data_2l50_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 2l50 _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 ' 5' ' ' TYR . . . . . 0.478 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 119.369 -0.348 . . . . 3.54 110.489 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.17 150.27 4.66 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 118.914 0.779 . . . . 2.3799999999999999 111.165 -173.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -59.26 -48.59 81.06 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 118.914 0.779 . . . . 2.5800000000000001 110.301 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.67 -47.69 14.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.594 1.558 . . . . 2.2200000000000002 110.941 172.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -74.26 -50.59 18.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 118.005 -0.997 . . . . 2.79 113.235 -173.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 mtmm -50.4 -37.89 39.96 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 120.931 1.696 . . . . 6.8300000000000001 113.48 164.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.39 -44.95 85.89 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.206 -1.378 . . . . 1.76 111.928 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.14 -36.14 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 CA-C-N 121.339 1.882 . . . . 1.77 110.59 172.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 52.6 mt -58.49 -51.99 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 O-C-N 121.179 -0.95 . . . . 1.8300000000000001 111.766 167.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.2 t -61.97 -39.58 84.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.486 1.515 . . . . 1.76 112.019 -177.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.3 mp -63.59 -43.12 97.87 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.798 0.839 . . . . 1.99 111.187 172.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 89.0 t -62.34 -41.94 93.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 118.126 -0.94 . . . . 1.8400000000000001 109.864 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -65.88 -41.68 91.28 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.111 1.323 . . . . 4.4900000000000002 114.111 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -16.52 20.28 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 120.336 -1.478 . . . . 3.5800000000000001 113.48 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -98.8 -61.59 1.35 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.767 1.627 . . . . 3.0800000000000001 113.189 166.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -60.46 -24.4 65.21 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.462 1.483 . . . . 3.0800000000000001 114.365 -171.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -46.32 -26.63 0.85 Allowed 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.094 1.316 . . . . 3.6400000000000001 113.815 167.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -91.18 7.12 42.24 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.808 2.043 . . . . 3.6699999999999999 115.99 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 N--CA 1.477 0.908 0 CA-C-N 119.711 1.141 . . . . 3.52 109.587 170.065 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 22.9 pt . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 121.812 0.815 . . . . 3.9199999999999999 111.441 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.6 t -78.74 134.7 37.04 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.571 -0.9 . . . . 3.1899999999999999 108.571 159.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -55.25 -25.11 31.45 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.154 -0.966 . . . . 3.3100000000000001 112.346 172.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.6 m -61.97 -12.98 21.17 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.013 1.486 . . . . 3.4900000000000002 115.013 169.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.6 m -82.96 -23.95 33.2 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.59 1.541 . . . . 2.2999999999999998 114.273 168.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -52.76 -53.96 40.63 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.298 1.863 . . . . 3.5699999999999998 111.9 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 27.0 ptt180 -61.66 -17.17 54.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.767 2.027 . . . . 3.3199999999999998 114.874 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -101.64 -52.42 3.22 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 126.969 2.108 . . . . 3.1800000000000002 109.179 -175.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 17.1 tmm? -53.75 -36.4 62.28 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.174 1.39 . . . . 2.1499999999999999 112.535 170.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 mt -54.12 -30.06 47.36 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.027 1.331 . . . . 1.8700000000000001 113.983 169.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.79 -3.69 58.05 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.416 1.007 . . . . 3.0899999999999999 112.869 176.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -56.5 2.19 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.691 1.596 . . . . 2.2000000000000002 112.346 170.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -90.46 -14.8 32.08 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.215 1.191 . . . . 3.0899999999999999 114.215 -167.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 mt -123.22 45.27 2.46 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.008 2.123 . . . . 2.5800000000000001 109.852 174.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -78.8 -21.01 48.4 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 115.343 1.608 . . . . 1.4199999999999999 115.343 -170.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.492 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 59.9 m-70 -83.43 -22.54 32.63 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 121.211 1.823 . . . . 2.25 114.364 -168.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 73.6 mtm -91.6 -12.92 32.93 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.88 1.672 . . . . 3.29 113.028 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.2 tp -99.06 117.87 34.54 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.768 1.227 . . . . 4.3700000000000001 111.016 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.7 m -159.19 -47.21 0.06 Allowed 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.569 -1.332 . . . . 5.3700000000000001 110.337 171.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -37.72 -26.78 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.631 2.772 . . . . 5.9400000000000004 115.471 160.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.7 m 71.79 -25.01 0.18 Allowed 'General case' 0 C--N 1.342 0.257 0 C-N-CA 128.758 2.823 . . . . 3.2400000000000002 112.73 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.26 -44.16 75.24 Favored Glycine 0 N--CA 1.473 1.103 0 C-N-CA 127.043 2.259 . . . . 2.1400000000000001 113.604 172.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -55.03 -42.74 73.0 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.498 1.119 . . . . 3.4199999999999999 111.774 171.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.7 ttt-85 -68.29 -40.07 81.91 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.534 -1.354 . . . . 6.21 113.249 170.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.1 mtmt -55.32 -29.94 59.26 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 122.16 2.255 . . . . 5.9299999999999997 112.58 173.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.42 -10.22 59.26 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.984 1.476 . . . . 2.2200000000000002 114.984 173.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -82.43 -52.89 6.45 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.796 1.238 . . . . 1.96 111.233 162.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.89 -33.47 74.27 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.316 0.647 . . . . 2.2400000000000002 112.655 -173.271 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -54.66 -32.0 58.5 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.719 1.007 . . . . 3.8399999999999999 113.719 169.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.0 mt -81.16 -40.19 24.34 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.618 1.167 . . . . 1.9299999999999999 110.735 -177.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.1 mm -48.7 -55.42 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.644 1.177 . . . . 2.23 110.66 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -66.01 -38.81 89.38 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.417 1.087 . . . . 2.5 113.174 -177.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -32.82 70.61 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.873 1.269 . . . . 4.1600000000000001 112.699 170.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.77 -41.57 14.0 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.142 0.977 . . . . 3.3900000000000001 110.593 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -47.95 -48.4 32.14 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.263 1.425 . . . . 2.73 112.111 172.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -53.51 -22.19 7.69 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.873 1.434 . . . . 2.7000000000000002 114.873 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.1 m-80 -113.81 5.62 16.39 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.066 1.346 . . . . 2.6800000000000002 113.539 -175.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 20.0 t60 -149.16 101.68 3.17 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 117.216 2.302 . . . . 4.1900000000000004 117.216 -153.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -20.75 3.24 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 128.239 2.616 . . . . 4.6200000000000001 115.341 170.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 95.87 22.9 19.39 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 118.84 -0.978 . . . . 3.5600000000000001 113.015 -166.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 58.9 mmt-85 -75.45 88.18 2.63 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.608 1.704 . . . . 5.1699999999999999 106.61 153.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.94 143.41 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 108.875 -0.787 . . . . 4.0899999999999999 108.875 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.87 149.2 39.04 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.526 1.131 . . . . 2.3599999999999999 108.538 174.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.36 -38.18 88.56 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 120.1 1.318 . . . . 3.1899999999999999 110.896 176.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.31 -22.83 63.64 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.924 2.09 . . . . 2.9399999999999999 113.905 175.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.96 -61.2 2.75 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.795 1.238 . . . . 3.6099999999999999 110.969 -178.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -56.0 -44.87 79.04 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.392 -0.818 . . . . 3.5499999999999998 112.789 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -61.72 -44.39 97.0 Favored 'General case' 0 C--O 1.239 0.552 0 O-C-N 121.844 -0.535 . . . . 0.68000000000000005 111.247 -178.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.59 -21.35 59.53 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 117.421 -1.276 . . . . 2.6499999999999999 112.804 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.8 mt -70.59 -44.22 67.78 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 120.176 1.353 . . . . 1.8999999999999999 112.662 165.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.8 mm -56.21 -37.3 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 CA-C-N 120.869 1.668 . . . . 1.76 112.452 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.28 -14.33 63.93 Favored Glycine 0 CA--C 1.533 1.208 0 CA-C-O 118.935 -0.925 . . . . 0.83999999999999997 114.502 178.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.02 -19.7 58.83 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-N 119.085 1.442 . . . . 0.81000000000000005 113.901 175.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.4 mp -90.76 -44.97 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 118.524 1.162 . . . . 2.2200000000000002 109.509 167.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.2 m -76.4 85.78 3.15 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 107.595 -1.261 . . . . 1.6599999999999999 107.595 -178.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -167.79 -75.82 0.04 OUTLIER Glycine 0 CA--C 1.532 1.098 0 CA-C-O 117.918 -1.49 . . . . 1.3500000000000001 113.993 -170.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -59.91 -44.48 30.05 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 123.134 2.556 . . . . 1.02 111.496 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.8 pt -76.27 -12.73 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 114.487 1.292 . . . . 2.6699999999999999 114.487 169.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.84 -49.09 77.86 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.788 1.631 . . . . 2.3300000000000001 112.599 -175.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.445 ' HZ2' ' CD ' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -55.03 -50.49 68.95 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.078 0.854 . . . . 4.1100000000000003 112.051 170.296 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.9 tt -53.75 -39.05 65.02 Favored 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 125.273 1.429 . . . . 2.54 112.399 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 80.4 mt -55.82 -63.22 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 119.623 1.101 . . . . 2.0099999999999998 111.068 171.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -53.49 -30.48 41.34 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 118.596 0.635 . . . . 1.8 112.63 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.445 ' CD ' ' HZ2' ' A' ' 92' ' ' LYS . 52.9 mt-10 -83.8 -21.03 32.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.45 1.1 . . . . 3.7999999999999998 112.54 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 -73.03 -38.15 66.63 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 120.938 -1.101 . . . . 2.29 112.13 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -69.34 0.85 4.44 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.303 1.441 . . . . 2.4500000000000002 112.798 175.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 . . . . . 0 N--CA 1.465 0.292 0 C-N-CA 126.229 1.811 . . . . 2.5299999999999998 111.32 179.02 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.492 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.642 0 CA-C-O 119.465 -0.302 . . . . 3.6699999999999999 110.522 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.53 150.18 7.13 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-N 118.958 0.799 . . . . 2.3399999999999999 111.371 -173.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -58.56 -49.21 78.27 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.458 1.026 . . . . 2.7599999999999998 110.238 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.38 -47.23 13.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.383 1.473 . . . . 2.1200000000000001 111.129 172.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -74.71 -50.83 16.07 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 117.928 -1.034 . . . . 2.7000000000000002 113.071 -172.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -50.11 -37.0 31.91 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 120.965 1.712 . . . . 6.3499999999999996 113.245 164.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.91 -41.63 82.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 117.438 -1.268 . . . . 1.79 112.777 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 75.2 t -62.36 -37.63 79.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-N 121.122 1.783 . . . . 1.8400000000000001 110.396 170.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 55.8 mt -56.29 -53.42 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 119.398 0.999 . . . . 1.8300000000000001 111.197 167.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 7.5 t -61.19 -39.66 83.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 125.206 1.402 . . . . 1.73 112.1 -176.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.5 mp -63.32 -44.49 94.81 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.128 0.876 . . . . 1.98 111.431 172.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 91.0 t -62.85 -40.54 89.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 118.056 -0.974 . . . . 1.8999999999999999 109.852 178.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -67.52 -42.95 81.93 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.676 1.125 . . . . 4.0999999999999996 113.286 172.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.61 -18.99 23.02 Favored 'General case' 0 CA--C 1.552 1.027 0 O-C-N 120.447 -1.408 . . . . 3.6099999999999999 113.561 176.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -95.17 -63.75 1.13 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.629 1.172 . . . . 3.25 113.083 166.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -59.06 -23.82 62.35 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.656 1.571 . . . . 3.0699999999999998 114.833 -170.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -46.89 -25.04 0.69 Allowed 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 120.259 1.391 . . . . 3.4300000000000002 113.884 167.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -93.23 8.78 38.85 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.298 2.239 . . . . 3.5899999999999999 116.153 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.1 m . . . . . 0 N--CA 1.477 0.899 0 CA-C-N 120.141 1.337 . . . . 3.3700000000000001 110.146 168.447 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 9.0 pt . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 121.816 0.817 . . . . 3.8799999999999999 111.475 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 32.5 t -84.99 138.35 32.52 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.7 -0.852 . . . . 2.8500000000000001 108.7 163.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -58.78 -20.01 45.88 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 120.56 -1.337 . . . . 3.2000000000000002 112.522 172.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 50.8 m -66.01 -16.76 64.18 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.237 1.415 . . . . 3.1200000000000001 114.586 167.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 61.6 m -80.41 -29.97 37.7 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.887 1.221 . . . . 1.5800000000000001 113.098 176.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -50.91 -57.37 8.68 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.651 1.114 . . . . 3.1699999999999999 112.146 176.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -61.86 -17.79 57.74 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.57 1.948 . . . . 3.6499999999999999 114.606 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -97.52 -54.76 3.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.962 2.105 . . . . 3.3300000000000001 109.07 -177.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -53.31 -35.67 60.4 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.803 1.641 . . . . 1.97 112.701 172.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.0 mt -54.31 -30.0 49.56 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.004 1.322 . . . . 1.8899999999999999 113.898 169.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.84 -3.43 56.78 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.611 1.096 . . . . 3.29 112.891 176.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.64 -57.27 2.05 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.874 1.67 . . . . 2.1600000000000001 112.341 171.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -89.67 -15.78 31.89 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.682 0.993 . . . . 3.0600000000000001 113.682 -167.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.3 mt -121.97 44.98 2.44 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.334 1.854 . . . . 2.5600000000000001 110.088 174.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -79.04 -23.67 44.13 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.344 1.609 . . . . 1.4099999999999999 115.344 -169.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . 0.478 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 64.6 m-70 -81.3 -22.36 38.63 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 121.115 1.78 . . . . 2.27 114.343 -167.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 73.2 mtm -91.19 -11.44 38.32 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.677 1.591 . . . . 3.3700000000000001 113.102 171.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 40.0 tp -100.74 120.15 39.66 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.15 1.38 . . . . 4.3300000000000001 111.091 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 23.0 m -160.94 -47.29 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 O-C-N 120.524 -1.36 . . . . 5.1399999999999997 110.019 170.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -37.72 -27.69 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 128.995 2.918 . . . . 5.9100000000000001 115.527 161.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 100.0 m 71.71 -22.17 0.2 Allowed 'General case' 0 C--N 1.342 0.245 0 C-N-CA 128.471 2.708 . . . . 3.3999999999999999 112.969 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.84 -44.89 92.01 Favored Glycine 0 N--CA 1.471 1.008 0 C-N-CA 126.181 1.848 . . . . 2.21 113.038 171.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -54.97 -41.34 71.05 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.823 1.249 . . . . 3.4300000000000002 111.731 172.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.6 ttt-85 -68.9 -41.36 78.36 Favored 'General case' 0 C--N 1.345 0.374 0 O-C-N 120.482 -1.387 . . . . 5.8300000000000001 113.121 170.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 19.5 mtmt -57.37 -26.49 61.1 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 121.65 2.023 . . . . 5.0700000000000003 112.885 173.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -74.54 -11.0 60.09 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.853 1.427 . . . . 2.1400000000000001 114.853 172.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.13 -56.89 3.52 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.307 1.443 . . . . 2.0499999999999998 111.145 163.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -34.18 69.0 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 113.255 0.835 . . . . 2.23 113.255 -176.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -55.14 -32.2 61.91 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 121.047 -1.033 . . . . 3.8399999999999999 113.765 170.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 17.3 mt -79.97 -40.09 28.73 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.254 1.022 . . . . 1.8799999999999999 110.416 -176.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 39.6 mm -49.74 -54.42 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.101 1.36 . . . . 2.29 110.733 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -65.4 -37.85 88.2 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.517 1.127 . . . . 2.5 113.369 -178.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -34.18 74.36 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.1 1.36 . . . . 4.1699999999999999 112.988 170.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.81 -41.0 18.01 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.738 1.215 . . . . 3.48 110.282 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -51.39 -46.61 62.88 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.676 1.59 . . . . 2.6499999999999999 112.817 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -55.22 -20.71 11.53 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.72 1.378 . . . . 2.6800000000000002 114.72 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -112.64 4.57 17.29 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.021 1.328 . . . . 2.71 113.459 -176.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -151.51 100.71 2.74 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 117.52 2.415 . . . . 4.2000000000000002 117.52 -153.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -19.08 4.1 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.49 2.716 . . . . 4.6399999999999997 115.793 171.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 96.15 26.46 11.25 Favored Glycine 0 CA--C 1.53 0.987 0 CA-C-O 118.915 -0.936 . . . . 3.73 113.087 -167.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 54.3 mmt-85 -78.63 84.16 4.76 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.35 1.575 . . . . 5.4100000000000001 107.154 154.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 11.3 mt -62.05 132.59 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 CA-C-N 118.795 0.725 . . . . 4.1600000000000001 109.324 -173.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 21.2 m -94.39 158.45 15.56 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 122.012 -0.43 . . . . 2.2000000000000002 110.33 166.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -63.63 -37.86 88.95 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 119.521 -0.872 . . . . 3.1699999999999999 111.474 166.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -21.63 65.53 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.652 1.581 . . . . 2.9399999999999999 114.266 177.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -62.43 -59.21 5.3 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.94 0.896 . . . . 3.4900000000000002 110.933 -177.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -54.51 -46.81 73.57 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.437 -0.789 . . . . 3.77 112.856 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 40.7 t-105 -61.96 -45.72 92.43 Favored 'General case' 0 C--O 1.239 0.542 0 O-C-N 121.998 -0.439 . . . . 0.68999999999999995 111.078 -176.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -72.27 -23.19 61.16 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-O 117.317 -1.325 . . . . 2.6800000000000002 112.436 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 30.9 mt -69.91 -42.61 73.14 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 120.081 1.31 . . . . 1.8999999999999999 112.844 167.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 32.2 mm -56.81 -36.08 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 CA-C-N 120.928 1.694 . . . . 1.74 112.497 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.21 -19.16 67.99 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.043 -0.865 . . . . 0.69999999999999996 114.077 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.84 -20.55 65.35 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-N 119.356 1.578 . . . . 0.84999999999999998 113.751 176.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.2 mp -90.86 -43.21 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 CA-C-N 118.497 1.149 . . . . 2.1099999999999999 110.25 168.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 4.1 m -78.13 83.89 4.38 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 107.86 -1.163 . . . . 1.6799999999999999 107.86 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -165.31 -74.55 0.03 OUTLIER Glycine 0 CA--C 1.533 1.16 0 CA-C-O 118.128 -1.373 . . . . 1.3899999999999999 114.109 -172.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.68 -42.55 38.34 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.158 2.572 . . . . 1.1299999999999999 111.617 176.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.9 pt -77.11 -12.4 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 114.93 1.456 . . . . 2.75 114.93 169.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.45 -52.17 66.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.75 1.614 . . . . 2.3199999999999998 112.605 -175.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . 0.44 ' HZ2' ' CD ' ' B' ' 199' ' ' GLU . 0.0 OUTLIER -53.66 -48.8 69.09 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.523 -0.736 . . . . 4.1100000000000003 112.284 170.441 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 10.2 tt -56.52 -37.64 70.73 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 125.318 1.447 . . . . 2.6800000000000002 111.979 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 75.4 mt -56.56 -61.94 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 119.648 1.113 . . . . 2.04 111.069 169.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -55.71 -28.42 55.6 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.726 -0.609 . . . . 1.8799999999999999 112.585 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . 0.44 ' CD ' ' HZ2' ' B' ' 195' ' ' LYS . 54.3 mt-10 -83.66 -23.76 31.63 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.33 1.052 . . . . 3.7000000000000002 112.35 178.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -76.55 -42.31 43.45 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.961 1.305 . . . . 2.25 112.838 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.58 3.01 6.79 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 122.659 1.219 . . . . 2.5699999999999998 112.548 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -120.23 -57.8 1.91 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 126.959 2.103 . . . . 3.1200000000000001 110.572 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.28 6.5 pt20 . . . . . 0 N--CA 1.476 0.85 0 C-N-CA 130.678 3.591 . . . . 6.0899999999999999 115.506 171.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.1 m-30 . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 111.809 0.3 . . . . 3.4700000000000002 111.809 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.2 t -76.26 134.83 39.69 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 108.184 -1.043 . . . . 2.9300000000000002 108.184 153.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -61.7 -28.66 69.57 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 122.683 0.393 . . . . 2.9300000000000002 110.638 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.03 -40.82 67.41 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.541 -0.725 . . . . 2.21 110.991 175.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -67.16 -61.3 1.99 Allowed 'General case' 0 C--N 1.337 0.058 0 O-C-N 121.909 -0.494 . . . . 2.5299999999999998 109.971 176.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.4 tptt -54.56 -26.94 35.33 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.416 1.265 . . . . 6.6299999999999999 114.416 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.7 -44.5 56.36 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.258 1.423 . . . . 2.0899999999999999 112.254 170.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 77.6 t -59.46 -39.53 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 120.547 1.521 . . . . 2.0800000000000001 110.025 168.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.5 mt -55.57 -50.42 66.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-O 117.689 -1.148 . . . . 1.77 110.516 170.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.7 t -58.43 -40.68 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-N 120.42 1.464 . . . . 1.6299999999999999 111.685 178.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.23 -51.53 65.86 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.071 0.85 . . . . 1.9299999999999999 111.914 173.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.1 t -60.63 -46.8 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.5 1.52 . . . . 2.04 112.883 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.42 ' HG2' ' HD1' ' B' ' 198' ' ' HIS . 8.0 tm-20 -66.6 -44.34 82.41 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 3.3300000000000001 110.111 -176.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.5 t30 -65.59 -34.66 78.76 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.085 0.772 . . . . 3.0 113.085 177.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -63.63 -50.65 68.51 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 120.556 -1.34 . . . . 3.3799999999999999 112.459 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -63.34 -42.91 98.98 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 117.491 -1.242 . . . . 3.8999999999999999 113.037 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.8 ptmt -63.0 -29.58 70.94 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.251 1.841 . . . . 5.5599999999999996 112.932 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -74.5 -49.23 22.96 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.043 -1.036 . . . . 3.6600000000000001 112.719 172.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.4 t . . . . . 0 N--CA 1.48 1.054 0 CA-C-N 119.371 0.987 . . . . 4.4199999999999999 112.903 -179.401 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.4 tt . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 108.236 -1.024 . . . . 3.54 108.236 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.4 m -118.05 156.3 28.84 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.402 -0.811 . . . . 3.2400000000000002 110.825 164.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.41 ' HZ3' ' HA ' ' A' ' 67' ' ' ASP . 11.8 ttpt -64.96 -19.27 65.88 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.237 -1.539 . . . . 3.0899999999999999 113.145 -177.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.1 p -65.34 -28.96 69.66 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.112 1.365 . . . . 2.1400000000000001 114.079 164.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.9 m -68.3 -30.78 69.86 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.383 -1.448 . . . . 1.3500000000000001 112.815 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -59.24 -57.86 11.16 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 120.579 1.536 . . . . 3.6000000000000001 111.819 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -55.27 -25.06 31.51 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.589 1.155 . . . . 2.8700000000000001 112.152 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.401 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 26.2 mt-10 -90.34 -50.13 6.14 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 125.774 1.629 . . . . 3.79 112.662 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 59.7 ttp -45.37 -45.57 12.64 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 124.12 0.968 . . . . 2.4100000000000001 110.243 162.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.1 mt -58.16 -50.49 73.33 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 125.264 1.426 . . . . 1.8799999999999999 112.732 171.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -20.86 59.78 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 120.427 1.467 . . . . 3.0 113.972 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 1.4 mppt? -87.41 -48.55 7.87 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.778 1.231 . . . . 3.8300000000000001 110.237 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -74.64 -74.35 0.2 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.267 1.027 . . . . 3.8199999999999998 111.615 171.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.0 mt -74.77 32.68 0.09 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.69 1.596 . . . . 3.6699999999999999 113.422 -173.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -59.25 -22.79 61.66 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.675 1.59 . . . . 1.6299999999999999 113.47 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -77.5 -62.55 1.62 Allowed 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.181 0.901 . . . . 2.23 110.279 -178.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 6.8 ptp -62.23 -29.87 70.7 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.583 1.083 . . . . 3.2000000000000002 113.362 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.83 -61.62 1.79 Allowed 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.88 -0.785 . . . . 4.3600000000000003 108.88 170.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.9 m 54.86 -82.52 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.09 1.756 . . . . 4.7400000000000002 111.45 -169.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.2 161.12 24.13 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.7 2.0 . . . . 3.7999999999999998 113.97 -174.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.5 m -69.61 -23.81 63.57 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.864 1.666 . . . . 3.27 112.377 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.86 -52.17 54.56 Favored Glycine 0 N--CA 1.471 1.018 0 C-N-CA 126.188 1.851 . . . . 1.73 112.784 173.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -61.5 -27.0 68.28 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.052 0.541 . . . . 3.6899999999999999 112.15 172.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 94.0 mtm-85 -80.74 -17.06 52.23 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 114.055 1.132 . . . . 7.2800000000000002 114.055 170.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt -66.45 -36.05 81.82 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 119.055 -2.278 . . . . 4.54 110.918 169.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.8 -18.74 34.84 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 114.859 1.429 . . . . 1.8500000000000001 114.859 163.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -80.72 -53.26 6.67 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 119.913 1.233 . . . . 2.0699999999999998 110.896 166.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -57.44 -40.55 78.69 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.889 1.275 . . . . 2.7999999999999998 113.873 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.0 ptmt -53.3 -30.96 41.62 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.905 0.882 . . . . 3.9399999999999999 112.542 178.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 30.1 mt -80.21 -44.69 19.31 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 118.503 -0.761 . . . . 1.8100000000000001 111.067 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 6.2 mm -54.47 -48.14 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-O 118.624 -0.703 . . . . 1.9399999999999999 109.783 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -67.36 -28.76 68.22 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 114.162 1.171 . . . . 2.3500000000000001 114.162 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -73.89 -35.52 64.7 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.307 0.643 . . . . 4.6900000000000004 112.244 171.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -72.43 -29.08 63.38 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.607 1.163 . . . . 3.48 111.515 172.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.41 ' HA ' ' HZ3' ' A' ' 35' ' ' LYS . 79.1 m-20 -62.52 -21.6 65.66 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.83 1.652 . . . . 3.4199999999999999 113.355 175.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.15 -10.91 59.78 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.748 1.388 . . . . 2.6299999999999999 114.748 169.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -135.99 -34.28 0.81 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 116.206 1.928 . . . . 2.3500000000000001 116.206 -166.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.6 m170 -115.64 115.89 27.16 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.421 -1.425 . . . . 4.46 112.105 -170.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -140.95 152.88 45.33 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.187 1.395 . . . . 5.8200000000000003 110.342 162.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.32 -41.6 0.78 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 127.309 2.385 . . . . 3.7799999999999998 114.353 -177.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.3 mmt85 -98.41 139.92 33.44 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 127.949 2.5 . . . . 6.5700000000000003 111.414 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 45.3 mm -101.41 145.67 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 N-CA-C 107.803 -1.184 . . . . 2.8599999999999999 107.803 148.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 t -101.62 152.93 20.22 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.518 -0.739 . . . . 1.8899999999999999 111.759 169.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -58.23 -51.66 68.84 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.021 0.828 . . . . 3.6699999999999999 110.96 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -61.06 -15.14 29.16 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.119 1.368 . . . . 3.21 112.565 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -64.51 -57.85 8.03 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.468 1.107 . . . . 3.0600000000000001 111.963 -174.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.56 -42.32 78.39 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.012 -1.68 . . . . 3.0499999999999998 111.768 176.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 30.0 t-105 -63.96 -48.54 76.06 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 119.247 -0.406 . . . . 0.68999999999999995 111.907 -177.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 36.5 p -62.59 -44.71 95.62 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.777 1.231 . . . . 3.4399999999999999 111.064 175.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 93.3 mt -62.28 -38.69 90.31 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 118.389 -0.815 . . . . 1.8500000000000001 112.852 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 23.3 mm -55.22 -46.67 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 CA-C-N 120.397 1.453 . . . . 2.0600000000000001 111.585 175.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.55 -29.23 72.93 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 119.458 -0.634 . . . . 0.82999999999999996 113.186 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.42 -22.82 77.79 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-O 118.676 -1.069 . . . . 0.60999999999999999 114.163 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.7 mp -88.24 -47.62 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 118.959 1.38 . . . . 2.0099999999999998 110.323 162.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.6 m -75.97 31.89 0.12 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 127.017 2.127 . . . . 2.4900000000000002 112.355 -169.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.61 -85.39 1.16 Allowed Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.3 0.952 . . . . 1.4299999999999999 111.095 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -64.23 -36.16 47.93 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.743 2.295 . . . . 1.8 111.974 -176.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.62 -17.63 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 113.579 0.955 . . . . 2.4900000000000002 113.579 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.54 -44.31 94.55 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 120.037 1.289 . . . . 2.21 112.846 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.25 -36.83 84.96 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 120.753 -1.217 . . . . 4.5499999999999998 110.643 176.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.32 -46.87 88.38 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.579 1.152 . . . . 2.1600000000000001 111.355 173.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 83.4 mt -50.69 -58.87 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.732 0.813 . . . . 2.25 110.636 172.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -63.92 -37.13 86.29 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.859 -0.526 . . . . 1.9099999999999999 112.251 -176.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.291 3.9 pt-20 -76.83 -13.99 59.95 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.041 -1.037 . . . . 3.0499999999999998 112.239 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.61 -29.18 30.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.44 1.896 . . . . 2.46 114.643 167.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -76.23 3.94 9.74 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 123.104 1.43 . . . . 2.4399999999999999 111.995 173.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 . . . . . 0 C--N 1.327 -0.413 0 C-N-CA 126.119 1.768 . . . . 3.0600000000000001 111.06 -175.906 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 111.783 0.29 . . . . 3.4500000000000002 111.783 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 7.2 t -75.4 137.64 41.17 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.093 -1.077 . . . . 2.8700000000000001 108.093 153.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -60.77 -28.67 68.9 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 122.568 0.347 . . . . 2.8599999999999999 110.573 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -39.25 69.42 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.131 -0.981 . . . . 2.4199999999999999 111.006 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -68.43 -60.67 2.27 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-O 119.319 -0.372 . . . . 2.5499999999999998 110.359 176.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -55.87 -27.24 50.83 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.341 1.237 . . . . 7.4800000000000004 114.341 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.14 -45.61 59.84 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.193 1.397 . . . . 2.1699999999999999 111.821 169.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 63.2 t -59.63 -39.62 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-N 120.892 1.678 . . . . 2.0499999999999998 110.442 170.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 10.6 mt -53.9 -50.21 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-O 117.605 -1.188 . . . . 1.8400000000000001 110.962 169.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 3.7 t -59.07 -43.23 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.072 1.306 . . . . 1.6299999999999999 111.671 178.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.3 mp -61.25 -45.76 93.2 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.06 0.845 . . . . 1.98 111.615 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 38.6 t -66.89 -44.38 88.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.262 1.425 . . . . 1.8700000000000001 113.141 178.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -66.43 -42.17 88.12 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.346 1.058 . . . . 3.1299999999999999 110.359 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -62.76 -31.02 71.89 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.625 0.972 . . . . 2.6299999999999999 113.625 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -71.32 -55.32 8.26 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.478 -1.389 . . . . 3.5899999999999999 111.949 176.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -61.13 -39.6 90.63 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.86 -1.15 . . . . 3.8799999999999999 113.191 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.65 -32.43 72.59 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.179 1.354 . . . . 5.4800000000000004 112.798 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -76.32 -43.62 40.41 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.76 -1.213 . . . . 3.6200000000000001 112.128 172.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 54.0 t . . . . . 0 N--CA 1.481 1.089 0 C-N-CA 124.462 1.105 . . . . 4.0999999999999996 113.173 -177.452 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.5 tt . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 107.476 -1.305 . . . . 3.54 107.476 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 66.8 m -142.96 161.36 38.32 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 119.769 -1.832 . . . . 3.5299999999999998 110.198 173.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . 0.437 ' HZ3' ' HA ' ' B' ' 170' ' ' ASP . 3.0 ttpt -68.4 -20.7 64.69 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 120.907 -1.12 . . . . 3.1699999999999999 112.806 -175.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 7.8 p -66.77 -31.25 71.77 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.262 1.425 . . . . 2.21 113.371 164.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 6.1 m -67.51 -35.56 79.34 Favored 'General case' 0 C--O 1.225 -0.229 0 O-C-N 120.574 -1.329 . . . . 1.3600000000000001 112.344 -177.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . 0.403 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 12.9 t80 -57.72 -58.8 6.74 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 119.606 1.094 . . . . 3.2200000000000002 111.434 -177.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -54.81 -26.07 32.44 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.618 1.167 . . . . 2.7000000000000002 112.373 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . 0.402 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 24.6 mt-10 -90.38 -50.88 5.71 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 125.739 1.616 . . . . 3.54 112.703 -174.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 63.5 ttp -45.53 -45.14 13.19 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 124.247 1.019 . . . . 2.6200000000000001 110.176 162.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 5.3 mt -57.85 -50.48 73.16 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 125.281 1.432 . . . . 1.8799999999999999 112.759 170.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -75.12 -21.96 58.51 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.411 1.46 . . . . 3.1299999999999999 114.139 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . 0.402 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 1.5 mppt? -85.02 -49.43 8.3 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.895 1.278 . . . . 3.52 110.068 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -74.27 -74.23 0.2 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.092 0.957 . . . . 3.8500000000000001 111.442 172.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 10.7 mt -75.11 33.61 0.1 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.946 1.699 . . . . 3.7599999999999998 113.214 -173.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -59.01 -23.03 61.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.641 1.576 . . . . 1.51 113.286 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -79.34 -61.42 2.01 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.226 0.921 . . . . 2.3100000000000001 110.687 -177.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 ptp -63.14 -26.73 68.95 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.564 1.075 . . . . 3.2200000000000002 113.848 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.08 -62.25 1.46 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.433 0.561 . . . . 4.3700000000000001 109.696 167.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 32.3 m 56.75 -82.13 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.894 1.678 . . . . 4.6399999999999997 111.995 -169.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -85.22 161.65 19.5 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.368 1.867 . . . . 3.8999999999999999 113.779 -170.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 44.0 m -70.8 -25.58 62.93 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 125.684 1.594 . . . . 3.52 112.164 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -59.01 -52.62 52.31 Favored Glycine 0 N--CA 1.469 0.889 0 C-N-CA 126.204 1.859 . . . . 1.95 112.345 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -60.34 -30.75 69.73 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.208 -0.584 . . . . 3.6299999999999999 112.101 172.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -77.61 -15.85 58.96 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 120.915 -1.116 . . . . 7.25 113.878 171.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -65.54 -35.55 81.19 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 119.165 -2.209 . . . . 4.7199999999999998 111.192 169.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.61 -19.23 36.87 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 114.901 1.445 . . . . 1.74 114.901 164.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.69 -54.0 6.28 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.632 1.106 . . . . 2.1000000000000001 111.151 166.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -57.57 -40.41 78.91 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.487 1.115 . . . . 2.71 113.468 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -52.9 -32.71 46.68 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.897 0.879 . . . . 3.9399999999999999 112.456 178.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 39.7 mt -77.98 -45.14 24.65 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 118.708 -0.663 . . . . 1.8500000000000001 110.543 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.81 -47.83 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.36 -0.829 . . . . 1.9199999999999999 109.575 -177.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -66.84 -32.38 73.62 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.961 1.097 . . . . 2.29 113.961 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -69.22 -35.71 76.47 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.555 -0.716 . . . . 4.7999999999999998 112.003 171.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -74.28 -28.54 61.24 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.829 1.252 . . . . 3.7200000000000002 111.943 173.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . 0.437 ' HA ' ' HZ3' ' B' ' 138' ' ' LYS . 79.2 m-20 -63.73 -21.48 66.42 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.095 1.758 . . . . 3.48 113.266 175.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.57 -9.42 59.78 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.701 1.371 . . . . 2.5899999999999999 114.701 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -136.34 -35.02 0.76 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.104 1.89 . . . . 2.3700000000000001 116.104 -166.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -109.54 108.1 18.44 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.47 -1.394 . . . . 4.3799999999999999 111.469 -174.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -121.04 156.32 32.45 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.32 1.448 . . . . 5.1399999999999997 110.309 161.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 64.91 -5.13 1.33 Allowed Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.647 1.594 . . . . 3.7200000000000002 116.615 169.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 21.8 mmt85 -144.88 152.73 40.69 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 126.902 2.081 . . . . 6.2699999999999996 111.214 -165.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 32.7 mm -122.01 150.18 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.528 1.531 . . . . 3.0499999999999998 107.44 156.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.3 t -108.03 157.97 17.79 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.632 0.773 . . . . 2.0299999999999998 112.226 169.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -60.01 -50.86 72.06 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 121.109 -0.995 . . . . 3.52 111.353 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -61.7 -16.24 47.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.796 1.238 . . . . 3.3900000000000001 112.637 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -64.2 -55.25 22.98 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.115 0.966 . . . . 3.0899999999999999 112.188 -175.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -57.22 -44.17 83.48 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.185 -1.572 . . . . 3.1800000000000002 111.848 175.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -64.01 -48.04 77.92 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 119.258 -0.401 . . . . 0.75 112.031 -177.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 40.3 p -62.42 -44.52 96.22 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.659 1.184 . . . . 3.4100000000000001 111.286 175.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . 0.403 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 93.8 mt -62.91 -38.8 92.42 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 118.164 -0.922 . . . . 1.76 112.599 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 23.2 mm -54.36 -46.18 69.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 CA-C-N 120.514 1.506 . . . . 2.0099999999999998 111.389 174.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.46 -29.1 72.4 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 118.569 0.622 . . . . 0.77000000000000002 113.035 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.69 -22.49 78.68 Favored Glycine 0 CA--C 1.535 1.304 0 CA-C-O 118.651 -1.083 . . . . 0.59999999999999998 114.264 178.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.6 mp -87.29 -48.67 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 CA-C-N 119.132 1.466 . . . . 2.0299999999999998 109.879 162.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 2.6 m -75.38 33.62 0.11 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 127.209 2.204 . . . . 2.4100000000000001 111.913 -169.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -88.95 -87.17 1.24 Allowed Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.54 1.067 . . . . 1.5 110.758 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.78 -34.29 62.08 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.799 2.333 . . . . 1.8 111.954 -175.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.29 -20.98 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 118.703 -0.665 . . . . 2.5 112.764 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.01 87.71 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 120.159 1.345 . . . . 2.0499999999999998 112.911 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.37 -36.83 83.5 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 120.825 -1.172 . . . . 4.5199999999999996 110.231 177.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -46.68 88.54 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.751 1.221 . . . . 2.4100000000000001 111.886 173.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 77.8 mt -50.61 -59.35 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.9 0.88 . . . . 2.25 110.515 171.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . 0.42 ' HD1' ' HG2' ' A' ' 17' ' ' GLU . 81.2 t60 -65.02 -35.95 82.83 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.935 -0.478 . . . . 1.8500000000000001 112.269 -175.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.264 4.3 pt-20 -77.08 -15.89 59.41 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 117.951 -1.024 . . . . 3.2799999999999998 112.139 177.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -81.12 -32.04 33.98 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.944 1.697 . . . . 2.3999999999999999 114.392 168.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -73.47 5.04 4.07 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 123.212 1.482 . . . . 2.3100000000000001 112.177 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -134.29 -61.46 0.78 Allowed 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 126.644 1.977 . . . . 3.0699999999999998 111.24 -174.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.919 0 C-N-CA 129.202 3.001 . . . . 4.7300000000000004 115.729 163.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 120.989 0.423 . . . . 3.7999999999999998 112.029 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 47.3 p -81.23 155.41 26.13 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 121.323 -0.861 . . . . 2.0299999999999998 109.792 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.426 ' CD ' ' HZ1' ' A' ' 10' ' ' LYS . 4.8 tp10 -61.21 -35.44 77.2 Favored 'General case' 0 C--O 1.223 -0.307 0 O-C-N 120.556 -1.34 . . . . 2.1299999999999999 111.641 -177.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -49.56 76.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.507 1.523 . . . . 1.99 110.9 174.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.416 ' CD ' ' HD1' ' B' ' 151' ' ' HIS . 50.3 tt0 -69.0 -53.06 22.55 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.217 1.807 . . . . 2.7400000000000002 111.27 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.426 ' HZ1' ' CD ' ' A' ' 7' ' ' GLU . 0.3 OUTLIER -52.07 -34.82 45.42 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.256 1.022 . . . . 6.29 110.356 169.908 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.04 -39.28 50.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 117.343 -1.313 . . . . 1.5900000000000001 112.992 177.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.7 t -52.72 -45.28 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 121.111 1.778 . . . . 1.72 110.719 164.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.06 -50.55 77.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.124 0.874 . . . . 1.8600000000000001 111.148 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.9 t -60.07 -34.95 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.63 1.172 . . . . 1.6000000000000001 112.702 176.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 mp -72.09 -43.03 65.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.8 1.182 . . . . 1.96 110.967 174.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.3 t -58.6 -45.7 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 125.456 1.503 . . . . 1.8700000000000001 110.99 173.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.418 ' CD ' ' HZ3' ' A' ' 21' ' ' LYS . 16.3 tm-20 -67.01 -45.76 76.57 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.867 1.267 . . . . 2.8999999999999999 111.12 174.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.403 ' HA ' ' CD ' ' A' ' 21' ' ' LYS 0.285 1.5 t30 -71.1 -7.32 45.69 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 115.143 1.534 . . . . 2.8300000000000001 115.143 179.244 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -82.82 -66.79 0.85 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.547 0.739 . . . . 3.6499999999999999 111.892 153.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -59.73 -32.8 70.88 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.266 1.21 . . . . 3.5299999999999998 114.266 -167.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.418 ' HZ3' ' CD ' ' A' ' 17' ' ' GLU . 10.0 ptmt -54.76 -25.88 30.68 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 119.723 -1.861 . . . . 3.21 113.756 175.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -82.66 -1.36 50.88 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.719 1.377 . . . . 4.0800000000000001 114.719 178.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.476 0.836 0 CA-C-N 119.84 1.2 . . . . 4.9900000000000002 109.808 170.016 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.4 tt . . . . . 0 CA--C 1.548 0.878 0 N-CA-C 109.374 -0.602 . . . . 3.79 109.374 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.1 t -102.43 141.98 34.37 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.916 -1.115 . . . . 3.8500000000000001 109.526 164.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.425 ' HZ2' ' CD2' ' A' ' 70' ' ' HIS . 73.4 mttt -61.24 -17.8 55.18 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.054 -1.654 . . . . 3.3199999999999998 113.026 174.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.3 t -61.4 -33.2 73.28 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.466 -0.771 . . . . 4.6200000000000001 112.578 166.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -65.02 -37.5 87.83 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 120.878 -1.138 . . . . 1.9299999999999999 113.185 -173.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 67.8 t80 -62.15 -54.75 36.61 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.887 1.221 . . . . 3.4700000000000002 111.899 176.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 24.7 ptt180 -65.64 -5.91 9.71 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.203 1.001 . . . . 2.8999999999999999 113.187 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.416 ' HB3' ' HE2' ' A' ' 44' ' ' LYS . 6.5 mt-10 -102.27 -43.1 5.8 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 126.657 1.983 . . . . 2.8199999999999998 111.851 176.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 4.9 ttm -52.65 -43.29 65.4 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.766 1.27 . . . . 2.3399999999999999 109.968 168.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.412 HD13 ' CZ ' ' A' ' 38' ' ' PHE . 72.1 mt -74.72 11.92 0.94 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 127.889 2.476 . . . . 2.2200000000000002 115.402 169.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -125.74 -11.38 6.67 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 125.7 1.6 . . . . 2.9500000000000002 113.023 166.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.416 ' HE2' ' HB3' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -109.0 -76.48 0.61 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.278 1.431 . . . . 2.2799999999999998 110.983 176.51 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.47 -19.67 66.03 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 120.624 1.557 . . . . 3.1000000000000001 115.026 -175.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.34 7.02 22.82 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.427 1.269 . . . . 2.6699999999999999 114.427 177.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -50.32 -33.9 21.82 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 117.615 2.45 . . . . 2.0699999999999998 117.615 -165.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -68.47 -25.12 64.82 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 121.102 1.773 . . . . 5.0099999999999998 112.214 -177.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.2 tpp -73.12 -7.44 51.37 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.673 1.989 . . . . 2.71 113.144 175.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.28 21.98 4.81 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.91 1.684 . . . . 4.9500000000000002 114.317 -162.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.5 t -35.31 -63.45 0.34 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 126.132 1.773 . . . . 4.6299999999999999 112.426 164.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -81.53 95.97 7.29 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 124.335 1.054 . . . . 6.1399999999999997 108.167 -177.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.2 p -51.42 -18.12 0.95 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.563 1.945 . . . . 4.5499999999999998 115.831 -168.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -58.02 -35.07 74.71 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.39 0.995 . . . . 2.1200000000000001 112.63 171.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 74.1 m-80 -59.22 -38.41 79.87 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 117.83 0.815 . . . . 4.4199999999999999 111.535 172.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.94 -27.15 49.27 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 114.498 1.296 . . . . 6.0199999999999996 114.498 172.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -59.56 -37.01 77.32 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 119.546 -1.971 . . . . 4.1200000000000001 110.971 167.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.3 -11.5 42.33 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.952 1.464 . . . . 2.1400000000000001 114.952 169.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.69 -52.03 6.38 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 120.502 1.501 . . . . 1.71 112.173 164.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.94 -35.32 76.42 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 118.951 0.796 . . . . 2.3100000000000001 112.268 -176.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -24.67 67.73 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.892 1.071 . . . . 5.6100000000000003 113.892 177.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.6 mt -73.98 -34.66 64.3 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 122.662 0.385 . . . . 1.8500000000000001 111.067 176.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 37.8 mm -58.27 -50.36 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.064 0.946 . . . . 2.1299999999999999 110.982 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.36 -38.18 89.29 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.016 0.926 . . . . 2.8500000000000001 112.645 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.38 -41.51 76.34 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.845 0.858 . . . . 4.0 112.12 166.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -73.16 -40.97 64.41 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 123.437 0.695 . . . . 4.2000000000000002 111.449 -178.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -49.57 -41.99 43.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.893 1.277 . . . . 2.5600000000000001 112.723 175.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.82 -16.93 62.5 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.322 1.601 . . . . 2.5699999999999998 115.322 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -133.68 16.04 3.97 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.505 1.298 . . . . 3.7999999999999998 114.505 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.425 ' CD2' ' HZ2' ' A' ' 35' ' ' LYS . 18.4 t60 -119.48 107.05 12.84 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.897 1.279 . . . . 5.71 110.97 -174.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -73.63 0.23 13.38 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.467 1.907 . . . . 5.54 114.223 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.59 -2.43 57.31 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 117.785 -1.564 . . . . 3.1400000000000001 113.54 -167.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.433 HH11 ' HG2' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -70.89 77.03 0.64 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.134 1.967 . . . . 5.7800000000000002 109.804 164.306 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -55.46 125.79 11.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 107.763 -1.199 . . . . 4.3600000000000003 107.763 164.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 36.9 t -137.31 146.19 44.34 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 124.792 1.237 . . . . 2.2200000000000002 111.594 -170.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -53.09 -41.6 65.09 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.95 1.093 . . . . 3.3700000000000001 113.95 -171.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -76.62 -14.46 59.98 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.837 0.681 . . . . 4.29 112.837 -174.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -64.84 -49.31 71.1 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.146 -0.971 . . . . 2.98 109.453 172.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -53.68 -48.18 69.73 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.261 -1.524 . . . . 3.1600000000000001 111.929 171.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 30.5 t-105 -68.97 -46.15 68.85 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.843 0.683 . . . . 0.60999999999999999 112.843 -171.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 57.5 p -59.73 -45.91 90.73 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.994 0.918 . . . . 3.29 111.027 171.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.422 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 91.6 mt -62.19 -38.46 89.21 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 117.31 -1.329 . . . . 1.73 112.323 -179.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.4 mm -50.61 -44.02 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 121.294 1.861 . . . . 1.77 111.261 174.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.11 -22.25 72.37 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 125.194 1.378 . . . . 0.56999999999999995 114.308 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.14 -20.0 70.66 Favored Glycine 0 CA--C 1.532 1.123 0 CA-C-N 118.362 1.081 . . . . 0.59999999999999998 113.193 173.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.5 mp -102.84 -45.49 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.768 1.227 . . . . 2.1600000000000001 110.947 163.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.0 m -80.88 72.45 7.88 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 127.108 2.163 . . . . 1.6899999999999999 108.635 -176.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -158.92 -71.23 0.02 OUTLIER Glycine 0 CA--C 1.525 0.664 0 C-N-CA 127.467 2.461 . . . . 1.0600000000000001 109.052 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -55.77 -55.63 2.84 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.187 2.591 . . . . 1.2 111.64 170.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.8 pt -74.27 -17.33 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 N-CA-C 114.361 1.245 . . . . 1.95 114.361 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.74 -48.06 82.43 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.91 0.777 . . . . 1.8100000000000001 112.435 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.69 -47.65 76.43 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.217 -0.927 . . . . 3.9500000000000002 111.804 169.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.4 tt -57.01 -45.35 83.13 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-O 117.722 -1.132 . . . . 2.8999999999999999 111.403 -178.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.9 mt -46.32 -55.28 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 120.009 1.277 . . . . 1.8300000000000001 111.005 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -61.73 -49.98 74.25 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.296 0.638 . . . . 1.8100000000000001 111.305 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -61.9 -36.58 81.73 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.891 0.876 . . . . 3.9399999999999999 111.434 -178.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -68.13 -44.6 75.73 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 127.896 2.478 . . . . 2.8100000000000001 111.314 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -68.2 -21.86 64.84 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.31 1.414 . . . . 3.3300000000000001 111.714 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.604 0 C-N-CA 123.535 0.734 . . . . 2.6200000000000001 111.191 172.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 . . . . . 0 N--CA 1.483 1.213 0 N-CA-C 114.039 1.126 . . . . 3.5299999999999998 114.039 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.1 p -81.83 155.23 25.49 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.866 -1.146 . . . . 2.25 109.754 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -61.05 -36.51 79.79 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 120.728 1.604 . . . . 2.3599999999999999 111.752 -178.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -47.86 84.43 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.615 1.166 . . . . 1.8799999999999999 110.34 176.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -68.15 -54.1 20.41 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.314 1.446 . . . . 2.98 111.645 -177.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -33.91 66.6 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.517 1.127 . . . . 5.4100000000000001 109.96 172.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.96 -45.33 67.63 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 117.199 -1.381 . . . . 1.6499999999999999 112.201 173.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 22.5 t -53.78 -41.27 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-N 121.154 1.797 . . . . 1.8600000000000001 110.625 170.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 70.3 mt -58.48 -54.47 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.405 -0.807 . . . . 2.0699999999999998 112.172 169.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.4 t -58.34 -42.88 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 119.405 1.002 . . . . 1.79 112.103 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.5 mp -64.87 -47.1 79.1 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.796 1.238 . . . . 2.1699999999999999 111.469 176.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.9 t -57.65 -48.22 83.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 123.292 0.637 . . . . 1.8300000000000001 110.514 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . 0.511 ' CD ' ' HZ3' ' B' ' 124' ' ' LYS . 8.8 tm-20 -62.89 -34.18 76.86 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.532 1.133 . . . . 2.8700000000000001 111.738 175.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.0 -25.24 64.41 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.596 1.544 . . . . 2.6499999999999999 113.465 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -72.63 -52.86 13.62 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.566 -0.708 . . . . 3.3300000000000001 111.0 165.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -65.9 -43.59 87.74 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.545 -0.722 . . . . 3.5699999999999998 112.923 -173.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . 0.511 ' HZ3' ' CD ' ' B' ' 120' ' ' GLU . 7.9 ptmt -58.01 -16.58 13.08 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 120.274 -1.516 . . . . 4.2699999999999996 114.941 177.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -89.61 -4.25 57.9 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.737 1.384 . . . . 4.4800000000000004 114.737 173.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.482 1.167 0 CA-C-N 120.593 1.542 . . . . 4.5999999999999996 111.188 173.099 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 16.6 tt . . . . . 0 CA--C 1.545 0.776 0 N-CA-C 106.991 -1.485 . . . . 3.8500000000000001 106.991 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 29.6 t -100.18 144.56 29.06 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 120.735 -1.228 . . . . 3.77 109.559 161.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -58.16 -21.64 47.91 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.572 -1.33 . . . . 3.1899999999999999 112.766 171.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 5.1 t -63.43 -34.46 77.8 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.756 0.65 . . . . 4.46 112.756 170.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 14.7 m -63.17 -42.66 99.44 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 120.942 -1.099 . . . . 2.0299999999999998 112.05 -175.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . 0.424 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 65.4 t80 -51.33 -60.28 3.3 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.174 0.99 . . . . 3.3500000000000001 112.061 171.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.1 ptt180 -65.18 -14.7 61.24 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.604 0.964 . . . . 3.04 113.604 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . 0.447 ' HB3' ' HE2' ' B' ' 147' ' ' LYS . 7.6 mt-10 -94.21 -40.91 9.76 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 126.467 1.907 . . . . 2.8399999999999999 113.398 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.3 tmm? -59.77 -39.44 84.86 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.342 -0.614 . . . . 2.4900000000000002 109.342 167.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.76 9.15 0.2 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.275 2.23 . . . . 2.8999999999999999 115.352 164.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -128.6 -21.84 3.39 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.465 1.283 . . . . 3.0800000000000001 114.465 168.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . 0.447 ' HE2' ' HB3' ' B' ' 143' ' ' GLU . 0.0 OUTLIER -108.19 -42.44 4.63 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.758 1.223 . . . . 2.3700000000000001 113.56 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -106.77 -26.07 11.45 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.723 2.009 . . . . 2.9100000000000001 112.67 -163.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.93 18.8 20.84 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.881 1.672 . . . . 2.6400000000000001 111.996 167.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -59.5 -35.46 74.18 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 116.04 1.867 . . . . 2.3599999999999999 116.04 -159.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . 0.416 ' HD1' ' CD ' ' A' ' 9' ' ' GLU . 1.5 m80 -60.95 -45.48 94.55 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 120.002 1.273 . . . . 4.8899999999999997 111.159 -178.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 tpp -59.8 -17.03 32.6 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.042 1.737 . . . . 2.7799999999999998 113.174 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.07 26.25 9.78 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.836 2.055 . . . . 5.2999999999999998 112.686 -174.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 43.4 t -64.85 -16.69 63.48 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.161 1.541 . . . . 4.8600000000000003 115.161 177.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -100.98 125.41 47.58 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 120.019 1.281 . . . . 5.0899999999999999 108.354 161.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 58.0 p -64.43 -21.51 66.67 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.802 1.038 . . . . 4.3799999999999999 113.802 -173.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -61.64 -37.1 93.66 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-N 119.646 1.112 . . . . 2.29 111.89 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -62.66 -38.71 91.41 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 119.01 -0.519 . . . . 4.3799999999999999 111.688 174.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -77.19 -27.45 53.6 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 119.739 1.154 . . . . 5.7599999999999998 114.018 173.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -57.68 -40.29 79.07 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 119.601 -1.937 . . . . 4.21 111.473 166.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.06 -12.9 43.06 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.31 1.596 . . . . 2.3700000000000001 115.31 170.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.53 -50.04 8.65 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 120.368 1.44 . . . . 1.8799999999999999 112.337 165.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.55 -35.1 76.81 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.617 0.644 . . . . 2.1600000000000001 112.173 -177.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.8 -23.11 67.08 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 114.13 1.159 . . . . 5.5700000000000003 114.13 176.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 22.1 mt -74.13 -33.85 63.69 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 122.579 0.352 . . . . 1.8799999999999999 111.46 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 29.1 mm -59.71 -50.08 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 124.349 1.06 . . . . 1.97 110.527 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -65.52 -36.04 82.65 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.471 0.653 . . . . 2.6800000000000002 112.671 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -57.14 -43.46 82.47 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.672 0.789 . . . . 4.1600000000000001 112.232 165.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 4.9 tp -69.79 -42.23 74.02 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 118.485 0.584 . . . . 4.2800000000000002 111.287 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -51.5 -40.83 60.33 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.196 1.398 . . . . 2.6699999999999999 112.173 174.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.46 -15.25 62.44 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.914 1.82 . . . . 2.5299999999999998 115.914 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -135.08 14.71 3.55 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 115.199 1.555 . . . . 4.04 115.199 -175.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -122.68 110.0 14.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.934 1.294 . . . . 5.75 110.908 -171.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -73.47 -27.04 61.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.876 2.07 . . . . 5.46 113.634 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 125.36 -8.33 7.91 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-O 117.953 -1.471 . . . . 3.6200000000000001 113.728 -169.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -68.51 76.7 0.28 Allowed 'General case' 0 C--N 1.346 0.421 0 CA-C-N 120.411 2.106 . . . . 8.8499999999999996 109.522 157.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.73 137.4 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 107.922 -1.14 . . . . 4.5999999999999996 107.922 164.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 16.9 t -142.24 147.25 36.18 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.623 0.601 . . . . 2.3399999999999999 112.623 -173.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -48.9 -48.53 42.38 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.793 1.237 . . . . 3.2999999999999998 113.751 -172.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -74.36 -12.71 60.6 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 113.636 0.976 . . . . 4.3899999999999997 113.636 -174.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -60.96 -51.45 69.21 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.135 -0.978 . . . . 3.0600000000000001 109.399 171.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -52.29 -49.13 64.75 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.746 -1.221 . . . . 3.1899999999999999 112.494 172.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 26.7 t-105 -69.1 -45.13 71.02 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 118.576 -0.726 . . . . 0.71999999999999997 112.457 -172.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 46.3 p -59.34 -45.36 91.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.458 1.103 . . . . 3.25 110.808 170.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . 0.424 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 58.7 mt -59.06 -40.91 86.61 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 117.36 -1.305 . . . . 1.6399999999999999 112.584 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 22.5 mm -53.69 -40.8 44.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 121.382 1.901 . . . . 1.76 112.074 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -65.18 -25.84 71.25 Favored Glycine 0 N--CA 1.473 1.107 0 C-N-CA 124.407 1.004 . . . . 0.56000000000000005 113.545 177.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -62.25 -19.68 59.86 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 118.391 1.095 . . . . 0.71999999999999997 113.986 173.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.2 mp -110.27 -36.78 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 CA-C-N 118.449 1.125 . . . . 2.1299999999999999 111.733 166.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 22.7 m -82.32 73.79 9.33 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 125.948 1.699 . . . . 1.71 108.04 -178.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -161.85 -67.78 0.02 OUTLIER Glycine 0 CA--C 1.529 0.947 0 C-N-CA 127.283 2.373 . . . . 1.1100000000000001 110.026 -175.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -58.27 -61.28 0.28 Allowed 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.307 2.671 . . . . 1.0800000000000001 111.178 168.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.9 pt -66.48 -28.09 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 CA-C-N 119.242 0.928 . . . . 2.2000000000000002 112.975 177.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -56.57 -46.01 80.98 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.889 0.768 . . . . 1.8999999999999999 112.826 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -65.98 -30.17 70.69 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.171 -0.955 . . . . 5.9800000000000004 113.488 172.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 35.4 mt -68.14 -41.02 82.26 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.589 1.086 . . . . 6.1100000000000003 111.943 176.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 70.5 mt -53.53 -42.88 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 119.278 0.944 . . . . 1.8899999999999999 110.805 171.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -61.98 -47.77 83.33 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 117.835 -1.078 . . . . 2.3500000000000001 111.93 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -52.57 -49.32 65.2 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.368 1.067 . . . . 3.4700000000000002 110.666 171.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -46.52 66.55 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.036 1.334 . . . . 5.7599999999999998 112.761 -177.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -77.8 -4.7 47.78 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.614 0.643 . . . . 2.7000000000000002 112.527 -177.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -98.82 -49.04 4.7 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.061 0.945 . . . . 3.8199999999999998 111.261 170.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 CA--C 1.535 0.377 0 C-N-CA 128.019 2.527 . . . . 6.3099999999999996 112.967 179.913 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 118.652 -0.69 . . . . 3.77 111.916 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.9 p -61.84 156.58 20.27 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 118.967 0.803 . . . . 1.99 110.403 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.421 ' CD ' ' HZ3' ' A' ' 10' ' ' LYS . 16.6 tp10 -63.19 -27.78 69.6 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.047 0.758 . . . . 2.1600000000000001 113.047 -178.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt -69.36 -47.87 63.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.728 1.211 . . . . 2.5899999999999999 109.984 172.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -49.74 62.8 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 122.837 0.455 . . . . 2.5499999999999998 111.367 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.421 ' HZ3' ' CD ' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -48.94 -36.49 17.48 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.729 1.612 . . . . 6.4699999999999998 111.124 172.539 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.19 -21.33 56.6 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.184 -1.572 . . . . 2.0099999999999998 113.716 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.1 t -60.89 -38.03 78.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 CA-C-N 121.143 1.792 . . . . 2.3100000000000001 110.066 169.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.5 mt -56.7 -56.95 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-O 118.825 -0.607 . . . . 2.3700000000000001 109.967 168.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 99.5 t -54.34 -40.28 47.66 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 124.642 1.177 . . . . 1.9299999999999999 112.933 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -72.62 -39.02 67.6 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.268 -0.895 . . . . 2.1099999999999999 112.432 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.1 t -64.55 -40.41 88.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.067 0.947 . . . . 1.98 111.53 172.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -55.15 -54.21 46.16 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.38 1.072 . . . . 2.6899999999999999 110.094 174.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -56.48 -30.16 62.6 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 115.479 1.659 . . . . 3.25 115.479 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -73.59 -57.85 3.71 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.532 0.606 . . . . 3.7599999999999998 112.171 173.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -68.38 -17.33 64.21 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.311 1.226 . . . . 3.02 114.311 -171.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -44.27 -32.64 1.34 Allowed 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 120.546 1.521 . . . . 3.8199999999999998 113.215 171.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -93.4 8.02 42.17 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.07 1.748 . . . . 3.4700000000000002 114.033 -174.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.476 0.863 0 C-N-CA 125.398 1.479 . . . . 3.27 110.27 172.363 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 12.0 pt . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 120.269 0.08 . . . . 3.77 111.085 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.4 t -76.41 138.63 40.5 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 120.504 -1.372 . . . . 4.0199999999999996 111.954 177.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.9 mtpt -72.51 -6.74 45.96 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.098 -0.955 . . . . 4.1299999999999999 113.309 169.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.1 p -80.3 -48.31 13.2 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.294 0.952 . . . . 3.8999999999999999 111.056 156.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.6 m -59.06 -35.6 73.61 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 117.234 -1.365 . . . . 1.7 113.751 -167.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -60.16 -60.38 3.91 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 121.058 1.754 . . . . 3.8100000000000001 112.07 172.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -63.78 -23.87 67.54 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.872 0.693 . . . . 3.4500000000000002 112.872 -178.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -71.45 -49.0 45.77 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.121 1.368 . . . . 3.23 112.774 169.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 8.4 tmm? -59.37 -35.88 74.73 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 126.125 1.77 . . . . 1.74 111.804 -174.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.2 mt -59.07 -20.24 51.58 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.679 1.592 . . . . 2.02 114.695 168.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -1.15 18.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.789 1.177 . . . . 2.79 113.228 175.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.62 -37.14 7.23 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.144 1.378 . . . . 2.77 112.839 172.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -96.79 -72.2 0.65 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.93 1.692 . . . . 4.5 109.637 169.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.95 20.7 0.06 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 125.944 1.698 . . . . 2.4300000000000002 114.769 -171.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -66.63 -23.01 66.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 128.964 2.906 . . . . 1.45 116.2 -164.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.478 ' H ' ' CD2' ' A' ' 48' ' ' HIS . 0.3 OUTLIER -76.42 -54.84 6.16 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.417 1.008 . . . . 2.0099999999999998 109.608 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.4 tpp -47.7 -42.91 26.07 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.485 2.314 . . . . 2.79 113.797 162.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -109.22 34.72 3.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.729 1.212 . . . . 5.3600000000000003 113.076 -175.262 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.4 p -62.88 -39.49 94.63 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 114.942 -1.026 . . . . 6.9699999999999998 110.942 167.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -68.98 137.43 53.72 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.286 1.434 . . . . 4.6799999999999997 112.991 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.8 m -69.35 -32.79 72.08 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.954 1.701 . . . . 2.8599999999999999 112.327 175.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.85 -50.53 57.82 Favored Glycine 0 N--CA 1.47 0.922 0 CA-C-N 119.568 1.076 . . . . 1.76 111.963 178.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -59.4 -29.29 67.63 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.971 -0.723 . . . . 3.77 112.35 172.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -80.02 -31.85 39.59 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.679 0.992 . . . . 6.9900000000000002 113.679 174.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 mmmt -60.67 -35.88 77.34 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 119.249 -2.157 . . . . 4.5599999999999996 111.872 169.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.88 -29.89 56.73 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 117.25 -1.357 . . . . 1.95 114.076 167.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.65 -41.32 79.53 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 120.514 1.506 . . . . 1.79 113.157 167.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -63.38 -35.31 79.99 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 125.845 1.658 . . . . 3.46 112.606 -177.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -47.82 -43.04 27.64 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.628 1.171 . . . . 4.0099999999999998 112.835 168.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.4 mt -70.12 -38.48 75.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.601 -1.182 . . . . 2.0899999999999999 110.35 -174.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.3 mm -63.89 -42.12 94.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 122.988 0.515 . . . . 2.0099999999999998 111.518 -176.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -72.13 -37.4 69.46 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 123.319 0.648 . . . . 2.5099999999999998 111.583 176.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -67.16 -30.68 70.72 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.183 -0.948 . . . . 4.6799999999999997 112.383 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 28.2 tp -69.14 -24.3 64.07 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 120.895 -1.128 . . . . 4.6399999999999997 112.394 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.51 -25.96 28.7 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.143 1.777 . . . . 4.8899999999999997 113.731 171.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -85.47 -4.43 59.16 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.817 1.414 . . . . 4.1600000000000001 114.817 174.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -127.59 -30.22 2.58 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 114.372 1.249 . . . . 3.9399999999999999 114.372 -171.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -90.97 57.97 3.65 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.943 1.297 . . . . 6.5999999999999996 112.528 -163.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -87.47 84.23 7.18 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.361 1.065 . . . . 5.6799999999999997 111.543 177.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 74.0 -28.6 0.95 Allowed Glycine 0 N--CA 1.476 1.309 0 C-N-CA 125.831 1.681 . . . . 5.0099999999999998 115.863 167.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 -89.14 152.15 21.79 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 126.229 1.812 . . . . 8.7799999999999994 110.329 169.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.4 mp -127.39 138.48 54.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 106.0 -1.852 . . . . 5.3600000000000003 106.0 170.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.0 152.28 20.38 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.579 0.228 . . . . 2.9100000000000001 111.219 173.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -61.62 -48.67 79.84 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 123.408 1.575 . . . . 3.3700000000000001 109.558 167.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.2 -16.5 64.34 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.95 2.9 . . . . 2.8999999999999999 114.308 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.2 tt0 -59.85 -55.04 39.07 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.444 1.498 . . . . 2.9199999999999999 110.256 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -59.49 -38.3 80.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.367 -0.833 . . . . 3.5899999999999999 111.813 177.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 22.2 t-105 -61.96 -49.98 73.94 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 118.818 -0.611 . . . . 0.59999999999999998 111.084 177.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.3 t -71.63 -15.6 62.25 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 113.924 1.083 . . . . 2.7799999999999998 113.924 176.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.3 mt -74.34 -47.53 33.81 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 120.009 1.277 . . . . 1.9099999999999999 111.861 164.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.8 mm -51.31 -40.66 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-N 120.895 1.679 . . . . 1.99 113.77 -174.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.11 -22.62 60.81 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 118.767 0.712 . . . . 0.71999999999999997 113.641 177.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.41 -16.76 80.43 Favored Glycine 0 CA--C 1.534 1.234 0 O-C-N 121.181 -1.187 . . . . 0.68999999999999995 113.882 175.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.8 mp -95.62 -46.36 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 CA-C-N 118.382 1.091 . . . . 2.0099999999999998 110.871 161.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 28.8 m -84.78 83.55 8.0 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 126.128 1.771 . . . . 1.8700000000000001 108.54 -171.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -167.45 -64.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.961 0 C-N-CA 125.428 1.49 . . . . 1.3600000000000001 111.932 -171.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -58.19 -53.17 4.5 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.2 2.6 . . . . 1.52 111.293 165.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.9 pt -61.22 -24.61 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 113.115 0.783 . . . . 2.9300000000000002 113.115 174.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.39 -53.42 52.64 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.412 1.006 . . . . 1.8799999999999999 112.389 -175.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -61.08 -34.17 74.51 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.621 -1.299 . . . . 3.6800000000000002 112.662 175.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.6 tt -66.24 -44.47 83.67 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.211 1.004 . . . . 2.2000000000000002 111.23 -178.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 56.0 mt -49.32 -59.91 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.63 0.772 . . . . 2.21 109.734 166.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -61.95 -28.52 69.6 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.014 -1.054 . . . . 1.9399999999999999 113.409 -173.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.348 3.2 pt-20 -87.21 -11.43 49.84 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 121.277 -0.89 . . . . 3.1400000000000001 113.095 175.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.507 ' C ' ' H ' ' A' ' 99' ' ' GLN . 0.6 OUTLIER -81.86 -40.73 22.02 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.433 1.893 . . . . 2.1899999999999999 113.935 169.553 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -66.43 7.66 0.31 Allowed 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 123.501 1.62 . . . . 2.4500000000000002 112.889 174.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.507 ' H ' ' C ' ' A' ' 97' ' ' GLN . 16.0 mm-40 . . . . . 0 C--N 1.326 -0.426 0 C-N-CA 126.891 2.076 . . . . 2.1499999999999999 109.704 -175.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 5.9 m-30 . . . . . 0 N--CA 1.479 0.992 0 N-CA-C 112.237 0.458 . . . . 3.7999999999999998 112.237 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 5.4 p -65.52 166.78 9.85 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 118.436 0.562 . . . . 1.8999999999999999 111.878 -176.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -62.19 -37.9 87.07 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.379 -0.826 . . . . 2.9300000000000002 111.957 173.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.38 -51.49 65.66 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.278 0.631 . . . . 2.3900000000000001 109.724 173.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.79 -54.8 10.29 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.26 -0.274 . . . . 2.4700000000000002 110.26 -169.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . 0.257 0.7 OUTLIER -60.49 -23.41 64.48 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 122.057 -0.402 . . . . 5.29 111.621 177.06 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.24 -25.03 61.47 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 119.34 -2.1 . . . . 2.4100000000000001 114.324 169.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 34.3 t -61.58 -35.38 66.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 121.297 1.862 . . . . 2.3399999999999999 110.879 170.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 71.2 mt -54.52 -55.8 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 121.383 -0.823 . . . . 2.1899999999999999 110.713 165.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 78.9 t -56.26 -41.45 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.951 1.3 . . . . 2.1200000000000001 112.474 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.71 -38.77 87.41 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.369 0.668 . . . . 2.1400000000000001 112.287 176.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 71.7 t -71.39 -39.32 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.709 0.804 . . . . 2.02 111.494 177.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -51.04 -55.89 15.24 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.726 1.21 . . . . 2.71 109.605 171.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -50.52 -40.77 52.43 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.9 1.444 . . . . 3.3500000000000001 114.9 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -66.44 -57.53 7.18 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.705 0.684 . . . . 3.73 111.79 178.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -66.05 -20.52 66.2 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.617 0.969 . . . . 3.0299999999999998 113.617 -171.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -45.88 -32.68 2.77 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 120.216 1.371 . . . . 3.9900000000000002 113.526 170.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -93.89 8.37 41.51 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.242 1.417 . . . . 3.2999999999999998 113.916 -174.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.0 m . . . . . 0 N--CA 1.479 1.02 0 C-N-CA 125.742 1.617 . . . . 3.2799999999999998 110.033 169.797 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 22.0 pt . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 108.441 -0.948 . . . . 3.5800000000000001 108.441 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 30.3 t -73.18 138.14 45.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 117.637 -1.625 . . . . 3.5699999999999998 111.209 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mtpt -63.94 -13.93 49.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.641 0.776 . . . . 4.2199999999999998 112.934 167.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 97.2 p -77.38 -27.73 52.6 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.02 -1.05 . . . . 3.0699999999999998 113.233 163.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.3 m -78.55 -39.56 37.44 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.937 1.244 . . . . 1.51 113.118 -173.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -55.51 -55.9 26.47 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 120.366 1.439 . . . . 3.6899999999999999 111.727 -177.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -55.49 -19.45 9.71 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.402 1.481 . . . . 3.0099999999999998 113.805 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -100.36 -46.23 5.32 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 125.332 1.453 . . . . 3.25 112.496 -174.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -51.15 -41.95 60.47 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.944 1.297 . . . . 1.74 110.646 165.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.8 mt -59.82 -17.25 34.62 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 116.098 1.888 . . . . 1.74 116.098 168.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -114.77 -5.0 12.65 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 120.679 1.581 . . . . 2.6699999999999999 113.955 174.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -107.18 -36.02 6.67 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.605 1.562 . . . . 4.1299999999999999 113.23 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -87.92 -72.65 0.52 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.307 1.443 . . . . 4.3499999999999996 108.617 163.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.58 22.65 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.794 2.038 . . . . 2.5800000000000001 114.918 -171.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -66.11 -25.67 67.1 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.376 2.67 . . . . 1.54 116.622 -166.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . 0.521 ' H ' ' CD2' ' B' ' 151' ' ' HIS . 0.6 OUTLIER -73.17 -55.87 5.87 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.936 1.244 . . . . 2.0 109.805 -177.639 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 27.2 tpp -47.77 -49.79 27.5 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.704 2.002 . . . . 3.1800000000000002 112.891 163.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 1.4 mt -99.7 35.37 2.02 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.667 1.187 . . . . 5.4000000000000004 113.147 -174.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 13.5 p -65.51 -36.77 84.82 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.785 -1.098 . . . . 6.7000000000000002 111.183 167.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -71.89 135.7 46.64 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.102 1.361 . . . . 4.96 113.062 174.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 96.9 m -67.07 -33.15 74.88 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.877 1.671 . . . . 3.2200000000000002 112.533 174.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -64.29 -52.56 42.84 Favored Glycine 0 N--CA 1.471 0.992 0 CA-C-N 119.98 1.264 . . . . 1.8999999999999999 112.152 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -58.4 -29.87 66.39 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.013 0.925 . . . . 3.8500000000000001 112.446 173.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 57.7 mtm-85 -78.64 -31.52 46.9 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.779 1.4 . . . . 7.0999999999999996 114.779 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -60.93 -37.09 81.11 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 119.879 -1.763 . . . . 4.6799999999999997 111.68 168.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -53.22 -32.14 46.75 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-O 117.581 -1.2 . . . . 1.8799999999999999 113.795 168.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.6 -44.42 74.36 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.869 1.268 . . . . 2.0699999999999998 113.152 169.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -62.96 -36.32 83.08 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.754 2.022 . . . . 3.5899999999999999 112.842 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -52.53 -36.21 55.05 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.916 -1.115 . . . . 3.8100000000000001 112.336 171.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 9.8 mt -73.36 -36.14 66.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.949 -0.569 . . . . 2.1400000000000001 111.247 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.0 mm -58.86 -44.8 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 123.797 0.839 . . . . 2.04 111.54 177.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -76.04 -33.11 59.62 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 123.168 0.587 . . . . 2.1699999999999999 112.014 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -67.29 -32.4 73.36 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.341 -0.85 . . . . 4.5499999999999998 112.364 170.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 22.2 tp -67.73 -23.85 65.31 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.014 -1.054 . . . . 4.4100000000000001 112.123 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.2 -32.78 49.77 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.537 1.535 . . . . 5.0300000000000002 113.843 170.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.09 -7.4 58.86 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.645 1.35 . . . . 4.2199999999999998 114.645 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -127.31 -26.44 3.07 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 115.091 1.515 . . . . 3.7000000000000002 115.091 -168.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 32.7 t60 -100.21 66.75 1.33 Allowed 'General case' 0 CA--C 1.548 0.889 0 O-C-N 120.885 -1.135 . . . . 6.1799999999999997 112.817 -163.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -81.41 69.58 8.08 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.847 1.308 . . . . 5.8499999999999996 111.898 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.96 -24.54 1.04 Allowed Glycine 0 CA--C 1.536 1.399 0 C-N-CA 125.858 1.694 . . . . 4.3399999999999999 115.694 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 16.9 mmt85 -79.97 142.71 34.8 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.752 1.221 . . . . 8.5899999999999999 110.494 169.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 3.4 mp -111.27 145.53 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 N-CA-C 106.547 -1.649 . . . . 5.6299999999999999 106.547 165.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.79 150.74 25.28 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 122.907 0.483 . . . . 2.8999999999999999 109.816 168.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -59.61 -49.6 77.13 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 123.569 1.652 . . . . 3.3799999999999999 109.559 169.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.44 -16.91 26.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 129.821 3.248 . . . . 3.1600000000000001 114.687 176.368 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -59.36 -57.51 12.67 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.243 1.417 . . . . 3.0299999999999998 110.649 175.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -57.62 -40.2 78.61 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.444 -0.785 . . . . 3.6200000000000001 112.331 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.9 t-105 -60.85 -51.47 69.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.229 -0.891 . . . . 0.72999999999999998 111.351 174.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 7.1 t -69.43 -18.58 63.75 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.982 1.264 . . . . 2.6899999999999999 113.701 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 97.3 mt -68.87 -51.27 42.12 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 120.092 1.314 . . . . 1.72 110.978 164.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 30.1 mm -52.0 -37.29 21.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 CA-C-N 121.035 1.743 . . . . 1.8899999999999999 114.336 -173.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.33 -22.07 65.02 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 119.309 0.959 . . . . 0.67000000000000004 114.238 175.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.79 -18.22 78.72 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 118.63 1.215 . . . . 0.69999999999999996 113.527 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.2 mp -101.48 -41.54 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 118.385 1.093 . . . . 2.0899999999999999 110.681 166.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 24.7 m -82.11 84.93 6.87 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.272 1.429 . . . . 1.97 108.84 -177.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -171.88 -66.17 0.04 OUTLIER Glycine 0 CA--C 1.528 0.896 0 CA-C-O 118.258 -1.301 . . . . 1.54 112.194 -170.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -58.36 -54.19 3.3 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.066 2.511 . . . . 1.55 110.95 167.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 35.5 pt -64.95 -21.04 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 113.387 0.884 . . . . 2.8700000000000001 113.387 175.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.01 -55.91 24.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.493 1.042 . . . . 1.8400000000000001 112.643 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -59.56 -34.21 72.4 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.518 -1.364 . . . . 3.79 112.558 175.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.3 tt -66.14 -43.58 86.66 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 124.126 0.97 . . . . 2.29 110.725 -177.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 48.4 mt -51.69 -58.26 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.97 0.908 . . . . 2.3199999999999998 109.631 167.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 80.7 t60 -70.79 -5.57 31.22 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 114.668 1.358 . . . . 1.8899999999999999 114.668 -173.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.339 3.5 pt-20 -104.01 -15.06 15.71 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.954 1.302 . . . . 3.0600000000000001 112.842 167.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . 0.522 ' C ' ' H ' ' B' ' 202' ' ' GLN . 0.2 OUTLIER -80.08 -39.55 29.43 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 126.434 1.894 . . . . 2.1699999999999999 114.674 169.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.06 10.34 0.11 Allowed 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 121.411 1.914 . . . . 2.5099999999999998 112.977 171.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.522 ' H ' ' C ' ' B' ' 200' ' ' GLN . 2.3 mm-40 -126.29 -76.51 0.58 Allowed 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 127.241 2.216 . . . . 2.1800000000000002 109.149 -178.022 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.988 0 C-N-CA 130.333 3.453 . . . . 4.79 116.72 169.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 113.94 1.089 . . . . 3.2400000000000002 113.94 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 81.8 p -68.2 153.88 42.84 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.871 0.469 . . . . 2.0600000000000001 110.661 -175.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -52.58 -38.46 60.05 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.776 0.83 . . . . 2.5699999999999998 111.355 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -42.77 99.77 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.362 1.865 . . . . 1.9199999999999999 111.672 177.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -50.69 13.61 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 118.69 0.677 . . . . 2.7999999999999998 111.607 -177.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -49.68 -34.82 19.59 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.237 1.015 . . . . 6.8899999999999997 111.17 165.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.38 -40.63 77.31 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 116.821 -1.561 . . . . 1.78 114.229 171.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.4 t -53.76 -47.32 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 CA-C-N 121.438 1.926 . . . . 2.25 110.077 169.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.2 mt -52.46 -51.53 32.84 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 CA-C-N 118.556 0.617 . . . . 1.79 111.505 172.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 16.9 t -60.21 -47.67 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.421 1.088 . . . . 1.8600000000000001 112.195 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 mp -57.92 -45.85 85.9 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.417 1.087 . . . . 1.8899999999999999 111.022 175.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.9 t -59.22 -54.13 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 126.072 1.749 . . . . 1.6599999999999999 111.792 -178.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 tp10 -71.22 -32.95 69.43 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.11 1.323 . . . . 5.04 112.234 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -67.72 -17.64 64.63 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 120.214 1.37 . . . . 2.5899999999999999 113.432 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -80.26 -56.68 4.04 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.321 -0.862 . . . . 3.2000000000000002 111.65 161.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -59.67 -34.28 72.65 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.246 -0.883 . . . . 3.2200000000000002 113.059 -169.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -47.6 -39.34 16.57 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.672 1.578 . . . . 3.8599999999999999 113.949 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.43 ' CE2' ' HG3' ' A' ' 41' ' ' MET . 90.9 m-85 -82.61 -19.69 37.86 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 120.747 -1.221 . . . . 3.6600000000000001 113.562 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 1.5 t . . . . . 0 CA--C 1.544 0.737 0 C-N-CA 126.283 1.833 . . . . 3.9700000000000002 110.97 168.559 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.0 tt . . . . . 0 N--CA 1.477 0.883 0 CA-C-O 121.615 0.722 . . . . 4.9000000000000004 110.539 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.9 m -113.61 138.27 50.41 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.12 -1.437 . . . . 3.75 107.12 168.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.492 ' HE2' ' OE2' ' A' ' 78' ' ' GLU . 15.2 mttp -76.64 -15.96 59.68 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.133 0.973 . . . . 4.4100000000000001 110.633 -154.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.3 p -41.49 -27.86 0.11 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.238 1.815 . . . . 2.71 114.722 154.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.9 m -74.33 -44.27 53.14 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.19 0.996 . . . . 2.7999999999999998 112.64 171.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -52.95 -50.47 63.97 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.152 1.381 . . . . 3.04 112.104 -172.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -54.35 -31.53 54.76 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.878 1.271 . . . . 4.4500000000000002 113.397 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -95.56 -36.67 11.18 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 112.78 0.659 . . . . 4.1100000000000003 112.78 -174.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' MET . . . . . 0.43 ' HG3' ' CE2' ' A' ' 22' ' ' TYR . 11.8 tmm? -48.57 -47.77 39.36 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.487 0.715 . . . . 2.54 110.179 159.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.1 mt -54.48 -51.49 64.89 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.523 0.729 . . . . 1.8600000000000001 112.685 173.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.41 -6.49 59.39 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.535 1.68 . . . . 3.73 115.535 -174.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.93 -37.33 9.44 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.63 1.172 . . . . 3.0499999999999998 113.715 167.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -107.1 -21.85 12.84 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.006 1.322 . . . . 2.9300000000000002 114.537 -167.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 64.3 mt -111.01 44.49 1.28 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.846 1.258 . . . . 3.48 109.843 162.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.6 p30 -66.76 -2.78 5.43 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 115.865 1.802 . . . . 1.5800000000000001 115.865 -169.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -100.34 -48.77 4.47 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.648 1.979 . . . . 2.6000000000000001 111.977 178.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 45.4 tpp -72.17 33.03 0.06 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.801 2.04 . . . . 2.8700000000000001 112.816 175.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 tp -89.1 -36.05 15.95 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 127.014 2.126 . . . . 4.6299999999999999 113.129 -157.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.96 28.13 17.09 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.733 0.813 . . . . 5.8799999999999999 112.094 -175.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.5 t70 58.61 -77.53 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 129.043 2.937 . . . . 5.2300000000000004 112.617 -170.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 50.9 m -132.26 -17.28 2.68 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 126.827 2.051 . . . . 3.2000000000000002 111.334 -173.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -69.84 -65.37 2.58 Favored Glycine 0 N--CA 1.473 1.129 0 CA-C-N 120.566 1.53 . . . . 1.8600000000000001 112.983 -170.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -59.7 -24.09 63.67 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.652 0.781 . . . . 4.4699999999999998 112.83 172.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -79.89 -46.04 17.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.675 1.19 . . . . 6.0199999999999996 113.736 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -58.28 -37.1 74.34 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.039 -1.663 . . . . 4.3099999999999996 111.26 167.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.26 -46.17 79.78 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 117.45 -1.262 . . . . 2.2999999999999998 112.0 168.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.34 -48.76 65.3 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.244 1.018 . . . . 1.8100000000000001 112.386 170.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.37 -28.53 69.76 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 124.458 1.103 . . . . 2.5899999999999999 113.319 -178.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -59.24 -38.22 79.47 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 120.446 -1.409 . . . . 4.3600000000000003 112.196 173.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 mt -66.05 -35.35 80.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.308 -0.86 . . . . 2.0299999999999998 110.953 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 20.0 mm -67.1 -50.11 66.94 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.253 0 C-N-CA 123.938 0.895 . . . . 2.0 110.973 -177.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -67.41 -24.91 65.71 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.234 1.014 . . . . 4.3600000000000003 112.363 -178.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -67.71 -49.61 61.8 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 124.328 1.051 . . . . 3.9399999999999999 113.795 164.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -97.73 -34.0 11.08 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 120.461 -1.4 . . . . 3.46 114.674 -163.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -65.39 -14.43 60.86 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 119.888 -1.758 . . . . 4.5800000000000001 112.861 169.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.25 -16.65 52.03 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.533 1.308 . . . . 4.8300000000000001 114.533 167.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -128.44 -4.04 5.44 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.726 1.75 . . . . 3.9199999999999999 115.726 -167.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -137.54 118.94 14.72 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 120.376 -1.453 . . . . 5.2300000000000004 109.854 172.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -94.24 -108.03 0.13 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.485 1.514 . . . . 4.04 113.33 -163.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -89.03 15.44 57.98 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 128.09 2.757 . . . . 3.9300000000000002 113.342 176.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.4 mmt-85 -126.38 147.57 49.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.816 1.646 . . . . 5.8099999999999996 109.311 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.0 mm -142.8 141.35 27.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 125.337 1.455 . . . . 3.6099999999999999 108.453 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.4 t -94.4 156.38 16.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.393 0.542 . . . . 2.6000000000000001 112.059 169.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -58.98 -40.39 84.7 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.796 0.808 . . . . 3.1000000000000001 111.188 161.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -73.38 -16.6 61.34 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.385 1.074 . . . . 4.0899999999999999 112.686 -172.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.492 ' OE2' ' HE2' ' A' ' 35' ' ' LYS . 25.6 mt-10 -60.75 -52.44 65.08 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.893 0.77 . . . . 3.0899999999999999 111.374 175.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -54.13 -42.84 69.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 121.228 -0.92 . . . . 2.8999999999999999 111.092 174.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -65.33 -52.34 54.58 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 118.292 -0.861 . . . . 0.67000000000000004 112.475 -177.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.7 t -68.65 -26.82 65.52 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.572 1.078 . . . . 2.77 112.742 177.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.0 mt -68.57 -38.71 80.93 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 119.986 1.266 . . . . 1.6599999999999999 111.357 173.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.4 mm -58.42 -38.88 72.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 120.469 1.486 . . . . 2.1899999999999999 112.718 -178.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.42 -24.64 52.85 Favored Glycine 0 CA--C 1.54 1.594 0 CA-C-N 119.288 0.949 . . . . 0.96999999999999997 113.405 174.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.68 -8.81 57.62 Favored Glycine 0 CA--C 1.534 1.266 0 O-C-N 121.131 -1.217 . . . . 0.81999999999999995 114.12 173.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.2 mp -124.44 -41.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.878 1.339 . . . . 2.1499999999999999 112.154 172.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 79.5 m -81.74 94.05 6.93 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.052 1.741 . . . . 1.99 108.361 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -177.37 -68.95 0.06 OUTLIER Glycine 0 CA--C 1.527 0.829 0 CA-C-O 118.606 -1.108 . . . . 1.4299999999999999 112.253 -172.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.76 -43.73 30.07 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.71 2.273 . . . . 1.21 111.378 169.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 12.2 pt -75.64 -19.56 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 N-CA-C 113.569 0.952 . . . . 2.0299999999999998 113.569 172.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.08 -54.67 43.2 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.717 1.144 . . . . 2.2599999999999998 111.973 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.435 ' HZ3' ' CD ' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -56.49 -42.68 78.7 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 118.23 -0.89 . . . . 3.7000000000000002 112.673 169.43 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.9 tt -59.78 -42.15 92.69 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 118.891 0.769 . . . . 2.2599999999999998 112.126 -176.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.2 mt -55.79 -56.9 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 124.109 0.964 . . . . 2.21 109.504 173.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 60.0 t60 -59.64 -36.29 76.08 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.82 1.248 . . . . 2.3199999999999998 112.789 -177.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.435 ' CD ' ' HZ3' ' A' ' 92' ' ' LYS . 2.8 pt-20 -88.47 -9.19 53.32 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.07 0.948 . . . . 3.1499999999999999 113.282 179.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.9 -48.47 7.77 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 124.453 1.101 . . . . 2.9300000000000002 113.802 169.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -57.52 -37.59 73.27 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.128 0.966 . . . . 2.5299999999999998 111.99 -171.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 . . . . . 0 N--CA 1.469 0.511 0 C-N-CA 124.471 1.108 . . . . 2.54 111.553 174.759 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 113.111 0.782 . . . . 3.3599999999999999 113.111 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 82.2 p -74.08 157.47 36.01 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 122.831 0.453 . . . . 2.3799999999999999 109.797 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -63.6 -23.34 67.34 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.656 -0.653 . . . . 2.6499999999999999 111.962 176.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.4 -41.11 98.41 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.369 0.668 . . . . 1.8 110.053 170.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.76 -51.02 12.16 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.759 0.651 . . . . 3.0299999999999998 112.759 -177.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -34.31 -50.26 0.41 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.774 1.23 . . . . 4.9100000000000001 111.899 159.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.04 -41.85 85.84 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 116.488 -1.72 . . . . 2.0099999999999998 113.959 178.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 15.6 t -53.83 -47.37 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-N 122.138 2.245 . . . . 2.25 110.788 168.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 16.6 mt -55.01 -49.19 73.62 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 119.454 1.025 . . . . 1.8600000000000001 111.224 173.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 23.2 t -65.62 -42.14 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.958 1.303 . . . . 1.8799999999999999 112.389 -176.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.6 mp -60.55 -42.44 96.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.615 1.166 . . . . 1.9399999999999999 111.153 172.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 18.0 t -65.06 -54.13 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.113 1.365 . . . . 1.71 112.807 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 34.7 tp10 -69.69 -34.35 73.8 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 121.016 1.735 . . . . 4.75 111.874 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -68.73 -19.34 64.34 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.885 1.22 . . . . 2.5800000000000001 113.481 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -72.65 -65.97 0.72 Allowed 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.452 -0.78 . . . . 3.3199999999999998 110.985 158.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -56.35 -34.07 66.27 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 117.802 -1.094 . . . . 3.29 113.777 -167.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 13.5 ptmt -46.78 -38.06 9.54 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 121.392 1.905 . . . . 3.6800000000000002 114.034 175.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . 0.517 ' CE2' ' HG3' ' B' ' 144' ' ' MET . 91.3 m-85 -82.89 -10.01 59.03 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 120.359 -1.463 . . . . 3.54 114.145 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 2.3 t . . . . . 0 CA--C 1.541 0.602 0 C-N-CA 127.057 2.143 . . . . 4.2000000000000002 111.459 179.848 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 8.2 tt . . . . . 0 N--CA 1.477 0.911 0 CA-C-O 121.169 0.509 . . . . 4.6399999999999997 109.952 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 58.6 m -117.84 144.31 45.51 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 121.011 -1.055 . . . . 3.8199999999999998 108.26 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . 0.454 ' HE2' ' OE1' ' B' ' 181' ' ' GLU . 17.2 mttp -73.1 -16.71 61.46 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.331 -0.856 . . . . 4.1600000000000001 112.183 -154.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.1 p -48.85 -29.5 4.71 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.652 1.981 . . . . 2.4399999999999999 114.048 161.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 46.7 m -68.59 -46.9 68.11 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.745 1.157 . . . . 1.4099999999999999 112.577 171.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -55.93 -53.85 51.86 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 120.196 1.362 . . . . 3.1800000000000002 112.245 -170.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -50.17 -29.56 9.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.285 1.034 . . . . 4.3600000000000003 113.19 175.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -94.89 -36.2 11.72 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 114.505 1.298 . . . . 3.6000000000000001 114.505 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 144' ' ' MET . . . . . 0.517 ' HG3' ' CE2' ' B' ' 125' ' ' TYR . 4.6 tmm? -53.37 -44.77 68.84 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 118.942 -0.551 . . . . 1.6399999999999999 110.43 163.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 43.1 mt -53.21 -49.11 67.44 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.92 0.782 . . . . 2.0600000000000001 112.155 170.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.0 -8.13 59.65 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.012 1.486 . . . . 3.4300000000000002 115.012 -172.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.37 -40.64 7.0 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.852 1.261 . . . . 2.6299999999999999 113.859 167.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -101.35 -28.74 12.43 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.382 1.473 . . . . 2.7599999999999998 113.209 -165.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 46.3 mt -108.41 40.5 1.76 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.323 1.449 . . . . 3.73 111.022 166.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -62.0 -20.17 63.61 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.597 1.703 . . . . 1.3500000000000001 115.597 -169.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . 0.545 ' H ' ' CD2' ' B' ' 151' ' ' HIS . 0.0 OUTLIER -80.83 -59.94 2.49 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.165 1.386 . . . . 2.3500000000000001 111.916 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 42.7 tpp -58.64 -15.63 12.5 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 126.055 1.742 . . . . 2.8700000000000001 115.524 173.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 50.9 tp -51.08 -29.87 14.3 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.634 2.774 . . . . 4.2400000000000002 115.779 -171.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 21.7 m 60.08 29.67 19.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.622 1.169 . . . . 5.4900000000000002 112.823 -174.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 12.0 t70 42.64 -97.53 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.352 1.861 . . . . 6.1799999999999997 111.71 -163.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 30.4 m -93.89 -25.3 17.37 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.106 1.362 . . . . 3.3799999999999999 112.164 -168.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -67.13 -68.44 1.66 Allowed Glycine 0 N--CA 1.477 1.383 0 CA-C-N 120.712 1.596 . . . . 1.95 113.305 -167.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -60.53 -21.87 62.97 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.094 0.958 . . . . 4.3700000000000001 112.759 173.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -82.41 -37.83 24.94 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.326 1.45 . . . . 5.8700000000000001 114.509 -178.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 18.2 mmmt -63.56 -37.54 87.71 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 119.981 -1.699 . . . . 5.4100000000000001 111.387 165.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -55.03 -43.54 73.81 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-O 117.192 -1.385 . . . . 2.3999999999999999 111.646 168.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -52.53 -52.57 54.05 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.46 1.104 . . . . 1.95 111.926 170.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -56.78 -37.18 70.74 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.865 1.266 . . . . 2.5800000000000001 113.212 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 34.7 mtmt -57.79 -38.36 75.37 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 121.167 -0.958 . . . . 4.46 112.753 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 10.2 mt -66.27 -42.42 88.47 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.037 -0.983 . . . . 2.04 110.619 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 17.3 mm -56.13 -56.09 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.464 1.106 . . . . 1.98 109.925 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -68.01 -27.56 66.67 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.201 0.815 . . . . 2.96 113.201 -175.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.08 -42.98 99.75 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.253 1.021 . . . . 3.6400000000000001 113.472 167.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.46 -26.88 16.29 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.045 -1.034 . . . . 3.9900000000000002 112.605 -169.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.17 -12.26 54.8 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.137 -1.602 . . . . 3.48 113.714 172.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.08 -11.79 60.0 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.942 1.09 . . . . 2.9900000000000002 113.942 164.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -128.02 -15.55 4.76 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.502 1.667 . . . . 2.5899999999999999 115.502 -166.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -143.18 125.81 15.91 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 120.448 1.476 . . . . 5.1600000000000001 110.418 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . 0.475 ' CG ' ' H ' ' B' ' 175' ' ' GLY . 12.2 p-10 -114.6 -108.06 0.37 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 125.358 1.463 . . . . 3.77 112.835 -167.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . 0.475 ' H ' ' CG ' ' B' ' 174' ' ' ASP . . . -77.57 15.18 7.87 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 127.126 2.298 . . . . 3.5800000000000001 114.196 173.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -131.57 150.24 52.22 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.412 1.885 . . . . 6.0599999999999996 110.039 170.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 35.2 mm -143.8 139.61 25.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 126.802 2.041 . . . . 3.6499999999999999 107.622 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 25.2 t -92.33 151.4 20.31 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.133 0.424 . . . . 2.6600000000000001 110.447 167.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -50.14 -41.37 48.78 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.403 0.621 . . . . 3.1000000000000001 111.169 164.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -71.65 -12.89 61.56 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.5 0.926 . . . . 4.2199999999999998 113.5 -173.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . 0.454 ' OE1' ' HE2' ' B' ' 138' ' ' LYS . 14.6 mt-10 -60.13 -51.63 68.77 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.655 1.116 . . . . 2.79 111.385 177.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -56.64 -43.58 80.42 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.134 -0.979 . . . . 3.1499999999999999 111.89 174.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 24.2 t-105 -62.87 -57.38 11.02 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 118.837 -0.602 . . . . 0.67000000000000004 111.875 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.7 t -65.09 -28.71 69.64 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.923 -1.037 . . . . 2.6699999999999999 112.73 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 77.2 mt -71.54 -35.57 70.7 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.854 1.206 . . . . 1.8200000000000001 112.975 173.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 7.0 mm -54.98 -39.2 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 CA-C-N 121.242 1.837 . . . . 1.99 112.292 177.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.07 -28.83 71.19 Favored Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.067 0.841 . . . . 0.72999999999999998 113.317 176.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -67.98 -14.23 65.42 Favored Glycine 0 CA--C 1.533 1.164 0 O-C-N 121.03 -1.277 . . . . 0.81999999999999995 113.461 175.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.7 mp -109.3 -32.52 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 118.465 1.133 . . . . 2.2400000000000002 112.313 166.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 18.6 m -91.88 97.24 10.85 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.379 1.871 . . . . 1.9399999999999999 110.05 -175.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -177.06 -64.77 0.06 OUTLIER Glycine 0 CA--C 1.529 0.938 0 C-N-CA 124.868 1.223 . . . . 1.4299999999999999 111.968 -172.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -62.33 -47.86 8.98 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.627 2.218 . . . . 1.3500000000000001 110.762 167.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 13.5 pt -67.93 -25.15 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 112.966 0.728 . . . . 2.4900000000000002 112.966 172.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.24 -58.95 6.18 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.836 1.198 . . . . 2.0800000000000001 111.939 -178.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . 0.458 ' HZ3' ' CD ' ' B' ' 199' ' ' GLU . 0.0 OUTLIER -57.11 -38.99 74.21 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 118.378 -0.82 . . . . 3.6699999999999999 112.549 173.583 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.1 tt -61.89 -41.97 98.52 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 118.511 -0.757 . . . . 2.3399999999999999 112.019 -177.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 32.8 mt -55.59 -56.17 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 119.478 1.035 . . . . 2.2599999999999998 109.639 173.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -59.46 -36.13 75.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.275 1.03 . . . . 2.4199999999999999 112.555 -176.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . 0.458 ' CD ' ' HZ3' ' B' ' 195' ' ' LYS . 2.8 pt-20 -90.51 -8.94 49.04 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.249 0.833 . . . . 3.3599999999999999 113.249 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -88.16 -49.02 7.28 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.434 1.094 . . . . 3.0 113.792 169.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -58.82 -33.85 70.85 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.05 0.929 . . . . 2.6600000000000001 112.144 -170.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -72.77 -52.82 13.48 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.675 1.19 . . . . 2.6800000000000002 111.388 175.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 . . . . . 0 CA--C 1.548 0.903 0 C-N-CA 127.212 2.205 . . . . 7.8700000000000001 113.837 177.299 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.411 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 3.6 m-30 . . . . . 0 CA--C 1.546 0.81 0 CA-C-O 119.099 -0.477 . . . . 3.6499999999999999 110.279 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.3 p -71.82 155.52 40.33 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 119.186 0.903 . . . . 2.0600000000000001 110.703 -176.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -61.29 -24.33 66.33 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 114.276 1.213 . . . . 2.7599999999999998 114.276 -171.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -48.86 79.41 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 119.7 1.137 . . . . 2.1299999999999999 110.643 170.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.24 -46.84 69.39 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.381 1.472 . . . . 2.8900000000000001 112.025 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.4 mmtt -52.17 -42.09 63.14 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.973 -1.08 . . . . 7.1200000000000001 111.495 169.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.42 -39.46 77.87 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.098 -1.43 . . . . 1.8999999999999999 112.064 177.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.2 t -54.6 -40.09 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 121.503 1.956 . . . . 2.3799999999999999 110.458 167.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.1 mt -59.67 -55.67 22.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 CA-C-N 120.07 1.304 . . . . 1.8999999999999999 111.809 170.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.9 t -58.11 -39.28 72.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 125.467 1.507 . . . . 1.8300000000000001 112.976 -177.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -70.48 -41.7 72.37 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.518 1.127 . . . . 1.8700000000000001 112.098 176.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 70.6 t -71.03 -35.88 61.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 123.826 0.85 . . . . 1.76 111.396 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -62.32 -46.29 89.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.115 0.966 . . . . 2.7000000000000002 110.848 168.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -55.11 -31.78 61.5 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.827 1.418 . . . . 2.27 114.827 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -78.24 -62.23 1.75 Allowed 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.645 -0.659 . . . . 3.2599999999999998 111.607 171.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -64.6 -26.57 68.46 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 118.288 -0.863 . . . . 3.1299999999999999 113.094 -169.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.0 -20.05 8.28 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 120.502 1.501 . . . . 3.3199999999999998 114.146 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -90.41 0.22 57.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.142 1.377 . . . . 3.6600000000000001 114.584 176.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.482 1.15 0 C-N-CA 125.592 1.557 . . . . 3.48 111.007 178.066 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.5 pt . . . . . 0 N--CA 1.474 0.768 0 N-CA-C 111.85 0.315 . . . . 4.0 111.85 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.2 t -77.61 149.39 34.78 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.693 0.759 . . . . 3.77 111.533 168.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -56.1 -23.0 31.38 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 120.607 -1.308 . . . . 3.1699999999999999 111.624 164.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.8 p -80.8 -9.42 59.81 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.009 -1.682 . . . . 2.2999999999999998 115.388 170.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.8 m -83.36 -33.98 25.71 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.042 1.292 . . . . 1.4099999999999999 112.24 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -45.49 -60.25 2.27 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.865 1.266 . . . . 3.4199999999999999 110.934 176.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.7 ptt180 -58.1 -24.25 57.92 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.692 1.597 . . . . 2.96 113.229 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -94.5 -40.39 9.91 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 126.154 1.782 . . . . 3.29 111.842 -172.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 5.7 tmm? -55.06 -40.44 70.32 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 120.298 -1.501 . . . . 1.9299999999999999 111.811 163.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.87 6.06 0.98 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.94 2.496 . . . . 2.8999999999999999 114.972 169.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -115.58 -13.5 11.52 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.207 1.803 . . . . 2.6899999999999999 113.607 165.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.55 -37.57 9.11 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.847 1.425 . . . . 2.6899999999999999 114.847 178.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -82.9 -56.29 3.91 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 118.591 0.632 . . . . 4.5800000000000001 109.77 164.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.95 75.06 4.49 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.482 -0.762 . . . . 2.8900000000000001 109.704 171.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -121.82 -2.92 9.23 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.216 1.807 . . . . 2.1899999999999999 113.965 -174.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -118.11 -28.01 5.96 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.114 -0.991 . . . . 2.1400000000000001 112.027 176.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 36.9 tpp -65.49 -12.91 57.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.608 1.963 . . . . 2.3700000000000001 112.443 163.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.3 pp -151.5 175.39 12.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.555 1.542 . . . . 4.3300000000000001 112.841 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.0 m 156.06 -37.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 130.903 3.681 . . . . 7.46 107.922 -164.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -55.27 132.33 47.59 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.197 0.999 . . . . 4.25 110.505 156.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 50.3 m -80.73 -25.81 37.81 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.221 1.408 . . . . 3.1299999999999999 111.274 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.16 -48.12 87.49 Favored Glycine 0 N--CA 1.472 1.098 0 C-N-CA 124.738 1.161 . . . . 1.8899999999999999 111.82 177.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -46.52 -55.73 7.08 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.918 1.687 . . . . 3.3500000000000001 112.173 166.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -60.59 -29.08 68.98 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.536 -0.727 . . . . 8.0500000000000007 112.669 -177.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 mmmt -59.98 -37.73 80.47 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.613 -1.304 . . . . 5.2300000000000004 113.213 174.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.82 -19.48 62.6 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.4 1.259 . . . . 1.78 114.4 172.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.2 -43.25 19.56 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.669 1.122 . . . . 1.8200000000000001 111.42 164.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -60.96 -43.08 99.23 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 113.375 0.88 . . . . 2.23 113.375 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -56.4 -27.61 56.88 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.076 0.951 . . . . 3.54 112.715 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 24.3 mt -77.01 -35.22 57.26 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 121.809 -0.557 . . . . 1.8300000000000001 111.763 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.6 mm -55.28 -40.81 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.244 1.018 . . . . 2.0 110.89 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -73.42 -35.14 65.78 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.462 0.912 . . . . 3.5899999999999999 113.462 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -60.78 -28.05 68.45 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.782 0.833 . . . . 3.9300000000000002 111.914 170.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.74 -32.32 21.94 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.904 2.082 . . . . 2.96 111.832 174.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -67.46 -22.24 65.5 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.114 1.366 . . . . 3.8100000000000001 113.972 172.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.4 -15.5 49.33 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.408 1.262 . . . . 3.2200000000000002 114.408 169.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -151.37 -31.4 0.16 Allowed 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 118.048 2.61 . . . . 3.96 118.048 -170.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -90.37 100.95 13.69 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 121.427 1.921 . . . . 3.9900000000000002 111.385 -177.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -65.76 -5.23 8.14 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 116.635 2.087 . . . . 3.9300000000000002 116.635 -173.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.34 7.71 8.16 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.629 1.109 . . . . 2.7000000000000002 115.179 -169.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 41.4 mmt-85 -75.28 -179.89 4.73 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.714 1.757 . . . . 5.6500000000000004 109.71 149.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.5 mm -136.34 137.28 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 N-CA-C 106.672 -1.603 . . . . 2.7799999999999998 106.672 166.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.3 m -96.41 146.7 24.54 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.144 0.884 . . . . 2.9900000000000002 110.175 167.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -64.39 -51.34 63.71 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.729 0.641 . . . . 3.8999999999999999 112.729 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -70.55 -20.67 62.78 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.702 1.201 . . . . 4.6799999999999997 112.953 -177.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -63.78 -35.86 82.0 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 121.34 -0.85 . . . . 5.2300000000000004 110.834 173.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -53.85 -52.13 61.39 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.213 -1.555 . . . . 2.7799999999999998 110.749 170.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 -65.29 -45.82 82.88 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.865 0.866 . . . . 0.73999999999999999 111.465 -175.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 99.5 m -57.83 -46.25 85.01 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 127.102 2.161 . . . . 3.4100000000000001 111.287 177.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 85.1 mt -60.94 -26.52 67.56 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 118.196 -0.907 . . . . 1.8600000000000001 113.06 174.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 35.9 mm -61.37 -32.69 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 CA-C-N 121.603 2.001 . . . . 2.2400000000000002 112.445 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.59 -28.07 67.16 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.572 1.082 . . . . 0.75 112.939 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -72.79 -19.98 79.57 Favored Glycine 0 CA--C 1.533 1.192 0 O-C-N 121.373 -1.075 . . . . 0.62 114.301 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.9 mp -97.47 -35.25 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 CA-C-N 118.451 1.125 . . . . 2.0 110.281 166.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.4 m -82.83 56.64 3.49 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.688 1.995 . . . . 1.71 110.666 -175.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -131.98 -71.6 0.1 OUTLIER Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.341 1.924 . . . . 1.3300000000000001 111.497 175.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -63.94 -56.04 0.55 Allowed 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.302 2.668 . . . . 1.8 111.872 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.3 pt -65.31 -27.16 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 112.966 0.728 . . . . 2.7999999999999998 112.966 173.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.32 -35.81 78.35 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.429 1.013 . . . . 2.2999999999999998 113.458 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.4 ptpt -69.25 -32.41 71.6 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.379 -1.451 . . . . 4.25 113.478 166.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.96 -37.43 85.97 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 120.457 1.48 . . . . 2.5099999999999998 112.031 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -47.04 -59.95 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-N 119.785 1.175 . . . . 2.3500000000000001 109.411 162.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.0 t60 -64.72 -19.05 65.55 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.692 1.367 . . . . 2.3100000000000001 114.692 -175.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -74.6 -47.36 32.82 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.307 -0.871 . . . . 3.1699999999999999 112.372 162.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -69.21 -40.01 78.27 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 117.424 -1.274 . . . . 2.3100000000000001 114.065 -172.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -60.37 -17.21 42.04 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 120.023 1.283 . . . . 2.7400000000000002 112.227 173.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.477 0.912 0 O-C-N 120.448 -1.407 . . . . 3.5800000000000001 110.919 172.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 . . . . . 0 CA--C 1.546 0.801 0 CA-C-O 118.592 -0.718 . . . . 4.0499999999999998 111.816 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.36 166.44 14.46 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 119.126 0.876 . . . . 2.1800000000000002 111.124 -177.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.87 -24.04 66.67 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 118.977 0.808 . . . . 2.8999999999999999 113.155 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.37 -43.67 98.27 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.921 1.237 . . . . 2.0099999999999998 110.036 172.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -71.34 -43.83 66.26 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.742 0.817 . . . . 3.1899999999999999 112.004 175.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 44.7 mmtt -53.52 -42.27 67.22 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.798 1.181 . . . . 7.1500000000000004 111.101 170.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.42 -45.41 69.25 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 124.331 1.052 . . . . 1.8500000000000001 111.977 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.33 -38.83 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 120.428 1.467 . . . . 1.95 110.031 170.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 76.9 mt -59.29 -56.1 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-O 117.694 -1.146 . . . . 1.96 111.378 168.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 t -58.21 -35.36 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 126.048 1.739 . . . . 1.8799999999999999 113.46 -177.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.42 -46.96 62.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.503 1.121 . . . . 1.8600000000000001 111.227 174.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 68.0 t -69.13 -34.68 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.976 0.91 . . . . 1.74 111.316 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -67.98 -44.55 76.42 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.39 1.476 . . . . 2.6699999999999999 110.445 170.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -55.63 -34.12 64.62 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.977 1.717 . . . . 2.1800000000000002 113.952 175.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -73.31 -64.93 0.88 Allowed 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.885 -0.51 . . . . 3.25 111.405 170.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -64.93 -28.89 69.83 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.66 0.985 . . . . 3.0600000000000001 113.66 -169.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -19.97 16.56 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 120.856 1.662 . . . . 3.52 113.834 177.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -89.94 -0.23 57.45 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.207 1.403 . . . . 3.25 114.17 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 33.6 m . . . . . 0 N--CA 1.481 1.104 0 C-N-CA 125.295 1.438 . . . . 3.3999999999999999 110.763 177.244 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 23.9 pt . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 112.583 0.586 . . . . 4.0199999999999996 112.583 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 42.1 t -83.04 148.92 27.25 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.369 -0.832 . . . . 3.54 111.233 171.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 18.0 ttpt -56.18 -20.3 17.31 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.734 -1.229 . . . . 3.3500000000000001 112.14 163.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 76.0 p -83.04 -8.32 59.56 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 115.674 1.731 . . . . 2.3500000000000001 115.674 169.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 67.4 m -76.71 -42.09 42.75 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.444 1.474 . . . . 1.29 112.692 -176.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -50.86 -54.79 20.89 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.443 1.019 . . . . 3.21 112.88 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -54.38 -26.26 29.21 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.292 1.037 . . . . 3.3199999999999998 113.517 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -95.75 -42.37 8.4 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.231 1.813 . . . . 3.1499999999999999 112.238 -174.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.9 tmm? -53.72 -40.06 65.78 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.852 -1.155 . . . . 1.6899999999999999 111.917 163.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.71 -21.36 54.72 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.688 1.366 . . . . 1.98 114.688 168.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -97.24 -5.37 37.0 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.418 1.487 . . . . 2.6099999999999999 112.386 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.85 -33.12 8.99 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.78 1.4 . . . . 2.3999999999999999 114.78 168.034 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -89.09 -63.87 1.23 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.904 0.881 . . . . 4.0300000000000002 111.521 175.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.35 35.98 0.15 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.045 1.338 . . . . 3.02 112.514 174.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -80.26 3.75 19.88 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.655 2.382 . . . . 1.8999999999999999 114.43 -171.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . 0.411 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 17.3 m-70 -117.05 -26.12 6.95 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 118.826 0.739 . . . . 2.1899999999999999 111.611 173.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 42.5 tpp -68.43 -26.99 65.8 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.21 2.204 . . . . 2.8199999999999998 112.406 165.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 1.8 pp -123.98 167.25 14.4 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.849 1.66 . . . . 4.4299999999999997 111.131 167.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 21.8 m -167.8 -54.58 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.299 1.84 . . . . 6.8200000000000003 107.479 175.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -63.82 143.93 57.46 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.636 0.732 . . . . 4.2599999999999998 109.678 160.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 5.9 m -65.58 -23.72 66.91 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.602 1.161 . . . . 4.4400000000000004 111.08 172.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.36 -28.39 50.26 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.292 1.425 . . . . 2.77 114.793 -178.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -71.25 -61.86 1.61 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 118.133 0.967 . . . . 3.0899999999999999 109.142 168.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.6 ttp-105 -48.56 -21.4 0.57 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.501 1.92 . . . . 5.4500000000000002 116.137 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -45.68 -38.35 6.73 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.635 1.107 . . . . 4.3899999999999997 113.224 164.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -70.94 -18.38 62.64 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 115.286 1.587 . . . . 1.79 115.286 174.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.46 -46.93 12.83 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 120.041 1.291 . . . . 1.97 109.926 165.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -57.32 -41.96 80.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.544 1.538 . . . . 1.98 112.539 -177.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -58.43 -28.33 65.15 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.445 1.276 . . . . 3.8100000000000001 114.445 174.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 52.5 mt -76.98 -35.87 56.86 Favored 'General case' 0 C--O 1.222 -0.388 0 O-C-N 121.908 -0.495 . . . . 1.96 110.773 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 14.7 mm -55.38 -40.36 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.607 0.763 . . . . 2.02 110.64 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -71.35 -34.76 70.78 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.583 0.957 . . . . 3.6800000000000002 113.583 176.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -64.15 -31.18 72.28 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.973 0.909 . . . . 4.0099999999999998 111.712 171.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.56 -36.28 57.72 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.123 2.169 . . . . 3.21 111.56 172.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -70.3 -22.19 62.86 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.631 1.172 . . . . 3.8199999999999998 113.556 177.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -63.61 -13.36 41.41 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.573 1.323 . . . . 3.02 114.573 169.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -149.36 -34.07 0.19 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 118.169 2.655 . . . . 3.9199999999999999 118.169 -171.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -88.44 98.21 11.5 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 121.229 1.831 . . . . 4.04 111.326 -175.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -64.83 -4.21 4.17 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 116.994 2.22 . . . . 3.8799999999999999 116.994 -172.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 120.41 5.67 10.18 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.679 -1.067 . . . . 2.4900000000000002 115.044 -167.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 37.7 mmt-85 -75.94 176.14 8.16 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.829 1.815 . . . . 5.71 109.848 150.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 32.7 mm -135.3 136.63 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 106.832 -1.544 . . . . 2.8900000000000001 106.832 167.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 23.8 m -95.21 147.55 23.35 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.837 0.744 . . . . 3.0499999999999998 110.28 168.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -61.87 -51.63 67.41 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.513 0.673 . . . . 3.8500000000000001 112.384 177.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -70.36 -16.02 62.93 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.562 1.545 . . . . 4.5700000000000003 112.777 -176.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -68.32 -38.02 81.16 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.085 -1.01 . . . . 4.8200000000000003 111.319 174.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -56.16 -45.43 79.68 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 119.963 -1.711 . . . . 2.9700000000000002 111.826 170.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.9 t-105 -68.09 -45.27 74.22 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.309 0.644 . . . . 0.77000000000000002 112.062 -177.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 87.2 m -58.25 -48.23 81.08 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.702 2.001 . . . . 3.21 110.783 175.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 84.0 mt -61.25 -27.65 68.6 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.394 0.887 . . . . 1.6799999999999999 113.394 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 23.7 mm -62.12 -39.88 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 CA-C-N 120.851 1.659 . . . . 1.8899999999999999 111.604 176.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -59.34 -30.65 68.21 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.645 1.117 . . . . 0.58999999999999997 113.012 175.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -69.12 -20.09 74.54 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-O 118.836 -0.98 . . . . 0.57999999999999996 114.297 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.5 mp -98.27 -36.53 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 119.17 1.485 . . . . 2.0299999999999998 110.912 163.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 17.4 m -81.54 64.92 6.46 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.973 2.109 . . . . 1.75 110.203 -173.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -137.66 -72.5 0.06 OUTLIER Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.403 1.478 . . . . 1.1399999999999999 111.649 178.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -65.43 -47.74 3.99 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.049 2.5 . . . . 1.3600000000000001 111.563 177.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 10.0 pt -66.99 -25.42 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 112.814 0.672 . . . . 2.29 112.814 174.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.76 -38.2 79.91 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.32 -0.863 . . . . 1.8100000000000001 112.692 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -65.78 -34.23 77.69 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 117.54 -1.219 . . . . 4.3600000000000003 112.922 165.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.2 tt -65.82 -39.43 90.84 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 121.206 1.821 . . . . 2.6000000000000001 111.872 177.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 96.3 mt -48.59 -59.28 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 CA-C-N 119.773 1.17 . . . . 2.2799999999999998 109.655 163.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 21.5 t60 -63.86 -22.37 66.89 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.661 1.356 . . . . 2.2400000000000002 114.661 -175.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -71.06 -46.29 62.21 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.385 1.074 . . . . 3.1600000000000001 112.106 164.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 25.2 mm100 -68.6 -41.99 78.8 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 117.64 -1.171 . . . . 2.4700000000000002 113.731 -173.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.25 -18.73 28.69 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.616 1.098 . . . . 2.7000000000000002 112.553 174.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -91.38 -47.37 7.5 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.603 -1.31 . . . . 3.7400000000000002 111.064 173.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 . . . . . 0 CA--C 1.548 0.891 0 C-N-CA 126.429 1.891 . . . . 5.9800000000000004 113.355 -178.764 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 . . . . . 0 CA--C 1.543 0.701 0 N-CA-C 106.949 -1.5 . . . . 4.4699999999999998 106.949 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 p -57.5 169.02 0.7 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.027 1.731 . . . . 2.6800000000000002 113.799 -163.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.0 -8.94 53.23 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.743 -1.223 . . . . 3.6800000000000002 113.786 172.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.51 -39.94 10.14 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.458 1.026 . . . . 2.0099999999999998 110.641 167.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -77.51 -58.85 3.04 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 120.702 -1.249 . . . . 3.5699999999999998 110.784 -173.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -56.67 -23.56 42.65 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.865 -0.522 . . . . 6.5499999999999998 111.624 171.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.04 -53.8 33.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.066 -1.021 . . . . 2.5899999999999999 112.785 168.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.03 -36.04 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 CA-C-N 119.865 1.211 . . . . 2.4399999999999999 110.727 174.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.4 mm -54.6 -50.93 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 119.463 1.029 . . . . 3.4500000000000002 110.645 167.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 31.0 t -69.67 -29.49 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 124.759 1.224 . . . . 2.5299999999999998 112.188 -174.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.2 mp -70.59 -39.79 73.63 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.7 1.137 . . . . 2.77 111.571 170.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.8 t -63.48 -46.46 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.046 0.938 . . . . 2.27 111.295 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -65.18 -45.72 83.73 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.362 0.983 . . . . 4.9500000000000002 111.244 172.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -57.85 -27.93 63.67 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 119.534 -1.979 . . . . 3.9199999999999999 113.815 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -74.63 -67.35 0.64 Allowed 'General case' 0 C--O 1.24 0.559 0 C-N-CA 123.266 0.626 . . . . 3.2400000000000002 111.709 165.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -61.11 -34.67 75.33 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 117.578 -1.201 . . . . 3.75 112.334 -168.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.8 mtpt -43.54 -51.43 6.79 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 126.861 2.064 . . . . 3.8799999999999999 113.044 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -81.6 -32.64 31.95 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.788 1.235 . . . . 4.0599999999999996 111.248 -176.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 CA--C 1.55 0.949 0 C-N-CA 128.217 2.607 . . . . 4.6299999999999999 110.115 177.628 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 36.3 pt . . . . . 0 N--CA 1.478 0.966 0 CA-C-O 120.68 0.276 . . . . 2.8599999999999999 111.337 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.5 m -78.19 135.98 37.72 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 121.196 -0.94 . . . . 2.9500000000000002 109.072 157.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.5 mttp -59.1 -27.91 66.02 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.069 -1.02 . . . . 3.1600000000000001 112.256 -178.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.2 p -57.37 -30.8 65.17 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.253 1.575 . . . . 2.0899999999999999 115.253 168.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.8 m -71.19 -39.07 72.04 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.641 1.11 . . . . 1.6000000000000001 112.461 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -50.95 -53.91 28.83 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.038 0.935 . . . . 3.52 111.611 176.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 23.7 ptt85 -69.61 -14.42 62.82 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.611 1.337 . . . . 3.8999999999999999 114.611 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -89.18 -46.02 9.12 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.193 0.997 . . . . 4.5199999999999996 111.009 175.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 3.3 tmm? -47.45 -47.25 27.1 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.518 1.127 . . . . 1.78 111.69 164.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.5 mt -60.12 -37.29 79.6 Favored 'General case' 0 C--O 1.212 -0.879 0 C-N-CA 123.49 0.716 . . . . 2.9100000000000001 111.655 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -69.96 -14.31 62.65 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 120.001 1.273 . . . . 3.0299999999999998 113.736 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.82 -46.48 3.48 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.391 1.476 . . . . 3.71 114.108 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -87.28 -28.17 22.46 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 119.478 1.035 . . . . 3.5899999999999999 111.921 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.48 49.04 0.81 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.87 2.068 . . . . 2.5499999999999998 110.766 162.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 42.1 p30 -69.05 -178.37 1.24 Allowed 'General case' 0 CA--C 1.548 0.904 0 O-C-N 120.561 -1.337 . . . . 4.6699999999999999 111.467 166.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 61.5 m170 80.29 -32.27 0.12 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 116.872 2.175 . . . . 4.04 116.872 158.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.7 ptp -76.21 -19.66 58.18 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 113.383 0.883 . . . . 3.02 113.383 163.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.8 mp -69.28 107.87 3.44 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.505 0.722 . . . . 3.3500000000000001 110.857 -177.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.5 m -76.58 -19.5 57.81 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.956 0.724 . . . . 4.4299999999999997 112.956 167.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -162.67 160.61 25.83 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 127.73 2.412 . . . . 3.6899999999999999 107.902 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 p -51.28 -20.93 1.85 Allowed 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 126.455 1.902 . . . . 5.2999999999999998 114.004 164.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -48.88 -34.86 16.46 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-N 120.983 1.719 . . . . 2.1800000000000002 114.291 176.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 30.5 t30 -71.57 -38.71 70.91 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 118.158 0.979 . . . . 4.4299999999999997 112.304 175.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -63.73 -37.56 87.84 Favored 'General case' 0 C--N 1.346 0.446 0 O-C-N 121.003 -1.061 . . . . 5.5800000000000001 112.184 165.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -64.34 -27.48 69.05 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 119.643 -1.911 . . . . 3.8399999999999999 113.327 174.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.56 -12.95 61.63 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.906 1.076 . . . . 1.8999999999999999 113.906 166.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.75 -46.47 14.2 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.162 0.892 . . . . 2.3599999999999999 111.608 160.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -51.86 -44.01 63.48 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.64 1.176 . . . . 1.8999999999999999 113.259 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -55.92 -28.45 56.88 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.715 1.005 . . . . 3.9399999999999999 113.715 175.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.7 mt -79.39 -41.43 27.76 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.346 1.059 . . . . 2.0600000000000001 111.238 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 mm -53.44 -54.22 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 124.407 1.083 . . . . 1.77 110.175 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -58.1 -43.06 86.94 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.234 0.54 . . . . 2.4700000000000002 112.439 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -31.31 70.73 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.374 1.47 . . . . 3.77 112.829 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.6 mt -95.05 -23.24 17.43 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 114.01 1.115 . . . . 3.8799999999999999 114.01 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -67.84 -14.67 63.15 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.506 1.503 . . . . 3.0 112.394 170.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.15 -18.73 48.95 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.064 1.505 . . . . 3.2400000000000002 115.064 163.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -130.53 -24.17 2.53 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 116.455 2.02 . . . . 3.2400000000000002 116.455 -166.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.416 ' HD1' ' CD ' ' A' ' 78' ' ' GLU . 2.1 m170 -121.88 138.94 54.2 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.288 -1.507 . . . . 5.0099999999999998 112.885 -171.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.592 ' CG ' ' H ' ' A' ' 72' ' ' GLY . 13.3 t0 -96.37 -160.6 0.81 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 126.456 1.902 . . . . 4.5800000000000001 111.072 -175.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.592 ' H ' ' CG ' ' A' ' 71' ' ' ASP . . . -59.84 -10.74 14.52 Favored Glycine 0 CA--C 1.527 0.793 0 O-C-N 120.011 -1.681 . . . . 3.25 113.843 152.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.7 mmt-85 -69.93 79.1 0.47 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.356 1.578 . . . . 5.79 108.992 161.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.4 mt -83.32 135.54 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 N-CA-C 107.505 -1.294 . . . . 3.48 107.505 172.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.7 t -104.17 166.45 10.39 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.551 0.691 . . . . 2.2000000000000002 111.79 172.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -78.11 -42.97 30.31 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.273 1.035 . . . . 3.8799999999999999 112.496 -178.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.5 p-10 -71.63 -24.1 61.81 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.588 1.955 . . . . 3.6499999999999999 112.644 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.416 ' CD ' ' HD1' ' A' ' 70' ' ' HIS . 83.7 tt0 -52.86 -57.31 10.65 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.311 1.844 . . . . 2.8799999999999999 111.103 169.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -56.47 -46.73 80.26 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.223 -0.923 . . . . 3.27 111.814 177.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -59.76 -39.94 86.52 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.822 -0.549 . . . . 1.3100000000000001 111.747 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 73.2 m -63.9 -42.02 97.55 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 126.243 1.817 . . . . 2.8500000000000001 110.769 175.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.01 -38.83 92.22 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 117.929 -1.034 . . . . 2.0 113.289 174.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.1 mm -57.75 -34.4 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 120.716 1.598 . . . . 2.21 110.947 173.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.02 -6.06 36.32 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.87 1.224 . . . . 1.4099999999999999 114.618 176.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -97.46 -19.85 24.18 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.034 1.417 . . . . 0.73999999999999999 114.599 171.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 5.1 mp -92.89 -35.96 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 118.776 1.288 . . . . 2.6699999999999999 110.451 170.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.8 m -74.42 145.7 43.49 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.575 -0.898 . . . . 2.3999999999999999 108.575 171.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.45 -60.15 0.49 Allowed Glycine 0 CA--C 1.535 1.292 0 CA-C-O 117.086 -1.952 . . . . 2.1200000000000001 115.428 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -65.55 -64.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.81 0 CA-C-N 121.356 2.578 . . . . 1.45 111.095 -173.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.5 -7.98 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 112.897 0.703 . . . . 2.8700000000000001 112.897 175.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.67 -34.04 70.8 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.846 1.203 . . . . 1.8300000000000001 113.225 -178.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -66.68 -27.59 67.78 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.335 -1.478 . . . . 4.7599999999999998 111.873 175.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.1 tt -80.21 -33.56 38.01 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.655 1.582 . . . . 2.5800000000000001 111.564 174.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 98.0 mt -47.42 -52.49 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 CA-C-N 119.226 0.921 . . . . 1.96 110.435 165.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -53.53 -42.06 67.02 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.157 1.169 . . . . 3.77 114.157 177.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.56 -49.5 76.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.794 0.838 . . . . 6.5 110.731 173.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -60.56 -39.91 89.72 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 120.905 -1.122 . . . . 2.6899999999999999 113.35 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -66.94 -22.71 65.93 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 119.589 1.086 . . . . 3.4399999999999999 112.283 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.414 0 O-C-N 121.162 -0.961 . . . . 2.1899999999999999 112.017 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 106.426 -1.694 . . . . 4.5899999999999999 106.426 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 11.2 p -58.32 168.2 1.15 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 126.214 1.805 . . . . 2.6899999999999999 113.72 -162.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.51 -6.88 21.73 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.432 -1.417 . . . . 3.4399999999999999 113.742 171.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.61 -38.72 9.43 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.663 1.12 . . . . 1.9399999999999999 111.344 166.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.87 -58.39 3.29 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 120.537 -1.352 . . . . 3.5 110.407 -174.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 14.0 tptp -57.84 -26.06 61.51 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 122.087 -0.383 . . . . 7.5800000000000001 110.66 174.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.23 -55.97 23.25 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 121.477 -0.764 . . . . 2.4900000000000002 112.887 169.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.25 -35.09 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-N 119.911 1.232 . . . . 2.46 110.668 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 19.8 mt -57.68 -44.53 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 118.596 0.635 . . . . 2.2000000000000002 112.167 167.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 39.8 t -72.73 -29.46 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 124.26 1.024 . . . . 2.4900000000000002 111.558 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.4 mp -69.68 -43.44 72.51 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.15 0.886 . . . . 2.8999999999999999 111.184 168.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 19.2 t -57.41 -46.76 85.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.566 1.146 . . . . 2.3500000000000001 111.728 171.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -62.31 -51.9 65.81 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.961 0.904 . . . . 4.6799999999999997 111.869 172.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -59.95 -25.59 65.32 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.489 -1.382 . . . . 3.9199999999999999 113.497 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -72.64 -69.54 0.4 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.688 0.795 . . . . 3.7200000000000002 111.534 164.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -62.98 -32.15 73.42 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 118.328 -0.844 . . . . 3.5499999999999998 113.025 -167.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . 0.401 ' HZ1' ' CD ' ' B' ' 148' ' ' GLU . 28.0 mtpt -43.86 -54.23 5.42 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.376 1.87 . . . . 3.8100000000000001 113.2 174.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . 0.418 ' CZ ' ' HG3' ' B' ' 144' ' ' MET . 43.1 m-85 -75.5 -30.2 59.78 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 123.531 0.732 . . . . 3.8599999999999999 110.783 -177.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 65.2 t . . . . . 0 CA--C 1.55 0.979 0 C-N-CA 127.683 2.393 . . . . 4.2599999999999998 110.702 178.551 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 35.9 pt . . . . . 0 N--CA 1.473 0.679 0 CA-C-O 121.708 0.766 . . . . 2.79 112.403 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 5.5 m -99.07 127.2 44.97 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 121.825 -0.547 . . . . 2.9199999999999999 109.933 176.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 32.0 mttp -60.79 -28.63 68.9 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 120.836 -1.165 . . . . 3.1699999999999999 112.256 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 10.8 p -60.2 -33.69 72.58 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.75 1.62 . . . . 2.0600000000000001 113.801 168.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.2 m -79.95 -37.36 34.63 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 118.197 -0.906 . . . . 1.8100000000000001 111.792 174.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -49.05 -54.07 17.49 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.571 1.078 . . . . 3.27 111.878 173.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 14.0 ptt85 -66.08 -17.17 64.53 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 114.211 1.189 . . . . 4.4500000000000002 114.211 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -94.02 -48.12 6.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.205 1.402 . . . . 3.8599999999999999 110.086 -177.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 144' ' ' MET . . . . . 0.418 ' HG3' ' CZ ' ' B' ' 125' ' ' TYR . 5.6 tmm? -45.17 -45.73 11.69 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.118 2.167 . . . . 1.99 112.51 162.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 8.9 mt -54.35 -40.87 68.48 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 123.625 0.77 . . . . 2.52 111.292 176.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -71.04 -13.66 62.06 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.634 -1.292 . . . . 2.9700000000000002 113.944 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.76 -53.78 3.31 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.902 1.281 . . . . 2.6099999999999999 113.086 175.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.401 ' CD ' ' HZ1' ' B' ' 124' ' ' LYS . 14.4 mt-10 -86.98 -26.96 23.55 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.385 0.539 . . . . 3.6400000000000001 111.657 -174.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -107.61 46.83 0.92 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.921 2.089 . . . . 2.4900000000000002 110.951 164.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 48.9 p30 -65.84 -178.38 0.57 Allowed 'General case' 0 CA--C 1.554 1.109 0 O-C-N 120.952 -1.093 . . . . 4.79 111.864 168.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 60.6 m170 79.17 -35.43 0.16 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 117.168 2.284 . . . . 3.8900000000000001 117.168 156.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 10.5 ptp -73.46 -19.37 60.96 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 118.716 0.689 . . . . 3.1000000000000001 112.77 162.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.33 99.83 0.58 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.935 0.894 . . . . 3.2400000000000002 111.04 -172.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 1.2 m -75.14 -14.7 60.58 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.259 1.024 . . . . 4.4100000000000001 113.378 175.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -167.22 159.97 13.29 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 128.574 2.749 . . . . 3.8900000000000001 108.035 166.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 72.9 p -50.01 -24.19 2.47 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.035 1.734 . . . . 6.0800000000000001 113.5 165.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -51.71 -29.67 26.24 Favored Glycine 0 CA--C 1.529 0.967 0 CA-C-N 120.822 1.646 . . . . 2.5499999999999998 114.073 174.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -74.31 -36.16 63.71 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 118.3 1.05 . . . . 4.2699999999999996 112.377 174.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 17.4 ttt-85 -64.12 -39.56 94.3 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.994 0.815 . . . . 5.4000000000000004 111.884 162.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.6 mtmt -65.8 -20.95 66.44 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 119.893 -1.754 . . . . 4.25 113.652 174.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -73.18 -10.39 59.72 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.239 -0.913 . . . . 1.98 113.447 168.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.02 -44.44 15.21 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 117.334 -1.317 . . . . 2.3799999999999999 111.471 158.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -48.52 -44.59 36.31 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 120.86 1.664 . . . . 1.9399999999999999 113.632 176.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -55.37 -30.29 60.06 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.105 1.15 . . . . 4.54 114.105 174.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 39.5 mt -78.4 -38.25 42.04 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.481 -0.762 . . . . 2.0600000000000001 111.892 173.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 9.5 mm -58.8 -53.39 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 124.004 0.815 . . . . 1.8999999999999999 109.669 -174.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -60.61 -31.34 70.52 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.256 0.835 . . . . 2.6200000000000001 113.256 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -73.84 -39.9 63.69 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.927 1.691 . . . . 3.3799999999999999 112.738 176.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.02 -18.02 22.29 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 114.09 1.144 . . . . 4.21 114.09 -173.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -58.88 -24.2 61.92 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.847 1.259 . . . . 3.0800000000000001 113.021 166.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.58 -24.75 45.35 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.065 1.135 . . . . 3.0699999999999998 114.065 169.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -109.34 -16.49 14.02 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.739 1.385 . . . . 2.5899999999999999 114.739 -170.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 5.7 t-80 -142.08 97.2 3.09 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 120.57 -1.331 . . . . 4.6299999999999999 112.576 -163.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -65.49 167.52 8.68 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 108.857 -0.794 . . . . 4.7999999999999998 108.857 149.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -67.39 31.35 0.21 Allowed Glycine 0 CA--C 1.527 0.818 0 C-N-CA 126.113 1.816 . . . . 3.73 116.799 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 30.8 mmt-85 -76.24 50.57 0.64 Allowed 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.476 1.638 . . . . 6.2999999999999998 109.864 161.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.9 mt -62.29 136.71 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.023 1.329 . . . . 3.8500000000000001 111.144 -162.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 12.8 t -117.83 155.91 29.28 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.667 1.187 . . . . 3.04 109.471 167.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -56.35 -34.78 66.94 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.488 1.115 . . . . 3.73 113.122 -173.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -68.52 -21.78 64.56 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.773 2.029 . . . . 3.9199999999999999 114.052 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -66.96 -58.63 4.59 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.008 1.277 . . . . 3.0899999999999999 110.944 178.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -50.03 -49.56 50.48 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.787 -0.571 . . . . 3.3999999999999999 111.706 172.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -61.17 -39.57 90.61 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.725 -0.609 . . . . 1.3200000000000001 112.085 -176.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 27.5 m -64.85 -44.18 90.58 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.746 1.618 . . . . 2.8199999999999998 110.86 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 88.4 mt -64.83 -36.47 84.45 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 117.847 -1.073 . . . . 2.1200000000000001 113.097 177.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 34.5 mm -56.21 -45.32 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 CA-C-N 120.898 1.681 . . . . 2.1600000000000001 111.344 172.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -64.82 -19.4 65.32 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 123.849 0.738 . . . . 1.1200000000000001 113.272 177.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.37 -20.82 65.94 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-O 118.257 -1.302 . . . . 1.03 113.915 173.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.3 mp -86.95 -43.09 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 CA-C-N 119.607 1.704 . . . . 2.1299999999999999 109.994 164.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 11.5 m -77.92 66.01 3.48 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.868 1.667 . . . . 2.27 111.375 -168.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -131.91 -75.39 0.12 Allowed Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.853 1.692 . . . . 1.6299999999999999 112.961 -174.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.52 -59.43 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.256 2.638 . . . . 1.6499999999999999 112.753 -168.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.3 pp -69.08 -11.55 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 113.282 0.845 . . . . 2.8599999999999999 113.282 -173.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -56.5 -35.9 68.53 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.624 1.102 . . . . 2.0600000000000001 112.899 175.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -74.08 -10.24 59.43 Favored 'General case' 0 CA--C 1.55 0.979 0 O-C-N 120.287 -1.508 . . . . 5.2800000000000002 112.785 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.1 tt -93.88 -30.33 14.84 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.176 2.19 . . . . 2.6600000000000001 112.377 166.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 91.6 mt -49.24 -48.14 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 120.661 -1.274 . . . . 2.2000000000000002 109.558 165.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -57.21 -30.31 64.46 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 115.458 1.651 . . . . 3.8100000000000001 115.458 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.67 -54.14 15.27 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.846 -0.427 . . . . 6.1799999999999997 109.846 168.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -58.8 -41.69 87.36 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.791 1.404 . . . . 3.0 114.791 -172.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -69.66 -17.65 63.52 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 119.541 1.064 . . . . 3.25 112.471 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.8 -50.82 4.3 Favored 'General case' 0 CA--C 1.514 -0.409 0 O-C-N 121.232 -0.918 . . . . 2.2999999999999998 111.735 177.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 CA--C 1.539 0.544 0 CA-C-N 114.954 -1.021 . . . . 4.9400000000000004 112.757 -179.081 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 111.942 0.349 . . . . 3.2799999999999998 111.942 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.9 t -64.69 151.9 43.8 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.48 0.712 . . . . 3.3300000000000001 110.329 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.502 ' CD ' ' HZ1' ' A' ' 10' ' ' LYS . 4.5 tp10 -51.09 -38.95 54.82 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.484 1.114 . . . . 2.5299999999999998 112.033 -173.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.54 -49.16 73.39 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.281 1.432 . . . . 1.8999999999999999 111.611 178.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -72.95 -46.14 54.13 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.521 -0.737 . . . . 3.1699999999999999 111.341 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.502 ' HZ1' ' CD ' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -48.85 -37.13 18.6 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.635 0.731 . . . . 6.9900000000000002 110.951 169.657 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.96 -47.35 25.43 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.301 1.44 . . . . 1.53 112.326 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 74.3 t -54.66 -38.5 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 120.027 1.285 . . . . 1.7 110.398 171.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 85.5 mt -60.37 -55.01 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 118.403 -0.808 . . . . 2.3700000000000001 110.364 170.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.4 t -56.09 -40.98 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.537 1.062 . . . . 1.75 112.569 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -64.35 -36.98 85.88 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.265 -0.897 . . . . 2.0699999999999998 111.566 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.5 t -80.84 -35.98 15.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 124.363 1.065 . . . . 1.8999999999999999 111.339 -178.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.418 ' CD ' ' HZ3' ' A' ' 21' ' ' LYS . 14.6 tm-20 -54.83 -49.96 69.78 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.032 0.933 . . . . 2.8799999999999999 109.98 164.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -66.14 -9.48 31.94 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.496 1.295 . . . . 2.6400000000000001 114.496 -170.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -112.46 -50.42 2.9 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.729 1.211 . . . . 3.6699999999999999 113.631 -178.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -59.68 -25.87 65.1 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.368 1.44 . . . . 3.4700000000000002 112.912 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.418 ' HZ3' ' CD ' ' A' ' 17' ' ' GLU . 7.3 ptmt -53.64 -20.45 5.29 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.623 -1.298 . . . . 2.8700000000000001 114.437 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -80.3 -2.86 47.05 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.43 1.27 . . . . 3.7400000000000002 114.43 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.475 0.821 0 C-N-CA 126.298 1.839 . . . . 3.6800000000000002 109.53 171.285 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.9 pt . . . . . 0 CA--C 1.537 0.465 0 N-CA-C 109.735 -0.468 . . . . 3.6899999999999999 109.735 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.7 t -71.82 129.72 39.33 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 120.549 -1.344 . . . . 3.2000000000000002 109.932 166.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.6 mttp -61.53 -20.52 63.34 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.023 -1.048 . . . . 3.3700000000000001 111.815 173.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.8 m -68.72 -28.41 66.8 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.357 -0.839 . . . . 3.1699999999999999 112.99 172.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.2 m -74.98 -21.42 59.16 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 120.029 1.286 . . . . 1.76 113.71 -173.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -63.15 -57.26 11.14 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.656 -1.278 . . . . 3.1400000000000001 112.021 165.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -60.65 -30.06 69.65 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.849 -0.532 . . . . 3.5699999999999998 112.227 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.98 -58.64 5.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.31 2.244 . . . . 3.5099999999999998 110.266 171.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -52.53 -37.66 58.05 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 127.798 2.439 . . . . 2.0899999999999999 113.868 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 58.9 mt -56.68 -16.17 5.83 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 115.088 1.514 . . . . 2.2799999999999998 115.088 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . 0.253 0.1 OUTLIER -110.87 11.42 22.36 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 115.058 1.503 . . . . 2.9100000000000001 115.058 171.786 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.94 -56.28 2.22 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.54 1.136 . . . . 2.6200000000000001 111.532 164.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -81.28 -46.86 14.14 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.327 -0.858 . . . . 3.1200000000000001 112.344 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.43 15.4 3.06 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.385 -1.447 . . . . 2.96 114.295 -172.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.15 29.69 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 130.582 3.553 . . . . 2.3300000000000001 118.226 -174.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.412 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 21.4 m-70 -126.89 -67.1 0.87 Allowed 'General case' 0 CA--C 1.545 0.786 0 O-C-N 120.07 -1.644 . . . . 2.4100000000000001 111.705 -178.054 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.3 ptp -65.3 -11.83 45.61 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.301 1.41 . . . . 3.04 114.181 167.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.4 tp -58.44 99.54 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.12 1.768 . . . . 3.2999999999999998 110.286 -176.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.19 61.39 6.8 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.412 1.085 . . . . 4.4500000000000002 110.143 -171.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.492 ' CG ' ' H ' ' A' ' 53' ' ' THR . 36.1 t70 48.1 -135.74 1.04 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 127.318 2.247 . . . . 5.0 112.904 -178.125 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.492 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 14.4 p -76.61 -37.89 55.67 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 127.082 2.153 . . . . 3.25 111.18 -170.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.82 -40.58 93.19 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 119.166 0.893 . . . . 1.8100000000000001 111.824 175.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -68.81 -56.91 6.51 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.326 1.051 . . . . 3.1400000000000001 111.259 172.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -56.4 -39.27 72.72 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 114.459 1.281 . . . . 6.1500000000000004 114.459 -176.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 48.6 mmtt -54.15 -38.19 65.24 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.67 1.577 . . . . 3.8900000000000001 113.45 174.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.14 -30.02 61.54 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.869 -1.062 . . . . 1.8100000000000001 113.423 175.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.61 -47.96 65.33 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.173 0.897 . . . . 1.72 111.206 171.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -63.46 -32.36 73.78 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.433 1.093 . . . . 2.04 112.825 -175.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -57.27 -32.24 66.41 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 119.287 0.949 . . . . 4.1900000000000004 113.35 173.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -75.58 -43.54 47.77 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.01 0.924 . . . . 1.8500000000000001 111.637 175.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 27.0 mm -59.88 -45.21 95.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 117.847 0.294 . . . . 2.2400000000000002 110.671 -170.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -59.28 -40.4 85.98 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.837 0.827 . . . . 2.98 113.094 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -65.2 -23.83 67.2 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.794 1.238 . . . . 4.0899999999999999 112.486 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -93.21 -33.68 13.89 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 125.827 1.651 . . . . 3.3300000000000001 113.171 174.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -58.71 -28.87 66.21 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.663 -1.273 . . . . 2.7200000000000002 112.961 163.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.34 -14.43 62.92 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.115 1.524 . . . . 2.4300000000000002 115.115 167.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -136.69 3.1 2.72 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.972 1.841 . . . . 2.5499999999999998 115.972 -165.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -150.54 127.89 11.37 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 119.789 -1.819 . . . . 4.1699999999999999 112.231 -171.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -58.71 13.13 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 130.494 3.518 . . . . 4.7699999999999996 115.134 173.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.47 -18.96 4.12 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 118.537 -2.602 . . . . 3.5 111.745 -162.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -44.19 135.83 4.22 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.181 1.49 . . . . 5.5499999999999998 107.232 150.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -140.23 146.77 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.983 0.897 . . . . 4.2599999999999998 109.367 171.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 16.1 m -56.69 167.82 0.69 Allowed 'General case' 0 CA--C 1.552 1.057 0 CA-C-O 121.995 0.902 . . . . 2.2799999999999998 111.969 162.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -76.23 -33.16 59.21 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-O 124.258 1.98 . . . . 3.77 109.874 160.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.31 -20.38 48.09 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 130.284 3.434 . . . . 3.6699999999999999 110.859 -162.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -68.11 -58.46 4.44 Favored 'General case' 0 C--O 1.22 -0.475 0 C-N-CA 127.242 2.217 . . . . 4.8499999999999996 111.859 176.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -48.32 -49.14 35.26 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 121.395 1.907 . . . . 2.8100000000000001 111.937 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 14.7 t-105 -59.68 -47.71 84.56 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 118.802 -0.618 . . . . 1.0600000000000001 110.84 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 94.6 m -58.59 -51.29 70.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.958 1.303 . . . . 3.46 111.249 175.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.8 mt -58.6 -33.35 69.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.33 1.452 . . . . 2.21 113.227 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 19.5 mm -50.6 -42.48 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 CA-C-N 120.441 1.473 . . . . 1.8200000000000001 111.047 173.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.94 -17.88 37.96 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.455 1.026 . . . . 0.70999999999999996 114.776 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.75 -24.21 60.69 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-N 118.472 1.136 . . . . 0.78000000000000003 113.741 174.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.6 mp -95.32 -44.32 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 119.398 1.599 . . . . 1.71 109.704 169.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.8 m -74.29 54.07 0.54 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.167 2.187 . . . . 2.1499999999999999 109.983 165.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -124.1 -77.79 0.35 Allowed Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.532 1.539 . . . . 1.1399999999999999 111.182 177.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.88 -46.84 0.68 Allowed 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 123.323 2.682 . . . . 1.0900000000000001 112.685 -174.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -76.11 -16.38 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 113.195 0.813 . . . . 2.5 113.195 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.89 -31.38 64.64 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.34 0.867 . . . . 2.2599999999999998 113.34 -169.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -45.84 90.87 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.283 -0.886 . . . . 3.7000000000000002 111.777 168.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -57.81 -36.75 72.67 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 123.83 0.852 . . . . 2.8399999999999999 111.493 -173.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.1 mt -48.42 -59.7 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.72 1.208 . . . . 2.0299999999999998 110.699 171.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -64.39 -32.93 74.75 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.379 -0.825 . . . . 1.8200000000000001 112.978 -176.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.322 3.1 pt-20 -81.91 -22.66 36.68 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 112.989 0.737 . . . . 2.9100000000000001 112.989 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -68.15 -41.48 81.51 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 125.381 1.472 . . . . 3.0 113.761 167.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.08 -40.42 76.91 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.642 1.11 . . . . 2.6699999999999999 110.371 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 . . . . . 0 N--CA 1.476 0.855 0 C-N-CA 123.339 0.656 . . . . 3.6899999999999999 111.28 173.899 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.412 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 15.6 m-85 . . . . . 0 N--CA 1.472 0.642 0 N-CA-C 113.481 0.919 . . . . 3.5800000000000001 113.481 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.4 t -67.43 152.92 44.84 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.514 0.726 . . . . 3.75 111.73 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -64.86 -31.65 72.98 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 114.149 1.166 . . . . 2.5899999999999999 114.149 -159.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.77 -46.39 84.62 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.524 1.056 . . . . 1.77 110.184 177.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.25 -50.34 22.85 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.136 -0.935 . . . . 3.1099999999999999 110.913 -176.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -38.43 -50.17 1.5 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.479 1.036 . . . . 4.9400000000000004 113.239 164.065 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.19 -37.39 80.89 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 118.234 -0.889 . . . . 1.54 112.553 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 70.4 t -61.43 -40.2 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.842 1.201 . . . . 1.71 110.477 169.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 48.0 mt -58.72 -51.12 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 119.452 1.024 . . . . 2.02 109.894 170.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 19.7 t -61.95 -41.02 89.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.799 1.24 . . . . 1.6799999999999999 112.717 -176.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.7 mp -63.72 -43.39 96.68 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.287 -0.883 . . . . 1.8300000000000001 111.078 175.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 54.1 t -71.66 -36.16 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.861 0.865 . . . . 1.8200000000000001 112.142 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . 0.406 ' CD ' ' HZ3' ' B' ' 124' ' ' LYS . 10.0 tm-20 -55.07 -51.06 67.55 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.496 1.118 . . . . 3.21 110.358 166.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -64.32 -6.52 7.14 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.947 1.462 . . . . 2.4700000000000002 114.947 -174.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -110.24 -57.37 2.21 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.988 1.315 . . . . 3.3900000000000001 112.856 -178.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -61.5 -20.86 63.67 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.426 1.012 . . . . 3.52 113.45 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . 0.406 ' HZ3' ' CD ' ' B' ' 120' ' ' GLU . 5.9 ptmt -53.86 -19.36 4.33 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 120.278 -1.513 . . . . 2.8799999999999999 114.598 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -81.14 -1.66 45.35 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 114.406 1.261 . . . . 3.6800000000000002 114.406 174.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 29.4 m . . . . . 0 N--CA 1.477 0.918 0 C-N-CA 125.503 1.521 . . . . 3.5699999999999998 110.778 172.569 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 29.7 pt . . . . . 0 N--CA 1.468 0.475 0 N-CA-C 108.72 -0.845 . . . . 3.7000000000000002 108.72 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 41.7 t -61.21 122.2 14.47 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.918 -1.114 . . . . 3.1000000000000001 109.726 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 14.2 mttp -64.45 -17.35 63.74 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 120.961 -1.087 . . . . 3.7400000000000002 111.379 177.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 37.0 m -63.98 -29.54 70.69 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.331 -0.856 . . . . 2.96 112.778 167.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 58.6 m -74.83 -20.89 59.57 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.967 1.258 . . . . 1.75 113.733 -174.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.18 -58.68 5.38 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.171 1.35 . . . . 3.3900000000000001 110.744 167.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.6 ptt180 -60.49 -27.04 67.27 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.658 -0.651 . . . . 4.2599999999999998 112.475 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -66.82 -58.61 4.69 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.259 1.824 . . . . 3.6200000000000001 110.601 169.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.9 tmm? -50.98 -39.11 54.71 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 127.744 2.418 . . . . 2.0800000000000001 113.514 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 75.2 mt -63.14 -0.03 0.69 Allowed 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 116.106 1.891 . . . . 2.0099999999999998 116.106 175.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . 0.263 0.1 OUTLIER -118.46 9.88 12.49 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.27 1.582 . . . . 2.8799999999999999 115.27 164.044 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.91 -64.36 1.19 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.29 1.436 . . . . 2.6299999999999999 111.826 168.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -76.57 -30.2 56.95 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.778 0.717 . . . . 3.1299999999999999 111.511 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 mp -100.98 77.78 1.87 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.777 0.798 . . . . 2.8399999999999999 110.87 165.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -109.68 0.7 19.09 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.74 1.385 . . . . 2.0699999999999998 114.74 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -109.9 -39.83 4.95 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.9 1.227 . . . . 2.1499999999999999 113.671 -171.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 17.3 ptp -85.41 -15.78 41.94 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.766 -1.209 . . . . 2.6699999999999999 113.714 171.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.65 103.41 0.25 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 126.357 1.863 . . . . 3.0899999999999999 111.575 -166.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.14 59.1 5.42 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.076 0.951 . . . . 4.5300000000000002 110.841 -172.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . 0.527 ' CG ' ' H ' ' B' ' 156' ' ' THR . 35.3 t70 50.19 -139.7 0.86 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 127.042 2.137 . . . . 4.8099999999999996 112.395 -176.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 156' ' ' THR . . . . . 0.527 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 18.9 p -77.34 -35.58 54.58 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 126.669 1.988 . . . . 3.5 111.485 -167.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.3 -41.65 95.11 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 119.773 1.17 . . . . 1.9199999999999999 111.509 176.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 -66.62 -55.82 13.53 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.955 1.302 . . . . 3.0099999999999998 111.346 173.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -53.36 -39.36 64.12 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.573 1.323 . . . . 6.3600000000000003 114.573 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -60.34 -33.6 72.63 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.603 1.547 . . . . 3.8399999999999999 113.511 177.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -56.21 -28.16 57.31 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 118.148 -0.929 . . . . 1.8600000000000001 113.095 175.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.73 -48.68 63.19 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 118.757 0.708 . . . . 1.8300000000000001 111.657 169.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -65.88 -30.87 71.54 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.174 0.99 . . . . 2.2200000000000002 113.174 -173.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 23.5 mtmt -58.16 -30.38 66.34 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.19 0.905 . . . . 4.2699999999999996 113.351 171.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 5.9 mt -80.77 -42.51 21.65 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.145 0.978 . . . . 1.9199999999999999 111.742 174.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 16.1 mm -58.12 -44.73 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 CA-C-N 118.556 0.617 . . . . 2.3300000000000001 110.701 -173.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -56.49 -42.23 77.94 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.655 0.613 . . . . 3.1499999999999999 112.655 177.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -65.57 -25.8 67.58 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.504 1.121 . . . . 3.8199999999999998 113.275 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.24 -37.47 9.66 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.888 1.275 . . . . 3.54 113.131 -177.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -65.69 -22.45 66.63 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 120.904 -1.122 . . . . 3.2400000000000002 112.418 165.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.57 -23.54 62.62 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.729 1.381 . . . . 2.4900000000000002 114.729 164.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -118.31 -9.86 10.33 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.853 1.797 . . . . 2.5299999999999998 115.853 -169.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -140.83 129.44 22.76 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 120.887 1.676 . . . . 4.96 112.721 -171.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -64.09 70.41 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 126.993 2.117 . . . . 4.6299999999999999 112.986 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 57.05 -1.75 0.11 Allowed Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.467 1.508 . . . . 3.96 114.209 -167.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 15.3 mmt85 -69.39 144.53 53.36 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 118.675 1.237 . . . . 5.54 109.1 -172.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.7 mt -126.86 138.15 55.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 104.767 -2.309 . . . . 4.8300000000000001 104.767 156.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 39.3 m -74.98 -100.31 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.663 -0.648 . . . . 2.25 110.086 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -151.85 -66.72 0.17 Allowed 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.278 -1.513 . . . . 3.8300000000000001 109.339 166.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -22.2 -46.91 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 130.486 3.515 . . . . 3.2200000000000002 114.808 149.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -48.63 -61.65 1.92 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.583 1.953 . . . . 4.7999999999999998 115.291 169.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -54.85 -42.54 72.11 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 119.759 -1.838 . . . . 2.98 111.56 -178.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 18.6 t-105 -62.09 -44.75 95.98 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.959 0.903 . . . . 0.97999999999999998 111.509 178.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 90.6 m -61.26 -44.93 96.44 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.956 1.702 . . . . 3.6099999999999999 111.302 174.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.7 mt -62.28 -32.67 73.42 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 117.32 -1.324 . . . . 2.1200000000000001 112.794 177.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 26.4 mm -52.94 -42.13 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 121.556 1.98 . . . . 1.8300000000000001 110.684 173.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.82 -9.86 35.55 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 125.153 1.358 . . . . 0.68000000000000005 115.115 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -83.67 -21.67 57.49 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-N 119.023 1.412 . . . . 0.85999999999999999 113.528 169.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.7 mp -100.12 -52.1 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 118.771 1.285 . . . . 1.78 109.187 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 18.2 m -75.46 58.89 1.05 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.395 2.278 . . . . 2.3399999999999999 109.269 166.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -141.94 -70.54 0.03 OUTLIER Glycine 0 CA--C 1.526 0.725 0 C-N-CA 126.183 1.849 . . . . 1.0900000000000001 110.15 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.23 -51.67 3.35 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.959 2.439 . . . . 1.28 112.051 175.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 1.8 pp -81.64 -13.74 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 113.038 0.755 . . . . 2.46 113.038 -174.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.26 -31.64 72.12 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.221 0.822 . . . . 2.0600000000000001 113.221 -170.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . 0.424 ' HZ2' ' CD ' ' B' ' 199' ' ' GLU . 0.0 OUTLIER -55.62 -46.82 77.33 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.538 -0.726 . . . . 3.54 112.558 167.677 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.9 tt -60.17 -34.62 73.83 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.588 -0.72 . . . . 2.5099999999999998 111.379 -172.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 62.3 mt -51.46 -61.91 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.65 1.18 . . . . 1.9199999999999999 109.853 171.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -59.47 -36.15 75.45 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.835 0.68 . . . . 1.97 112.835 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . 0.424 ' CD ' ' HZ2' ' B' ' 195' ' ' LYS 0.345 3.1 pt-20 -80.19 -22.29 42.06 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 112.746 0.647 . . . . 2.9900000000000002 112.746 179.608 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -70.61 -39.87 73.5 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 125.003 1.321 . . . . 2.8199999999999998 113.617 167.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -53.54 -40.81 65.81 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.918 1.235 . . . . 2.52 110.506 175.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -48.13 76.62 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.267 1.027 . . . . 3.8599999999999999 110.936 177.11 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 . . . . . 0 CA--C 1.541 0.622 0 N-CA-C 113.725 1.009 . . . . 5.9800000000000004 113.725 179.798 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 . . . . . 0 C--O 1.246 0.9 0 CA-C-O 119.748 -0.168 . . . . 3.3199999999999998 111.148 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.0 p -75.13 165.75 24.73 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.185 0.594 . . . . 2.1000000000000001 111.962 -175.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -58.68 -44.98 90.39 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.445 0.698 . . . . 2.7000000000000002 110.643 173.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.87 -38.61 86.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.194 1.398 . . . . 2.21 110.134 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -73.09 -53.79 10.16 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.085 -1.01 . . . . 2.9500000000000002 110.931 -177.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.0 mmtp -54.82 -33.32 61.45 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.777 -1.202 . . . . 5.7999999999999998 112.296 168.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.95 -45.09 83.03 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 117.955 -1.022 . . . . 1.76 112.425 169.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.6 t -58.53 -38.62 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-N 120.745 1.611 . . . . 2.0099999999999998 110.458 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.7 mt -56.34 -52.95 45.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 118.042 -0.98 . . . . 2.0600000000000001 111.323 165.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -61.52 -33.93 59.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 120.759 1.618 . . . . 1.8600000000000001 114.094 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.19 -36.48 79.64 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 120.424 -1.422 . . . . 1.8700000000000001 111.124 172.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 43.9 t -74.35 -34.94 38.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 123.707 0.803 . . . . 1.95 110.855 178.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.55 -53.8 54.05 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.897 1.279 . . . . 3.4500000000000002 111.122 164.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -52.93 -28.92 25.71 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.83 1.418 . . . . 3.5499999999999998 114.83 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -81.33 -61.75 1.85 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.121 0.785 . . . . 3.6800000000000002 113.121 168.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -64.0 -29.12 70.3 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.736 0.643 . . . . 3.0099999999999998 112.736 -167.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.5 ptmt -51.36 -27.19 9.14 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.867 1.062 . . . . 3.1600000000000001 113.867 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -94.95 -8.97 35.44 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 115.362 1.616 . . . . 3.7999999999999998 115.362 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.7 m . . . . . 0 N--CA 1.484 1.257 0 CA-C-N 120.312 1.415 . . . . 2.8900000000000001 109.606 167.609 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 15.4 tt . . . . . 0 N--CA 1.468 0.457 0 N-CA-C 109.115 -0.698 . . . . 4.1200000000000001 109.115 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.8 t -113.36 163.53 14.73 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.729 0.776 . . . . 2.6400000000000001 110.623 167.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -53.63 -27.66 28.44 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.385 1.074 . . . . 5.6500000000000004 113.696 168.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.9 p -72.36 -25.81 61.67 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.695 0.998 . . . . 2.6699999999999999 113.695 172.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 m -78.08 -49.1 14.59 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.805 0.842 . . . . 1.73 111.257 -175.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -48.07 -57.61 5.58 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.798 1.239 . . . . 3.4900000000000002 112.024 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 13.4 ptt85 -59.23 -15.53 15.82 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.011 1.115 . . . . 5.5800000000000001 114.011 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -109.66 -26.05 10.09 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 114.513 1.301 . . . . 3.3300000000000001 114.513 -176.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 10.5 tmm? -53.06 -45.48 68.13 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 109.003 -0.74 . . . . 2.3300000000000001 109.003 151.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.8 mt -64.1 -11.77 33.04 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.114 1.524 . . . . 1.79 115.114 172.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -101.23 -23.3 14.45 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.1 0.96 . . . . 2.3799999999999999 113.582 172.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -99.71 -41.28 7.36 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.257 1.206 . . . . 2.5499999999999998 114.257 178.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -100.95 -20.45 15.43 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.89 1.276 . . . . 3.1099999999999999 114.356 -168.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.5 mt -118.48 41.4 2.98 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.534 1.534 . . . . 3.6000000000000001 111.406 165.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -70.72 -15.94 62.74 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.648 1.351 . . . . 1.46 114.648 -172.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -94.59 -15.44 24.06 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.547 1.067 . . . . 2.48 112.542 -170.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.2 mmm -80.64 14.62 2.02 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 126.153 1.781 . . . . 3.0800000000000001 114.703 174.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.3 mp -99.01 128.37 45.13 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.758 2.023 . . . . 3.1800000000000002 111.914 -176.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -109.49 -1.94 17.98 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.722 1.209 . . . . 5.1699999999999999 112.78 169.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -177.5 170.06 2.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 129.758 3.223 . . . . 4.3200000000000003 106.387 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -31.83 -39.08 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 125.329 1.452 . . . . 3.3500000000000001 112.573 147.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.13 -41.08 52.88 Favored Glycine 0 N--CA 1.473 1.16 0 C-N-CA 128.806 3.098 . . . . 1.8200000000000001 115.608 -171.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -59.22 -41.17 88.03 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 117.874 0.837 . . . . 3.4700000000000002 110.563 172.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 74.8 mtm-85 -73.5 -36.58 65.78 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 118.169 -0.919 . . . . 5.8799999999999999 112.79 172.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.3 mtmm -54.88 -28.94 54.11 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 121.485 1.948 . . . . 6.1200000000000001 112.516 171.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.12 -19.16 60.67 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 115.592 1.701 . . . . 1.9199999999999999 115.592 170.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.87 -52.67 9.84 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.565 1.146 . . . . 1.9399999999999999 110.191 161.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -66.42 -31.33 72.02 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.984 0.914 . . . . 2.1600000000000001 112.493 -170.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.8 ptmm? -55.76 -25.0 38.63 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.302 1.223 . . . . 4.2999999999999998 114.302 166.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 12.0 mt -84.92 -43.09 14.37 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.31 1.044 . . . . 1.9299999999999999 111.379 172.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.7 mm -51.83 -39.74 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.102 1.361 . . . . 1.8600000000000001 112.12 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -69.91 -30.13 67.47 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.348 1.459 . . . . 2.23 113.899 177.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -85.66 -23.75 27.34 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.09 1.756 . . . . 4.5 112.742 175.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.14 -26.09 68.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.868 1.267 . . . . 5.0099999999999998 112.456 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -67.11 -13.25 61.76 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.485 1.914 . . . . 2.9199999999999999 114.499 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -78.69 -6.11 54.89 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.192 0.812 . . . . 4.5300000000000002 113.192 166.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -132.07 -34.54 1.26 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.78 1.232 . . . . 4.0899999999999999 114.192 -169.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.8 m170 -110.28 67.78 0.65 Allowed 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.345 -1.472 . . . . 5.3700000000000001 114.764 -165.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -74.44 67.17 1.44 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.564 1.545 . . . . 4.3200000000000003 111.996 173.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.67 -40.0 0.94 Allowed Glycine 0 CA--C 1.532 1.147 0 C-N-CA 126.285 1.898 . . . . 2.9900000000000002 113.502 -177.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -68.14 76.51 0.24 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 127.924 2.489 . . . . 9.6199999999999992 110.369 173.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.7 mm -65.58 139.01 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 O-C-N 121.425 -0.797 . . . . 3.73 109.814 171.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 t -91.92 167.27 12.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.414 1.086 . . . . 2.0800000000000001 112.864 176.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -72.72 -57.8 3.83 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.752 0.787 . . . . 3.5099999999999998 109.731 160.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.09 -35.81 62.5 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.933 2.093 . . . . 3.3700000000000001 112.946 -167.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -73.23 -22.89 60.33 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 113.722 1.008 . . . . 5.9400000000000004 113.722 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -57.01 -48.81 77.59 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 119.552 -1.968 . . . . 3.1600000000000001 110.51 166.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.7 t-105 -67.2 -41.99 84.91 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.691 -0.671 . . . . 0.88 111.502 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.62 -41.66 92.45 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 119.342 0.973 . . . . 3.98 112.049 171.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.66 -37.48 78.84 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.524 1.056 . . . . 1.8700000000000001 112.525 176.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 40.0 mm -55.06 -42.82 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 CA-C-N 120.7 1.591 . . . . 2.0499999999999998 111.802 173.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.97 -27.63 73.62 Favored Glycine 0 CA--C 1.531 1.063 0 CA-C-N 118.54 0.609 . . . . 1.05 112.588 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.25 -20.38 71.22 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 118.164 0.982 . . . . 0.77000000000000002 113.983 177.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 mp -91.74 -50.07 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.512 1.125 . . . . 2.0800000000000001 110.107 162.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.8 m -81.96 46.36 1.0 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.441 2.297 . . . . 2.4300000000000002 112.097 -171.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.59 -70.97 0.57 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 126.084 1.802 . . . . 1.1399999999999999 110.514 175.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -61.61 -45.28 18.18 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.012 2.475 . . . . 1.21 112.82 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.3 pt -73.12 -14.91 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 114.435 1.272 . . . . 1.8999999999999999 114.435 177.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.6 -40.57 83.61 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.094 0.861 . . . . 1.98 113.198 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -40.17 91.3 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 117.741 -1.584 . . . . 3.46 111.663 171.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -39.07 91.59 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 124.053 0.941 . . . . 2.6600000000000001 111.353 -175.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -53.9 -58.52 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 123.982 0.913 . . . . 2.27 110.893 166.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -63.44 -36.68 84.53 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.946 -1.096 . . . . 1.8500000000000001 113.08 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.279 2.6 pt-20 -81.29 -13.02 58.89 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.822 0.849 . . . . 3.0800000000000001 112.222 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.515 ' C ' ' H ' ' A' ' 99' ' ' GLN . 0.4 OUTLIER -72.82 -35.17 67.24 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 125.082 1.353 . . . . 2.2400000000000002 113.232 165.094 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -71.54 16.62 0.1 Allowed 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 123.935 1.826 . . . . 3.5600000000000001 111.505 168.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.515 ' H ' ' C ' ' A' ' 97' ' ' GLN . 4.2 mm-40 . . . . . 0 CA--C 1.534 0.356 0 C-N-CA 126.068 1.747 . . . . 2.6499999999999999 109.184 174.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 . . . . . 0 C--O 1.243 0.735 0 N-CA-C 109.923 -0.399 . . . . 3.3599999999999999 109.923 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.9 p -73.17 162.88 28.9 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.138 0.427 . . . . 1.8200000000000001 110.994 -175.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -60.14 -43.93 95.32 Favored 'General case' 0 C--O 1.221 -0.431 0 O-C-N 121.359 -0.838 . . . . 2.1000000000000001 111.196 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.87 -41.75 71.2 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.48 1.512 . . . . 2.0800000000000001 110.694 175.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -72.91 -54.81 7.73 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.421 1.088 . . . . 3.04 112.249 -175.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -56.27 -26.9 53.44 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.89 1.276 . . . . 5.5 112.239 168.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.73 -40.34 48.91 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 120.451 -1.406 . . . . 2.1000000000000001 112.608 169.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 37.3 t -58.81 -30.42 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 120.924 1.693 . . . . 2.0499999999999998 110.624 171.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 70.7 mt -58.22 -57.4 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 119.448 1.022 . . . . 2.0600000000000001 110.763 164.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 41.2 t -55.26 -38.56 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 125.656 1.582 . . . . 1.8300000000000001 114.617 177.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.7 mp -66.37 -33.96 76.88 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.408 -1.432 . . . . 2.0699999999999998 111.858 174.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 52.5 t -78.45 -33.59 17.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.157 0.583 . . . . 1.8799999999999999 110.768 -178.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -56.41 -51.58 67.85 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.797 0.839 . . . . 3.6000000000000001 111.563 164.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -52.65 -29.55 26.91 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.927 1.455 . . . . 3.6000000000000001 114.927 -177.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -82.37 -60.18 2.29 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.017 0.747 . . . . 3.4399999999999999 113.017 170.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -63.11 -29.3 70.69 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 119.01 -0.519 . . . . 2.9900000000000002 112.217 -166.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -51.31 -25.44 5.88 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.931 1.292 . . . . 3.0499999999999998 114.137 172.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -98.24 -9.41 25.62 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 115.083 1.512 . . . . 3.9100000000000001 115.083 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.482 1.141 0 CA-C-N 119.818 1.19 . . . . 2.77 109.158 166.71 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 19.9 tt . . . . . 0 N--CA 1.47 0.54 0 N-CA-C 109.754 -0.462 . . . . 4.2599999999999998 109.754 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 30.2 t -94.04 149.15 21.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.6 0.714 . . . . 2.8199999999999998 110.677 166.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . 0.533 ' HZ1' ' CG ' ' B' ' 170' ' ' ASP . 57.9 pttt -52.43 -20.56 2.92 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.772 1.229 . . . . 5.3099999999999996 113.975 164.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 92.8 p -81.56 -21.31 38.55 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.354 1.242 . . . . 2.73 114.354 169.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 14.0 m -78.06 -45.4 23.65 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.916 -1.115 . . . . 1.5 111.408 -175.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -47.07 -58.36 4.09 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.625 1.17 . . . . 3.7599999999999998 111.516 178.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 18.1 ptt85 -58.57 -14.98 9.44 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.438 1.495 . . . . 5.0499999999999998 113.652 -178.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -107.86 -31.01 8.19 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 114.706 1.373 . . . . 2.8399999999999999 114.706 -178.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 7.4 tmm? -52.52 -44.42 65.72 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.651 -0.499 . . . . 2.2599999999999998 109.651 156.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.5 mt -59.9 -22.34 62.25 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.931 1.692 . . . . 1.6000000000000001 114.182 173.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -94.65 -15.2 24.18 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.411 1.084 . . . . 2.4199999999999999 112.979 177.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.17 -41.54 5.11 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.91 1.078 . . . . 2.5499999999999998 113.91 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -100.24 -15.99 17.89 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.369 1.468 . . . . 3.1099999999999999 113.899 -171.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 96.9 mt -125.38 38.33 4.2 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.296 1.839 . . . . 3.5800000000000001 111.966 166.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -69.57 -17.73 63.58 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.827 1.417 . . . . 1.3 114.827 -172.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -88.93 -0.79 57.7 Favored 'General case' 0 CA--C 1.555 1.153 0 O-C-N 120.565 -1.334 . . . . 2.2599999999999998 112.375 -171.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 4.5 mmm -101.71 12.97 36.23 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.273 2.229 . . . . 3.0899999999999999 113.447 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 9.2 mp -96.71 128.64 43.85 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.734 2.014 . . . . 3.1699999999999999 111.412 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 33.0 t -112.23 -1.75 15.1 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.117 1.367 . . . . 5.4100000000000001 112.808 169.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -178.04 170.8 1.81 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 129.751 3.22 . . . . 4.5 106.917 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 m -33.24 -40.0 0.06 Allowed 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 125.133 1.373 . . . . 3.5899999999999999 111.915 148.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.09 -42.49 39.95 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 128.394 2.902 . . . . 1.9199999999999999 115.389 -171.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -58.35 -43.56 88.38 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 117.642 0.721 . . . . 3.4500000000000002 110.78 172.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 83.2 mtm-85 -69.68 -39.52 76.92 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 118.244 -0.884 . . . . 5.8600000000000003 112.467 172.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 17.2 mtmm -54.16 -29.58 46.12 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 121.35 1.886 . . . . 6.0599999999999996 112.299 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -75.29 -19.37 59.72 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 115.282 1.586 . . . . 1.8700000000000001 115.282 171.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -76.37 -54.29 6.96 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.141 1.376 . . . . 1.8400000000000001 110.395 161.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -66.43 -31.82 72.8 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.87 0.868 . . . . 2.0099999999999998 112.394 -169.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 6.0 ptmm? -56.17 -25.56 47.22 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.774 1.028 . . . . 4.4299999999999997 113.774 167.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.6 mt -84.54 -41.78 16.15 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.216 1.007 . . . . 1.8999999999999999 111.391 174.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 20.3 mm -54.57 -43.1 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.385 1.074 . . . . 1.78 111.233 -177.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -65.09 -27.87 69.06 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.861 1.264 . . . . 2.2000000000000002 113.68 176.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -85.21 -24.22 27.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.956 1.303 . . . . 4.5199999999999996 112.782 174.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 14.2 tp -66.88 -23.85 66.05 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.596 1.158 . . . . 4.8700000000000001 112.355 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . 0.533 ' CG ' ' HZ1' ' B' ' 138' ' ' LYS . 0.8 OUTLIER -55.46 -25.08 34.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.223 2.209 . . . . 3.1400000000000001 114.326 166.974 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.2 -9.08 59.04 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.601 0.963 . . . . 4.2599999999999998 113.601 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -130.61 -33.05 1.66 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.259 1.207 . . . . 3.8599999999999999 114.259 -166.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 22.4 m170 -114.21 74.76 0.89 Allowed 'General case' 0 CA--C 1.548 0.88 0 O-C-N 120.463 -1.398 . . . . 5.1799999999999997 114.749 -168.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -82.67 76.76 9.51 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.002 0.921 . . . . 4.0599999999999996 110.824 166.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.61 -41.5 1.2 Allowed Glycine 0 N--CA 1.478 1.46 0 C-N-CA 126.518 2.009 . . . . 3.0299999999999998 114.598 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -68.52 82.83 0.27 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 128.064 2.546 . . . . 9.7899999999999991 109.967 171.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 26.6 mm -72.41 136.62 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 O-C-N 120.877 -1.14 . . . . 3.7599999999999998 109.519 171.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 8.4 t -94.06 137.67 33.0 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.457 1.103 . . . . 2.3100000000000001 111.275 170.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -50.14 -54.49 20.36 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.487 1.115 . . . . 3.6499999999999999 110.28 171.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.65 -30.67 65.59 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.813 2.045 . . . . 3.4900000000000002 112.278 -170.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -74.29 -22.93 59.06 Favored 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 113.049 0.759 . . . . 5.9100000000000001 113.049 -177.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -58.63 -47.32 84.8 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 119.503 -1.998 . . . . 3.2799999999999998 110.471 165.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 19.0 t-105 -68.59 -37.61 79.97 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.144 -0.931 . . . . 0.91000000000000003 111.724 -173.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 82.3 p -63.09 -47.09 84.35 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 119.649 1.113 . . . . 3.4399999999999999 110.689 171.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.29 -37.71 81.36 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.087 -0.959 . . . . 1.8100000000000001 112.85 -178.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 39.6 mm -54.62 -41.89 57.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 CA-C-N 120.589 1.54 . . . . 1.9199999999999999 111.467 173.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.55 -26.31 73.69 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 123.684 0.659 . . . . 1.01 112.789 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -67.52 -19.99 71.38 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-N 118.097 0.949 . . . . 0.68999999999999995 113.326 177.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.8 mp -96.71 -46.47 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 CA-C-N 118.284 1.042 . . . . 2.0099999999999998 110.132 165.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 2.9 m -81.15 39.43 0.51 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.042 2.137 . . . . 2.3500000000000001 112.351 -175.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -108.97 -70.62 0.68 Allowed Glycine 0 CA--C 1.529 0.96 0 C-N-CA 126.149 1.833 . . . . 1.23 110.174 173.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -61.02 -43.39 30.36 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.057 2.505 . . . . 1.05 113.029 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 11.1 pt -75.15 -17.56 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 114.454 1.279 . . . . 1.8999999999999999 114.454 177.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -58.36 -42.51 87.12 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.548 1.067 . . . . 1.8899999999999999 113.588 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.29 -41.62 89.41 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.979 1.263 . . . . 3.6200000000000001 111.993 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -40.22 90.78 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 123.997 0.919 . . . . 2.8399999999999999 111.714 -176.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 88.0 mt -52.85 -63.09 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.591 0.756 . . . . 2.3100000000000001 110.041 168.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -59.09 -37.19 76.54 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.292 -0.88 . . . . 1.8100000000000001 112.906 -175.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.295 2.5 pt-20 -78.02 -18.29 56.05 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 112.385 0.513 . . . . 3.21 112.385 178.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . 0.429 ' C ' ' H ' ' B' ' 202' ' ' GLN . 0.4 OUTLIER -75.99 -35.02 59.75 Favored 'General case' 0 C--N 1.344 0.334 0 C-N-CA 125.392 1.477 . . . . 2.2400000000000002 114.611 169.052 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -65.19 -1.13 2.03 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 122.801 1.286 . . . . 2.98 111.736 171.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.429 ' H ' ' C ' ' B' ' 200' ' ' GLN . 1.1 mt-30 -112.89 -70.16 0.82 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.001 1.721 . . . . 3.4199999999999999 109.597 177.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 . . . . . 0 N--CA 1.483 1.206 0 C-N-CA 131.695 3.998 . . . . 5.1100000000000003 116.413 177.15 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.465 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 50.8 m-85 . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 115.948 1.832 . . . . 3.2999999999999998 115.948 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.6 p -65.5 158.27 27.37 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.164 0.585 . . . . 2.0299999999999998 109.975 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -60.5 -31.05 70.12 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 117.885 -1.055 . . . . 3.73 110.908 172.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.22 -41.3 85.94 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.057 1.299 . . . . 2.1099999999999999 111.278 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -55.99 9.87 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.886 0.874 . . . . 2.9199999999999999 110.722 178.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -45.05 -43.82 9.68 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.762 1.625 . . . . 5.4900000000000002 113.593 166.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.08 -45.86 83.54 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.553 1.141 . . . . 1.49 113.088 173.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.99 -41.06 87.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 120.248 1.385 . . . . 1.8100000000000001 110.608 173.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.6 mt -53.28 -49.7 51.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-N 119.187 0.903 . . . . 2.1699999999999999 111.331 166.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.4 t -65.6 -35.86 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 119.707 1.139 . . . . 1.8 112.783 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp -65.45 -41.78 93.09 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.862 -1.149 . . . . 2.0 111.338 172.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.0 t -67.4 -43.34 87.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 125.455 1.502 . . . . 1.8300000000000001 111.917 176.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -53.69 -51.96 61.58 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 119.119 0.872 . . . . 3.23 109.835 168.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.435 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 54.4 t30 -64.13 -23.11 67.2 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.035 1.124 . . . . 2.0699999999999998 114.035 -169.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -76.24 -61.1 2.06 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.7 0.8 . . . . 3.7799999999999998 112.335 168.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -67.49 -21.84 65.49 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.984 1.105 . . . . 2.9500000000000002 113.984 -170.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.435 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 1.6 ptmt -53.69 -21.94 8.01 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.342 1.428 . . . . 2.8700000000000001 112.975 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -89.98 8.14 33.93 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.453 1.901 . . . . 3.7200000000000002 115.023 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 125.136 1.374 . . . . 3.3300000000000001 110.885 173.036 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 16.3 pt . . . . . 0 CA--C 1.546 0.817 0 N-CA-C 113.87 1.063 . . . . 4.5899999999999999 113.87 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.2 m -125.72 156.82 38.77 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.711 2.004 . . . . 2.9700000000000002 109.523 171.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -58.07 -21.8 47.43 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 115.343 1.609 . . . . 3.1400000000000001 115.343 -164.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.4 m -47.85 -42.25 26.05 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 121.269 -0.894 . . . . 3.0600000000000001 113.304 165.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 m -74.36 -11.6 60.3 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.534 1.309 . . . . 2.3399999999999999 114.534 -172.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -69.82 -56.71 6.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 121.045 1.748 . . . . 3.5499999999999998 111.444 165.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -61.78 -26.04 67.84 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.466 0.543 . . . . 2.8199999999999998 112.466 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -71.52 -50.59 29.86 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.671 1.189 . . . . 3.8799999999999999 110.625 170.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -59.96 -43.04 95.3 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.886 1.674 . . . . 1.8300000000000001 112.733 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 31.8 mt -50.69 -36.86 38.06 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.907 1.283 . . . . 2.0499999999999998 112.434 168.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -83.88 -20.21 33.47 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 118.108 -0.949 . . . . 2.5600000000000001 112.771 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.52 -45.57 19.04 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.68 1.582 . . . . 3.8500000000000001 112.117 166.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -90.22 -41.07 11.8 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.926 1.084 . . . . 3.4700000000000002 113.926 -167.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.4 mt -107.0 28.68 7.78 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.216 1.007 . . . . 3.5800000000000001 112.803 -170.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -67.63 23.83 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 117.059 2.244 . . . . 1.99 117.059 -171.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.445 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 0.2 OUTLIER -127.65 -42.88 1.59 Allowed 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.267 -1.521 . . . . 2.6299999999999999 111.731 -178.372 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.9 ptp -77.54 -19.97 54.91 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.667 1.187 . . . . 2.77 113.555 164.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.1 tt -99.92 104.9 16.57 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.254 1.422 . . . . 3.2799999999999998 111.046 -175.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.3 t -71.63 109.28 5.45 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.581 -0.699 . . . . 5.5499999999999998 111.3 168.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 49.79 -88.39 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.68 1.992 . . . . 7.2599999999999998 114.062 136.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.3 p -130.89 -19.91 2.87 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.439 1.495 . . . . 4.3300000000000001 112.33 167.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.64 -41.44 99.59 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 119.976 1.262 . . . . 3.2200000000000002 112.081 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -82.88 -48.98 10.14 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 117.552 0.676 . . . . 3.5499999999999998 112.345 165.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -55.13 -37.13 66.52 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.901 1.445 . . . . 5.9000000000000004 114.901 -172.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -63.84 -31.58 72.81 Favored 'General case' 0 N--CA 1.479 1.024 0 O-C-N 120.883 -1.136 . . . . 4.5 114.015 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.77 -40.19 96.08 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 122.96 0.504 . . . . 3.2200000000000002 111.653 168.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.86 98.68 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.131 0.572 . . . . 1.9399999999999999 112.291 172.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -54.67 -29.66 53.27 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.256 1.022 . . . . 2.5800000000000001 112.626 174.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -24.72 59.92 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.177 -1.577 . . . . 7.0800000000000001 114.004 175.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 15.4 mt -65.82 -43.0 89.88 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 120.523 -0.471 . . . . 2.1699999999999999 110.973 163.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.5 mm -59.61 -48.32 87.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 123.205 0.602 . . . . 1.99 110.739 -177.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -59.32 -38.13 79.53 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.092 0.473 . . . . 2.3700000000000001 112.258 178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 -65.92 -30.46 71.05 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.782 0.833 . . . . 4.29 113.071 175.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.16 -30.69 22.28 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.351 1.46 . . . . 2.9100000000000001 111.827 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -64.87 -32.38 74.06 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.441 1.496 . . . . 3.1499999999999999 113.147 166.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.0 -23.31 66.55 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.122 1.156 . . . . 2.8900000000000001 114.122 170.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -122.71 -7.84 8.5 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.839 1.792 . . . . 2.4500000000000002 115.839 -167.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.35 117.97 13.05 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.302 1.865 . . . . 4.3499999999999996 112.757 -177.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -78.6 63.63 3.44 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.908 2.483 . . . . 4.04 111.926 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.78 7.87 62.6 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.344 0.974 . . . . 3.2799999999999998 114.228 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.8 mmt85 -70.12 175.16 4.72 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.268 1.427 . . . . 6.4100000000000001 111.957 176.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 25.0 mm -140.02 150.18 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 126.191 1.797 . . . . 3.2599999999999998 106.853 161.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.7 t -127.0 165.16 19.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.536 1.534 . . . . 1.9099999999999999 111.902 169.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -67.62 -51.78 46.14 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 122.54 1.162 . . . . 3.2599999999999998 111.93 175.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -25.02 67.39 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.422 2.289 . . . . 3.3999999999999999 113.914 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.6 -59.26 5.45 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.049 1.339 . . . . 3.46 111.888 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -58.06 -42.31 85.21 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.063 -1.023 . . . . 3.8399999999999999 111.466 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 20.9 t-105 -62.33 -48.27 80.55 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.922 -0.561 . . . . 0.70999999999999996 111.767 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.1 t -69.82 -32.75 71.35 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 117.637 -1.173 . . . . 2.7799999999999998 111.718 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.9 mt -66.93 -40.94 87.76 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 117.798 -1.096 . . . . 1.8200000000000001 112.553 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 12.1 mm -50.26 -44.58 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-N 120.174 1.352 . . . . 2.0 111.688 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.05 -19.13 50.3 Favored Glycine 0 CA--C 1.539 1.545 0 CA-C-O 119.459 -0.634 . . . . 0.63 114.579 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.45 -23.29 60.84 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 118.72 1.26 . . . . 0.59999999999999998 114.013 177.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -94.98 -44.97 13.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-N 119.446 1.623 . . . . 2.1600000000000001 109.647 165.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.3 m -83.44 35.43 0.5 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.055 2.542 . . . . 2.21 112.035 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -93.59 -78.9 1.42 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 125.009 1.29 . . . . 1.55 110.761 172.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.2 -41.27 16.86 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.885 2.39 . . . . 1.3500000000000001 112.263 -176.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -70.17 -12.95 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 113.761 1.023 . . . . 2.2599999999999998 113.761 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.78 -43.66 92.54 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.343 0.974 . . . . 2.0099999999999998 111.816 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -61.45 -34.23 75.07 Favored 'General case' 0 C--O 1.221 -0.397 0 O-C-N 120.442 -1.411 . . . . 3.8900000000000001 112.291 171.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 tt -66.88 -41.08 87.85 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.924 0.89 . . . . 2.21 111.271 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.2 mt -51.37 -62.58 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-O 121.642 0.734 . . . . 1.6799999999999999 109.541 162.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -60.41 -27.77 67.73 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.113 1.153 . . . . 1.9199999999999999 114.113 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.305 3.9 pt-20 -89.45 -9.33 50.57 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.715 1.206 . . . . 3.1600000000000001 112.769 178.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.495 ' C ' ' H ' ' A' ' 99' ' ' GLN . 5.5 tp-100 -89.48 -30.51 18.23 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.882 1.673 . . . . 3.5099999999999998 111.826 169.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -63.99 6.27 0.18 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 126.849 2.059 . . . . 3.2999999999999998 113.314 165.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.495 ' H ' ' C ' ' A' ' 97' ' ' GLN . 10.2 mm-40 . . . . . 0 C--N 1.324 -0.533 0 C-N-CA 126.153 1.781 . . . . 2.3399999999999999 110.273 -173.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.445 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 46.5 m-85 . . . . . 0 N--CA 1.478 0.931 0 N-CA-C 115.554 1.686 . . . . 3.5899999999999999 115.554 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 36.0 p -64.27 157.79 25.03 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.069 0.947 . . . . 2.1299999999999999 109.871 178.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -59.59 -33.98 72.15 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-O 117.108 -1.425 . . . . 3.7200000000000002 110.952 173.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.27 -43.29 95.29 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 120.641 1.564 . . . . 2.02 111.323 176.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -57.52 5.68 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.822 0.849 . . . . 2.9500000000000002 110.598 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -42.79 -44.25 4.34 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.37 1.868 . . . . 5.4900000000000002 114.278 164.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.27 -44.75 87.03 Favored 'General case' 0 C--O 1.223 -0.337 0 O-C-N 120.821 -1.175 . . . . 1.5600000000000001 112.586 174.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.3 -42.66 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.936 1.244 . . . . 1.8600000000000001 110.506 172.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 71.0 mt -53.03 -48.03 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.344 1.058 . . . . 1.9299999999999999 110.57 168.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.3 t -66.58 -35.09 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.396 1.078 . . . . 1.8400000000000001 112.82 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -67.87 -40.0 83.66 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.567 -1.333 . . . . 2.0 111.222 173.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 29.7 t -67.91 -38.48 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 126.036 1.734 . . . . 1.8700000000000001 111.993 175.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.93 -53.05 62.57 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.153 0.981 . . . . 3.5699999999999998 110.294 167.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -66.57 -7.34 19.52 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.214 1.561 . . . . 2.1099999999999999 115.214 -177.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -87.56 -65.43 1.02 Allowed 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.367 -0.833 . . . . 3.8500000000000001 111.972 160.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -69.69 -22.31 63.43 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.921 1.452 . . . . 2.9300000000000002 114.921 -166.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 10.4 ptmt -53.78 -22.34 9.25 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 121.265 1.848 . . . . 3.0299999999999998 113.436 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -84.39 7.82 18.3 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.641 1.976 . . . . 3.8500000000000001 114.907 176.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 30.9 m . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 125.989 1.715 . . . . 3.3999999999999999 110.161 170.155 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 18.9 pt . . . . . 0 CA--C 1.551 0.982 0 N-CA-C 114.821 1.415 . . . . 4.3099999999999996 114.821 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 71.1 m -118.33 155.08 31.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.818 1.247 . . . . 3.0099999999999998 109.867 165.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -50.92 -36.01 36.25 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.17 1.388 . . . . 3.0099999999999998 114.144 -171.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 4.9 m -52.34 -17.41 1.16 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.811 2.044 . . . . 2.4500000000000002 115.43 174.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 1.4 m -75.43 -37.33 60.48 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.502 1.121 . . . . 2.4399999999999999 112.545 175.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -58.39 -49.74 76.16 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.277 1.031 . . . . 3.2400000000000002 111.948 -175.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -55.82 -29.2 59.39 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.455 1.102 . . . . 2.7599999999999998 113.77 175.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -86.69 -44.73 11.6 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.645 1.178 . . . . 3.8799999999999999 111.365 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 2.7 tmm? -52.67 -45.77 66.92 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.182 0.593 . . . . 1.72 111.641 167.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 21.3 mt -55.51 -52.51 63.45 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.624 1.57 . . . . 2.1800000000000002 112.869 170.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -61.09 -18.48 58.15 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.7 1.2 . . . . 2.4399999999999999 113.406 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.29 -44.14 5.25 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.848 1.055 . . . . 3.0800000000000001 113.848 177.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -79.42 -38.14 35.45 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.715 1.206 . . . . 3.5899999999999999 113.626 -178.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.7 mt -111.81 28.08 9.08 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.421 0.897 . . . . 3.52 113.421 -169.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -71.09 9.71 0.68 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 116.689 2.107 . . . . 1.51 116.689 -165.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . 0.465 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 0.5 OUTLIER -108.01 -32.13 7.68 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 120.041 -1.662 . . . . 2.7200000000000002 111.851 -173.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 21.1 ptp -83.01 -27.71 30.17 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.045 1.738 . . . . 2.8100000000000001 112.473 159.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 5.5 tt -94.79 97.49 10.08 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.089 1.356 . . . . 3.3599999999999999 110.749 -176.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 30.3 t -74.64 104.36 5.29 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.99 0.9 . . . . 5.5899999999999999 110.416 167.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 54.75 -100.01 0.1 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.802 1.241 . . . . 7.8899999999999997 112.809 138.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 41.5 p -130.75 14.29 5.36 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.86 1.664 . . . . 5.04 113.766 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -86.4 -64.7 1.44 Allowed Glycine 0 N--CA 1.466 0.663 0 N-CA-C 109.876 -1.29 . . . . 3.3399999999999999 109.876 160.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -67.2 -46.34 74.19 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 118.409 -0.805 . . . . 3.77 111.753 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -59.4 -22.91 62.11 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 120.691 1.587 . . . . 5.5800000000000001 114.95 -176.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp -52.28 -38.1 57.37 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.888 1.222 . . . . 5.1600000000000001 113.118 168.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -63.88 -48.03 78.27 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.824 0.45 . . . . 2.1299999999999999 110.91 172.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -56.62 -49.37 75.16 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.523 0.601 . . . . 2.0 111.693 176.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -66.31 -33.0 74.76 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.726 0.811 . . . . 2.3900000000000001 112.351 -175.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -47.25 82.04 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.004 -1.06 . . . . 7.8099999999999996 112.894 167.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.67 -47.8 76.12 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.044 0.84 . . . . 2.4199999999999999 111.019 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 38.9 mm -50.48 -51.64 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 123.404 0.682 . . . . 2.02 110.493 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -73.73 -31.03 63.16 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.322 0.582 . . . . 3.6400000000000001 112.265 -173.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 38.2 m-20 -62.42 -27.47 69.12 Favored 'General case' 0 CA--C 1.555 1.165 0 N-CA-C 112.548 0.573 . . . . 4.8799999999999999 112.548 169.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.47 -28.76 20.63 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.999 1.72 . . . . 3.0499999999999998 111.54 177.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -63.75 -28.97 70.24 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.741 -1.224 . . . . 2.98 113.309 164.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.27 -14.07 62.72 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 114.345 1.239 . . . . 2.9300000000000002 114.345 166.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -125.71 -13.3 6.47 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 116.628 2.084 . . . . 2.4100000000000001 116.628 -170.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -139.88 122.35 16.15 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 122.057 2.208 . . . . 4.5199999999999996 113.233 -174.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -79.07 66.06 4.41 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 127.514 2.325 . . . . 4.0999999999999996 112.137 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.1 5.57 66.17 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.731 1.157 . . . . 3.3199999999999998 114.75 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt85 -68.43 178.21 2.08 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.154 1.782 . . . . 6.4500000000000002 112.415 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 21.5 mm -137.6 151.83 26.49 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 126.84 2.056 . . . . 3.46 105.461 158.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 9.8 t -132.46 164.05 27.41 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.22 1.408 . . . . 2.1000000000000001 113.277 170.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -63.91 -55.46 22.52 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 122.881 1.324 . . . . 3.52 111.359 175.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -27.27 68.13 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.606 2.363 . . . . 3.5299999999999998 113.71 178.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -57.04 -60.39 3.65 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.995 1.318 . . . . 3.3900000000000001 111.153 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -55.42 -46.45 76.67 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.234 -0.916 . . . . 3.6600000000000001 111.477 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 23.4 t-105 -62.64 -47.29 84.37 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.967 -0.54 . . . . 0.71999999999999997 111.55 -177.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.5 t -70.7 -32.18 69.32 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 117.658 -1.163 . . . . 2.7599999999999998 111.664 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 46.1 mt -67.33 -40.51 85.9 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-O 117.24 -1.362 . . . . 1.8200000000000001 112.105 175.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 13.1 mm -49.03 -46.13 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 CA-C-N 120.691 1.587 . . . . 1.8799999999999999 111.901 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -60.98 -19.6 56.77 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 123.997 0.808 . . . . 0.68999999999999995 114.381 178.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -78.12 -18.37 76.68 Favored Glycine 0 CA--C 1.531 1.077 0 CA-C-N 118.687 1.244 . . . . 0.77000000000000002 113.54 174.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -101.61 -48.17 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-N 119.482 1.641 . . . . 2.0 109.976 166.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 25.7 m -80.45 68.58 6.68 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 127.038 2.135 . . . . 2.3500000000000001 109.45 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -129.67 -83.49 0.33 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.731 1.634 . . . . 1.26 110.961 177.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -61.89 -39.29 52.54 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 122.479 2.119 . . . . 1.45 111.656 178.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.95 -11.31 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 113.461 0.911 . . . . 2.3700000000000001 113.461 177.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.12 -42.87 83.78 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.534 1.061 . . . . 1.9099999999999999 111.293 177.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -61.42 -35.42 77.5 Favored 'General case' 0 C--O 1.22 -0.475 0 O-C-N 120.508 -1.37 . . . . 4.1799999999999997 112.262 169.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.85 -43.7 95.34 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.149 0.98 . . . . 2.3999999999999999 111.165 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 78.7 mt -50.17 -62.11 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-O 121.43 0.633 . . . . 1.6699999999999999 109.824 163.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -58.67 -31.06 67.84 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.865 1.061 . . . . 2.0899999999999999 113.865 -173.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.258 3.8 pt-20 -88.7 -12.28 42.79 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.691 1.196 . . . . 3.23 112.76 -179.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . 0.463 ' C ' ' H ' ' B' ' 202' ' ' GLN . 6.5 tp-100 -84.28 -34.19 23.83 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.308 1.443 . . . . 3.77 111.252 169.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -63.19 2.93 0.31 Allowed 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 126.421 1.889 . . . . 3.25 113.222 166.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.463 ' H ' ' C ' ' B' ' 200' ' ' GLN . 6.6 mm-40 -128.21 -72.48 0.62 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.92 1.688 . . . . 2.75 111.21 -176.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 . . . . . 0 N--CA 1.476 0.867 1 C-N-CA 132.14 4.176 . . . . 4.9500000000000002 116.513 170.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 . . . . . 0 C--O 1.241 0.607 0 N-CA-C 112.861 0.689 . . . . 4.0700000000000003 112.861 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.31 153.59 40.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.771 -0.826 . . . . 2.4300000000000002 108.771 -176.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -59.81 -43.31 94.56 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-O 119.125 -0.464 . . . . 2.0899999999999999 110.891 178.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.91 -44.44 94.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.086 1.754 . . . . 3.2799999999999998 111.639 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -71.15 -53.8 13.27 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 125.837 1.655 . . . . 3.1099999999999999 110.819 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -58.55 -27.5 64.63 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.107 -0.996 . . . . 6.0999999999999996 111.828 167.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.6 -37.39 70.97 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 119.474 -2.016 . . . . 1.5700000000000001 111.72 172.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 91.4 t -60.41 -37.46 74.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.84 1.655 . . . . 1.74 110.504 167.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 13.3 mt -55.23 -54.1 28.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 CA-C-N 120.335 1.425 . . . . 1.96 112.196 165.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.4 t -58.5 -44.36 88.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 119.633 1.106 . . . . 1.79 112.951 -179.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.6 mp -63.2 -42.32 99.31 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.58 1.082 . . . . 1.96 111.393 175.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.6 t -65.34 -41.3 90.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 123.819 0.848 . . . . 1.7 110.825 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.58 -43.08 99.51 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.396 0.544 . . . . 3.1499999999999999 112.161 166.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.57 -23.76 64.9 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.704 -1.247 . . . . 3.9100000000000001 113.556 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -75.43 -72.83 0.28 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.907 0.883 . . . . 2.9900000000000002 112.455 158.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -58.95 -26.65 64.6 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.39 1.626 . . . . 3.52 115.39 -167.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -47.45 -32.66 5.3 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.986 1.266 . . . . 3.6600000000000001 112.555 173.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -93.11 -19.22 21.72 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.257 1.823 . . . . 3.7000000000000002 115.219 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.488 1.464 0 CA-C-N 120.455 1.479 . . . . 3.3100000000000001 110.109 -168.56 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.0 pt . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 116.032 1.864 . . . . 3.0600000000000001 116.032 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.4 t -77.67 137.51 38.56 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.41 -1.431 . . . . 3.3999999999999999 110.068 164.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mttp -60.7 -21.86 63.34 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 121.063 -1.023 . . . . 3.4500000000000002 112.161 172.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.4 p -67.66 -32.95 73.99 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 120.492 -1.38 . . . . 2.3300000000000001 113.427 171.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.5 m -63.59 -39.68 94.99 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.593 1.088 . . . . 1.3300000000000001 111.543 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 25.9 t80 -52.1 -60.47 3.16 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.816 0.846 . . . . 3.3599999999999999 111.733 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -61.88 -28.68 69.67 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.458 0.54 . . . . 3.71 112.458 -176.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -83.79 -42.01 16.95 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.288 0.566 . . . . 2.8399999999999999 112.098 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 15.7 tmm? -58.58 -37.48 75.87 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.681 -1.262 . . . . 2.0699999999999998 111.099 170.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.6 mt -69.56 -8.03 43.65 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.302 1.593 . . . . 2.1200000000000001 115.302 167.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -92.14 -7.72 47.69 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 120.932 -1.105 . . . . 3.1000000000000001 113.405 163.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -62.84 1.51 Allowed 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.404 1.261 . . . . 2.3100000000000001 114.404 174.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -82.14 -4.61 57.32 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 119.338 -2.101 . . . . 2.6600000000000001 114.011 -168.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.86 24.81 5.0 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.802 2.041 . . . . 2.54 111.794 175.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -74.87 -26.76 59.91 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 115.418 1.636 . . . . 2.0899999999999999 115.418 -164.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 16.8 m80 -70.02 -20.54 63.26 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.472 1.487 . . . . 4.7000000000000002 111.072 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.5 tpp -70.72 3.98 2.81 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.28 1.432 . . . . 2.8799999999999999 114.323 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.1 mp -85.35 119.37 25.64 Favored 'General case' 0 C--O 1.225 -0.23 0 O-C-N 120.734 -1.229 . . . . 3.71 110.27 174.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.7 t -110.08 5.45 22.11 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 114.911 -1.041 . . . . 5.2800000000000002 112.552 175.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 t70 164.94 158.85 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 129.992 3.317 . . . . 4.9800000000000004 109.492 -177.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -25.08 -48.5 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 129.959 3.304 . . . . 4.2999999999999998 114.206 157.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.18 -33.61 75.88 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 125.545 1.545 . . . . 2.5099999999999998 113.515 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 -71.35 -23.71 61.97 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.074 0.937 . . . . 4.2999999999999998 112.929 177.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.436 ' CZ ' ' HA ' ' A' ' 56' ' ' ARG . 0.7 OUTLIER -81.39 -45.34 16.24 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-N 119.301 0.955 . . . . 8.0500000000000007 112.487 164.213 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.8 mmtm -55.24 -34.57 64.11 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.906 0.776 . . . . 4.1600000000000001 112.892 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.27 -27.58 36.11 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.442 1.275 . . . . 1.9299999999999999 114.442 172.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.38 -43.41 50.37 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 119.149 0.886 . . . . 1.95 111.62 171.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -60.45 -36.63 78.69 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.279 1.432 . . . . 2.8500000000000001 112.771 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -58.19 -30.21 66.26 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.514 0.931 . . . . 4.2300000000000004 113.514 173.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.9 mt -78.06 -42.18 33.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 118.415 -0.802 . . . . 1.8300000000000001 111.425 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.7 mm -60.73 -43.65 95.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 118.951 0.796 . . . . 2.2000000000000002 110.373 -175.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -62.09 -28.72 69.81 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.536 0.939 . . . . 2.77 113.536 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.6 m-20 -81.64 -44.63 16.92 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.283 1.433 . . . . 3.96 113.01 175.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.87 -30.19 26.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.612 1.165 . . . . 3.1299999999999999 111.703 -171.07 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -71.5 -22.93 61.73 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.914 1.079 . . . . 2.77 113.914 -177.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.55 -2.4 3.4 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 113.88 1.067 . . . . 3.0600000000000001 113.88 164.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -138.4 -173.31 3.5 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 127.514 2.326 . . . . 3.8500000000000001 110.287 -176.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 7.2 m80 55.52 45.34 25.22 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.97 1.47 . . . . 4.6699999999999999 114.97 158.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.45 ' C ' ' H ' ' A' ' 73' ' ' ARG . 0.3 OUTLIER -134.09 155.46 50.01 Favored 'General case' 0 C--O 1.232 0.158 0 O-C-N 121.378 -0.826 . . . . 6.6799999999999997 112.592 166.657 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.56 -18.9 0.41 Allowed Glycine 0 CA--C 1.538 1.515 0 CA-C-O 118.918 -0.934 . . . . 5.1900000000000004 113.392 -161.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.45 ' H ' ' C ' ' A' ' 71' ' ' ASP . 87.5 mmt-85 -141.38 149.83 41.61 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 128.359 2.664 . . . . 5.3499999999999996 110.42 172.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.4 mm -138.02 148.16 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.296 1.839 . . . . 4.1399999999999997 109.83 173.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.7 m -117.39 144.44 44.96 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.148 1.779 . . . . 2.4300000000000002 108.681 177.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -59.37 -36.67 76.19 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.773 1.273 . . . . 3.1699999999999999 112.112 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.83 -20.54 65.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.512 2.725 . . . . 3.02 114.488 177.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -56.8 -58.91 6.05 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.888 1.222 . . . . 3.3199999999999998 109.888 171.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -58.79 -44.39 90.73 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.343 -0.848 . . . . 3.5499999999999998 112.035 -175.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.6 t-105 -62.07 -47.66 83.67 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 118.561 -0.733 . . . . 0.69999999999999996 112.138 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.2 t -70.3 -28.14 64.95 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.446 1.021 . . . . 2.8799999999999999 112.124 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 57.9 mt -68.04 -40.96 82.75 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 117.631 -1.176 . . . . 1.8100000000000001 111.75 172.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 25.6 mm -54.76 -42.03 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 CA-C-N 121.545 1.975 . . . . 1.76 111.977 176.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -65.38 -19.39 66.49 Favored Glycine 0 N--CA 1.472 1.041 0 C-N-CA 124.111 0.862 . . . . 0.66000000000000003 114.149 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.09 -22.29 63.62 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-N 118.307 1.054 . . . . 0.66000000000000003 113.706 177.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.1 mp -90.42 -40.82 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 118.829 1.314 . . . . 2.04 109.955 163.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.3 m -80.75 80.61 7.19 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.452 1.501 . . . . 1.78 109.074 -175.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -153.98 -75.61 0.02 OUTLIER Glycine 0 CA--C 1.532 1.132 0 C-N-CA 125.752 1.644 . . . . 1.0700000000000001 112.861 -174.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -62.37 -45.77 14.03 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.74 2.293 . . . . 1.0800000000000001 111.641 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 pt -72.87 -16.37 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 114.839 1.422 . . . . 2.6000000000000001 114.839 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -50.51 -58.53 5.56 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.792 1.633 . . . . 1.97 112.715 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -60.69 -40.23 91.4 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.112 -0.992 . . . . 3.79 112.466 176.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.3 tt -58.63 -47.15 85.35 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 124.424 1.09 . . . . 2.3100000000000001 110.579 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 42.4 mt -47.7 -58.49 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.792 1.237 . . . . 2.3799999999999999 111.117 174.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -70.55 -34.65 72.49 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.57 -0.706 . . . . 2.8999999999999999 112.099 -175.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.284 4.3 pt-20 -77.15 -24.19 51.57 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.636 -0.665 . . . . 2.9100000000000001 111.876 -175.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -59.0 -58.35 9.04 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.262 1.825 . . . . 2.1200000000000001 112.438 164.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -71.62 -12.54 61.4 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.024 0.829 . . . . 3.52 112.431 -171.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 . . . . . 0 N--CA 1.47 0.526 0 O-C-N 121.209 -0.932 . . . . 2.1600000000000001 111.146 163.336 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 . . . . . 0 N--CA 1.476 0.825 0 N-CA-C 112.664 0.616 . . . . 3.4700000000000002 112.664 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.17 156.61 37.18 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.712 0.805 . . . . 2.73 109.774 -173.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -63.03 -39.85 95.98 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-O 117.78 -1.105 . . . . 2.4900000000000002 111.341 175.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.16 -47.37 81.35 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.784 1.278 . . . . 2.0699999999999998 109.895 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.08 -56.1 7.78 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 126.57 1.948 . . . . 2.8399999999999999 111.593 -173.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -57.92 -29.87 65.47 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 120.75 -1.219 . . . . 5.4000000000000004 112.238 169.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.43 -40.81 77.01 Favored 'General case' 0 C--O 1.224 -0.251 0 O-C-N 119.826 -1.796 . . . . 1.54 111.992 169.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 53.2 t -59.65 -31.93 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.762 1.619 . . . . 1.8400000000000001 111.162 171.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 35.2 mt -60.78 -54.37 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 CA-C-N 119.859 1.209 . . . . 1.8899999999999999 110.872 166.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.24 -36.92 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.479 1.112 . . . . 1.73 113.268 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.83 -44.76 76.48 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.474 1.034 . . . . 1.9299999999999999 111.39 173.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.4 t -64.12 -39.44 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.947 0.899 . . . . 1.5700000000000001 111.406 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -69.9 -38.15 76.21 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.112 0.782 . . . . 3.3700000000000001 113.112 170.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -59.31 -23.07 62.14 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.582 -1.324 . . . . 3.6000000000000001 113.017 173.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -81.44 -68.82 0.66 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.671 0.788 . . . . 3.1899999999999999 112.704 163.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -60.24 -25.75 65.9 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.892 1.441 . . . . 3.4500000000000002 114.892 -168.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -47.87 -33.19 7.13 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.922 1.237 . . . . 3.71 112.925 172.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -89.47 -16.82 29.94 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.862 1.43 . . . . 3.48 114.862 177.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.483 1.224 0 CA-C-O 123.235 1.493 . . . . 3.1899999999999999 109.914 -167.789 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 19.7 pt . . . . . 0 N--CA 1.488 1.445 0 N-CA-C 115.292 1.59 . . . . 3.02 115.292 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 29.8 t -94.29 137.88 32.93 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.469 -1.395 . . . . 3.27 109.97 164.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -68.78 -17.07 63.97 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.732 -1.23 . . . . 3.6899999999999999 111.469 171.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 10.0 p -65.53 -27.68 68.63 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.589 -1.319 . . . . 2.2599999999999998 113.116 165.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 12.6 m -77.94 -39.29 43.2 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.364 0.984 . . . . 1.48 111.545 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . 0.412 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 47.7 t80 -47.58 -57.48 5.39 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.008 0.923 . . . . 3.46 111.171 173.125 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.3 ptt180 -62.12 -26.73 68.47 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.361 0.874 . . . . 3.71 113.361 -176.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -87.82 -43.68 11.66 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.425 1.09 . . . . 2.4399999999999999 111.941 -176.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.46 -41.41 69.45 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.393 1.477 . . . . 2.2200000000000002 111.245 170.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 71.2 mt -71.02 -4.3 24.17 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.54 1.936 . . . . 2.4900000000000002 115.183 171.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -98.92 -10.09 23.27 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.325 1.45 . . . . 2.96 112.725 165.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.19 -57.31 2.09 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.867 1.267 . . . . 2.1800000000000002 113.658 174.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -86.76 -6.03 58.94 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.505 -1.372 . . . . 2.7799999999999998 114.044 -169.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.35 14.85 8.3 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.784 2.034 . . . . 2.6499999999999999 112.618 176.029 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -66.87 -26.87 67.1 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.264 1.579 . . . . 1.9199999999999999 115.264 -163.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -70.86 -14.21 62.32 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.182 1.355 . . . . 4.5300000000000002 112.304 178.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.6 tpp -80.25 5.37 14.82 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.339 1.455 . . . . 2.9500000000000002 113.731 174.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.9 mp -91.49 132.04 36.53 Favored 'General case' 0 C--O 1.227 -0.122 0 O-C-N 120.678 -1.264 . . . . 3.3500000000000001 109.404 177.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 20.1 m -140.4 16.88 2.39 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.165 -0.959 . . . . 5.21 112.118 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 18.7 t70 172.13 158.57 0.1 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 129.4 3.08 . . . . 5.4199999999999999 109.762 173.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 3.7 m -25.2 -52.87 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 129.498 3.119 . . . . 5.0300000000000002 113.326 156.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.0 -33.5 69.25 Favored Glycine 0 CA--C 1.525 0.674 0 C-N-CA 124.817 1.199 . . . . 2.9199999999999999 113.262 -175.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -70.92 -23.83 62.33 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 118.516 1.158 . . . . 4.1299999999999999 113.516 -178.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -84.4 -50.05 8.14 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.084 0.857 . . . . 8.5299999999999994 112.62 164.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -54.33 -34.46 61.1 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 119.007 0.821 . . . . 4.0899999999999999 112.552 -178.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -53.62 -29.44 37.95 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.41 1.263 . . . . 1.8200000000000001 114.41 173.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -74.12 -40.34 62.72 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.224 0.92 . . . . 1.8600000000000001 112.274 171.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -70.13 -27.63 64.71 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.292 1.037 . . . . 1.9199999999999999 112.876 -177.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 23.4 mtmt -60.05 -27.82 67.26 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 121.138 -0.976 . . . . 4.1699999999999999 113.274 168.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 6.5 mt -78.14 -40.89 36.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.702 -0.681 . . . . 1.8 110.998 173.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 19.1 mm -61.06 -44.69 98.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 118.393 0.542 . . . . 2.3100000000000001 110.926 -178.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -61.94 -27.66 68.99 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.491 0.923 . . . . 3.0899999999999999 113.491 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 m-20 -83.2 -45.23 14.12 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.158 1.383 . . . . 3.9500000000000002 113.092 174.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.72 -31.34 12.72 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.311 1.044 . . . . 3.8799999999999999 112.673 -166.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -79.83 -8.4 59.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.703 1.201 . . . . 3.4300000000000002 112.966 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -74.97 -7.13 52.73 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.894 1.278 . . . . 3.3300000000000001 113.484 159.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -134.48 -173.41 3.28 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.439 2.296 . . . . 4.0099999999999998 110.514 -178.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 57.6 73.08 0.48 Allowed 'General case' 0 CA--C 1.552 1.034 0 CA-C-O 122.809 1.29 . . . . 4.7199999999999998 113.269 164.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . 0.472 ' C ' ' H ' ' B' ' 176' ' ' ARG . 1.1 t0 -155.81 159.23 39.23 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.791 1.237 . . . . 6.0999999999999996 110.899 172.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 69.01 -27.43 0.3 Allowed Glycine 0 CA--C 1.534 1.221 0 C-N-CA 124.381 0.991 . . . . 5.6500000000000004 112.337 -160.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . 0.472 ' H ' ' C ' ' B' ' 174' ' ' ASP . 81.9 mmt-85 -134.58 149.65 50.63 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.027 2.531 . . . . 5.6299999999999999 110.302 167.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 26.2 mm -140.3 152.24 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.893 2.077 . . . . 4.6299999999999999 107.315 172.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.4 m -117.38 144.01 45.39 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.503 1.521 . . . . 2.46 109.501 -177.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -58.91 -38.93 80.02 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 122.986 1.374 . . . . 3.0699999999999998 111.937 177.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -63.5 -20.98 66.05 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.305 2.642 . . . . 2.96 114.346 175.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -57.5 -55.48 34.21 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.919 1.236 . . . . 2.9700000000000002 109.713 171.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -55.39 -51.24 67.47 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.838 -0.539 . . . . 3.6499999999999999 111.507 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.3 t-105 -61.05 -45.58 94.19 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 118.927 -0.559 . . . . 0.68999999999999995 112.351 -178.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.7 t -72.12 -27.53 62.68 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 117.81 -1.091 . . . . 2.6200000000000001 112.343 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . 0.412 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 74.4 mt -65.21 -44.71 87.46 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.769 1.168 . . . . 1.8700000000000001 111.535 168.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 36.8 mm -52.89 -38.55 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 CA-C-N 121.578 1.99 . . . . 2.1699999999999999 113.417 -177.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.2 -18.96 67.77 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 123.928 0.775 . . . . 0.72999999999999998 113.924 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -77.7 -25.16 63.31 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 118.522 1.161 . . . . 0.81000000000000005 113.321 176.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -87.55 -43.06 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 118.44 1.12 . . . . 2.0 110.238 164.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 8.0 m -86.41 86.04 7.33 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.912 1.285 . . . . 1.8100000000000001 109.177 -170.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -160.07 -74.37 0.02 OUTLIER Glycine 0 CA--C 1.533 1.206 0 C-N-CA 126.259 1.885 . . . . 1.1000000000000001 113.18 -171.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.59 -45.59 17.19 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.917 2.411 . . . . 1.0700000000000001 111.751 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.5 pt -71.82 -19.31 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 116.874 -1.536 . . . . 2.6099999999999999 114.533 172.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -46.79 -58.91 3.43 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 121.71 2.05 . . . . 1.98 112.902 178.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.13 -40.96 87.08 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.42 -1.425 . . . . 4.1100000000000003 112.583 177.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.2 tt -61.01 -46.67 89.8 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 118.465 0.575 . . . . 2.4399999999999999 110.334 -178.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 49.7 mt -49.36 -48.21 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 126.141 1.776 . . . . 2.5699999999999998 111.903 175.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -76.72 -42.78 40.02 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.254 -0.579 . . . . 2.9100000000000001 111.601 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -76.13 -21.64 56.38 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.888 -0.508 . . . . 2.8900000000000001 111.896 -169.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -50.74 -59.76 3.75 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 126.516 1.926 . . . . 2.5499999999999998 112.888 162.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -75.56 0.75 16.3 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 122.196 0.998 . . . . 3.4199999999999999 111.631 -170.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -98.09 -53.91 3.23 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.715 1.606 . . . . 2.9199999999999999 110.257 165.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 113.563 0.949 . . . . 5.1299999999999999 113.563 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.471 0.579 0 N-CA-C 108.121 -1.066 . . . . 3.8599999999999999 108.121 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 70.0 p -59.6 141.18 55.5 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 118.956 0.798 . . . . 2.1000000000000001 110.751 -170.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -65.39 -21.76 66.71 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 117.992 -1.004 . . . . 3.3799999999999999 112.33 -175.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -47.92 64.69 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.019 0.827 . . . . 1.8300000000000001 110.912 169.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -69.64 -52.21 27.9 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.863 0.756 . . . . 3.1299999999999999 110.783 -178.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -44.57 -45.94 9.71 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.193 1.397 . . . . 5.2000000000000002 114.01 164.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.0 -48.07 80.4 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 118.05 -0.976 . . . . 1.52 112.321 174.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 93.8 t -58.93 -35.52 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 120.061 1.3 . . . . 1.8200000000000001 111.296 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.0 mt -54.13 -46.77 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 CA-C-N 120.066 1.303 . . . . 1.8200000000000001 112.312 165.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 53.9 t -71.62 -42.01 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 120.459 -1.4 . . . . 1.8400000000000001 112.938 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.19 -30.49 68.25 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.886 -1.134 . . . . 1.8999999999999999 111.052 174.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.3 t -73.49 -48.74 40.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-O 117.038 -1.458 . . . . 1.8400000000000001 111.799 172.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -38.54 81.97 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 121.416 1.916 . . . . 3.4100000000000001 112.949 176.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -64.88 -32.64 74.44 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.786 1.032 . . . . 2.3100000000000001 113.786 -176.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -65.63 -57.51 7.94 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.69 -0.631 . . . . 3.7200000000000002 110.713 167.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -68.97 -24.7 64.28 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.927 1.084 . . . . 2.9700000000000002 113.927 -170.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.421 ' HZ3' ' CD ' ' A' ' 45' ' ' GLU . 36.5 pttt -66.71 -24.8 66.29 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 121.27 1.85 . . . . 3.3999999999999999 112.661 168.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -100.33 10.7 40.85 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.053 1.741 . . . . 4.2000000000000002 114.433 172.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 34.1 m . . . . . 0 CA--C 1.541 0.615 0 C-N-CA 125.626 1.57 . . . . 3.7200000000000002 108.207 164.859 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.5 tt . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 108.986 -0.746 . . . . 4.4800000000000004 108.986 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.0 m -114.27 142.15 46.66 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 107.77 -1.196 . . . . 3.4500000000000002 107.77 148.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.5 mttp -63.31 -19.58 64.73 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.614 -1.304 . . . . 3.9900000000000002 113.143 -168.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 5.3 p -49.97 -20.15 0.87 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.442 2.297 . . . . 2.5299999999999998 115.877 163.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 m -92.48 -18.34 23.33 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.565 1.691 . . . . 1.96 115.565 170.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -60.47 -47.16 87.36 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 118.592 -2.567 . . . . 3.54 111.296 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -58.04 -20.77 41.64 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.91 1.684 . . . . 3.1000000000000001 114.344 170.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.65 -49.13 6.25 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 126.591 1.956 . . . . 3.7999999999999998 108.853 -171.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 1.2 tmm? -48.67 -49.89 35.56 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.413 1.485 . . . . 1.98 111.295 163.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.4 mt -59.98 -9.96 3.64 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 115.627 1.714 . . . . 2.1299999999999999 115.627 172.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -112.23 -16.87 12.9 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.551 1.54 . . . . 2.8399999999999999 112.589 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.8 -42.61 11.8 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.999 0.818 . . . . 3.9199999999999999 112.837 166.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.421 ' CD ' ' HZ3' ' A' ' 21' ' ' LYS . 22.1 mm-40 -84.76 -53.16 5.54 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.099 1.36 . . . . 3.0 111.746 -174.48 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.3 mt -96.14 39.82 1.14 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.769 1.228 . . . . 3.6499999999999999 112.334 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -76.41 -12.15 60.01 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.838 1.421 . . . . 1.5800000000000001 114.838 -169.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -88.19 -22.45 24.01 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.814 1.188 . . . . 2.2999999999999998 111.318 178.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.3 tpp -63.81 -6.87 6.44 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 128.054 2.541 . . . . 3.4399999999999999 114.336 172.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.2 mp -100.55 -179.9 4.23 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 128.393 2.677 . . . . 3.5600000000000001 113.754 -168.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.8 m -177.28 -101.19 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 129.086 2.954 . . . . 4.8300000000000001 107.148 175.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.59 17.3 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 128.202 2.601 . . . . 4.6699999999999999 115.066 -171.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.6 m 68.53 -1.85 1.8 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.425 2.29 . . . . 4.7999999999999998 111.316 -152.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.36 -47.26 69.51 Favored Glycine 0 N--CA 1.471 0.972 0 C-N-CA 125.119 1.342 . . . . 2.6600000000000001 113.874 -165.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -59.58 -51.83 68.14 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 117.699 0.749 . . . . 4.71 112.17 174.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -55.34 -28.9 56.83 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.584 1.327 . . . . 5.9400000000000004 114.584 171.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -55.18 -39.46 69.59 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 122.567 2.439 . . . . 4.6500000000000004 111.984 173.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.34 -12.06 60.97 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.078 1.51 . . . . 2.2400000000000002 115.078 174.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.26 -52.25 6.38 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.598 1.159 . . . . 2.25 112.284 163.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.92 -30.87 71.88 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.685 0.794 . . . . 2.71 111.758 -175.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.0 ptmm? -60.91 -27.4 68.16 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.999 1.111 . . . . 4.3499999999999996 113.999 171.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.3 mt -83.39 -32.49 26.15 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.227 0.611 . . . . 2.29 112.297 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.1 mm -53.6 -55.54 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.719 1.207 . . . . 2.2999999999999998 110.334 178.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -62.69 -39.4 93.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.227 1.011 . . . . 4.5999999999999996 112.531 -177.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.24 -28.97 56.99 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.775 1.23 . . . . 4.4100000000000001 113.767 171.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.5 mt -104.27 -26.4 12.5 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.763 1.394 . . . . 3.6299999999999999 114.763 177.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -66.39 -15.25 63.15 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.55 1.068 . . . . 3.6200000000000001 111.821 165.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.32 -27.32 59.22 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 115.07 1.507 . . . . 3.4700000000000002 115.07 160.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -109.62 -20.39 12.86 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.625 1.713 . . . . 2.5 115.625 -168.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -139.15 124.84 19.54 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.584 -1.322 . . . . 4.6299999999999999 113.541 -166.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -77.59 17.96 0.48 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.202 1.801 . . . . 4.7300000000000004 115.422 -170.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.76 5.28 66.69 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 124.08 0.848 . . . . 2.98 112.658 -159.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.23 134.73 57.34 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.408 1.104 . . . . 5.8099999999999996 109.204 146.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 34.8 mm -150.39 115.69 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 127.375 2.27 . . . . 3.0899999999999999 107.97 -176.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.8 t -95.8 -172.38 2.58 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.731 1.612 . . . . 3.0699999999999998 111.609 167.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -78.24 -40.45 37.23 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.474 1.11 . . . . 3.48 112.034 170.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.75 -32.28 73.73 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.847 2.459 . . . . 3.1899999999999999 112.981 -168.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -58.59 -50.97 71.85 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 124.786 1.235 . . . . 4.0800000000000001 110.49 176.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -57.41 -49.66 75.48 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.588 -0.695 . . . . 4.0999999999999996 112.489 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 14.0 t-105 -61.83 -39.73 92.82 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 118.779 0.718 . . . . 0.95999999999999996 111.778 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.0 m -59.64 -47.12 86.86 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.283 1.433 . . . . 3.1699999999999999 111.082 174.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.86 -48.57 79.92 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.123 -0.941 . . . . 2.1499999999999999 111.976 178.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.3 mm -55.09 -34.68 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 120.506 1.503 . . . . 2.23 112.84 -170.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -69.6 -21.21 76.2 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.072 0.844 . . . . 0.70999999999999996 113.753 177.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.47 -23.74 77.33 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.394 0.997 . . . . 0.73999999999999999 113.081 173.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.1 mp -89.74 -48.5 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.219 1.01 . . . . 2.48 110.344 163.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.9 m -82.7 67.2 8.66 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 126.096 1.758 . . . . 2.0 108.974 -173.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -146.69 -77.33 0.02 OUTLIER Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.596 1.569 . . . . 1.2 112.103 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -60.99 -40.66 50.43 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.545 2.83 . . . . 1.24 114.181 -170.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.7 pt -86.57 -14.91 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 119.455 1.025 . . . . 2.8199999999999998 113.146 173.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.48 -35.77 80.39 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.352 0.978 . . . . 2.5899999999999999 113.155 -172.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -55.33 -44.69 76.09 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.094 -1.004 . . . . 3.2400000000000002 112.75 167.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.6 tt -60.7 -36.57 79.13 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.247 1.019 . . . . 2.2799999999999998 111.222 -178.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.2 mt -50.39 -61.09 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 123.79 0.836 . . . . 1.96 110.151 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.1 t60 -62.16 -35.36 78.55 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.245 -0.91 . . . . 1.8999999999999999 112.846 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -70.11 -23.07 62.97 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 122.986 0.514 . . . . 3.77 111.018 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -81.05 -30.28 34.84 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.228 1.411 . . . . 2.71 113.944 171.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -67.8 3.89 1.32 Allowed 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 120.292 1.405 . . . . 2.8300000000000001 112.182 166.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 . . . . . 0 CA--C 1.537 0.444 0 C-N-CA 125.705 1.602 . . . . 2.1699999999999999 111.08 170.285 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.538 0.497 0 CA-C-O 118.067 -0.968 . . . . 4.0199999999999996 110.989 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 77.4 p -54.01 139.85 33.2 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.863 1.21 . . . . 2.0499999999999998 110.018 -171.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -60.41 -36.67 78.68 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-O 116.433 -1.746 . . . . 3.73 109.514 -176.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.92 -50.56 66.13 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.61 1.55 . . . . 1.8700000000000001 111.364 174.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -68.02 -50.56 54.66 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.856 0.753 . . . . 3.0 111.737 -177.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -49.72 -40.93 42.31 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.705 -1.247 . . . . 5.4800000000000004 113.831 168.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.91 -40.53 75.53 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 124.971 1.308 . . . . 1.6299999999999999 111.766 177.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 95.6 t -60.79 -42.56 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 120.018 1.281 . . . . 2.04 110.719 168.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 21.0 mt -52.46 -45.38 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 CA-C-N 120.436 1.471 . . . . 1.79 111.934 168.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 22.4 t -68.62 -38.63 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 O-C-N 120.885 -1.134 . . . . 1.6000000000000001 113.232 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -58.02 -35.41 71.23 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.979 -1.076 . . . . 2.0499999999999998 111.536 170.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 93.9 t -74.71 -44.67 46.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 117.575 -1.203 . . . . 1.96 111.042 -178.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.51 -37.94 85.55 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 120.551 1.523 . . . . 3.71 112.719 174.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -65.28 -33.24 75.52 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.833 1.049 . . . . 2.25 113.833 -176.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -66.77 -55.57 14.37 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 121.266 -0.896 . . . . 3.4900000000000002 110.843 168.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -68.55 -24.21 64.6 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.791 1.034 . . . . 2.98 113.791 -171.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . 0.408 ' HZ3' ' CD ' ' B' ' 148' ' ' GLU . 36.7 pttt -69.18 -20.77 64.0 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.925 1.693 . . . . 3.2999999999999998 113.264 168.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -98.75 -0.02 43.57 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.828 1.651 . . . . 3.8999999999999999 115.001 170.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.477 0.922 0 C-N-CA 126.118 1.767 . . . . 3.6400000000000001 109.45 171.179 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.3 tt . . . . . 0 N--CA 1.471 0.586 0 CA-C-O 120.808 0.337 . . . . 4.3799999999999999 110.928 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 60.3 m -92.08 138.54 31.45 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.679 -0.859 . . . . 3.7400000000000002 108.679 167.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -53.86 -26.02 22.6 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 120.532 -1.355 . . . . 3.98 114.259 -175.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 20.0 p -71.23 -8.65 55.0 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.811 2.044 . . . . 2.3799999999999999 116.057 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 2.2 m -80.59 -42.7 21.83 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.988 1.267 . . . . 2.6600000000000001 112.459 -172.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -57.91 -49.06 78.03 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.661 1.184 . . . . 3.1499999999999999 112.011 -176.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -54.39 -20.69 7.88 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.162 1.171 . . . . 2.8199999999999998 114.162 173.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -105.39 -34.56 7.8 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.981 0.912 . . . . 2.4500000000000002 113.261 -173.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.6 tmm? -49.91 -49.96 47.96 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.554 1.142 . . . . 1.96 110.697 158.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 77.1 mt -57.05 -11.24 1.44 Allowed 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.813 1.783 . . . . 2.1400000000000001 115.813 168.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -106.35 -14.62 15.05 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 120.351 1.432 . . . . 2.5 112.42 177.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.96 -38.27 6.67 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.201 1.4 . . . . 2.4900000000000002 113.387 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.408 ' CD ' ' HZ3' ' B' ' 124' ' ' LYS . 42.9 mm-40 -77.68 -57.3 3.89 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.677 1.191 . . . . 3.2200000000000002 109.65 173.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.6 mt -91.95 42.3 1.1 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.26 1.024 . . . . 3.5699999999999998 111.643 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -71.76 -9.36 58.17 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.198 1.184 . . . . 2.0699999999999998 114.198 -172.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -92.98 -31.76 14.78 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.541 1.064 . . . . 2.1299999999999999 111.491 179.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 22.2 tpp -56.76 -1.73 0.07 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 128.897 2.879 . . . . 3.3399999999999999 115.933 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.7 mp -100.43 -173.98 2.54 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.638 2.375 . . . . 3.5899999999999999 114.427 -166.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 16.6 m -176.25 -104.98 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 129.824 3.25 . . . . 4.5199999999999996 107.393 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.44 12.73 0.06 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 128.068 2.547 . . . . 5.04 115.511 -171.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 67.64 13.81 9.36 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.992 1.717 . . . . 5.4299999999999997 110.444 -134.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.19 -48.01 85.88 Favored Glycine 0 N--CA 1.473 1.155 0 C-N-CA 126.089 1.804 . . . . 3.3799999999999999 115.854 -161.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -66.33 -48.65 69.59 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.611 1.205 . . . . 4.5899999999999999 111.42 174.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.0 ttt-85 -53.54 -28.22 30.32 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.664 1.357 . . . . 5.6699999999999999 114.664 175.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 55.9 mmtt -53.78 -36.17 62.11 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 122.247 2.294 . . . . 6.3799999999999999 111.535 173.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.44 -11.59 59.86 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.284 1.587 . . . . 2.1000000000000001 115.284 175.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -81.14 -51.58 8.3 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.274 1.03 . . . . 2.1899999999999999 111.616 164.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.18 -33.76 75.14 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.816 0.446 . . . . 2.6299999999999999 111.737 -173.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 7.6 ptmm? -58.11 -28.38 64.58 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.386 1.254 . . . . 4.3799999999999999 114.386 172.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 30.0 mt -79.09 -33.04 44.79 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.875 -0.516 . . . . 2.1699999999999999 112.163 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.4 mm -64.0 -52.19 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 123.686 0.794 . . . . 2.3300000000000001 109.372 -174.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -60.45 -38.01 82.8 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.828 1.251 . . . . 4.5199999999999996 112.251 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.02 -33.69 72.34 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.434 1.094 . . . . 4.1200000000000001 112.774 172.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.02 -21.57 19.66 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.193 -0.942 . . . . 4.5599999999999996 112.401 -177.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -65.21 -19.62 66.06 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.16 1.384 . . . . 2.7400000000000002 113.519 166.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -73.06 -24.17 60.65 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.012 1.115 . . . . 2.73 114.012 162.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 -116.71 -10.37 11.13 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.88 1.808 . . . . 2.2799999999999998 115.88 -165.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.51 138.11 24.58 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 121.326 1.876 . . . . 4.4900000000000002 114.76 -173.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -87.4 1.15 54.2 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.416 1.635 . . . . 4.3899999999999997 115.416 -172.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 97.27 9.84 54.99 Favored Glycine 0 CA--C 1.533 1.194 0 O-C-N 121.201 -0.937 . . . . 2.8399999999999999 112.907 -161.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.4 153.81 42.82 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 119.064 -1.054 . . . . 5.6600000000000001 109.044 131.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 36.2 mm -152.74 140.58 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 128.814 2.846 . . . . 3.48 106.32 178.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 3.7 t -106.2 167.51 9.76 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 119.849 1.204 . . . . 3.2200000000000002 112.431 163.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -57.51 -44.35 84.96 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.502 1.144 . . . . 3.5099999999999998 112.144 172.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -29.72 70.68 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.448 2.699 . . . . 3.52 112.248 -171.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.98 -46.38 81.73 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.024 0.93 . . . . 3.8300000000000001 111.024 178.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -57.57 -47.62 81.59 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.256 0.935 . . . . 3.8700000000000001 111.859 175.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.4 t-105 -60.06 -46.12 90.6 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.541 0.609 . . . . 0.93000000000000005 111.354 178.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 89.9 m -57.07 -46.09 82.76 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.968 1.307 . . . . 3.3900000000000001 110.766 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 71.9 mt -65.86 -40.67 91.89 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 117.056 -1.449 . . . . 2.1600000000000001 112.603 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 25.3 mm -53.23 -39.24 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 CA-C-N 121.02 1.736 . . . . 2.0499999999999998 112.261 -177.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.77 -18.63 62.04 Favored Glycine 0 CA--C 1.535 1.332 0 CA-C-N 119.446 1.021 . . . . 0.62 114.034 176.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -77.78 -20.75 73.14 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-N 118.721 1.26 . . . . 0.84999999999999998 113.623 175.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.1 mp -94.44 -45.29 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.394 1.078 . . . . 2.8199999999999998 110.666 166.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 23.8 m -82.16 80.01 8.5 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 125.937 1.695 . . . . 2.0 107.727 -177.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -155.9 -78.98 0.02 OUTLIER Glycine 0 CA--C 1.531 1.067 0 CA-C-O 118.656 -1.08 . . . . 1.28 113.138 -174.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.09 -40.08 35.7 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.337 2.691 . . . . 1.2 113.268 -172.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 18.9 pt -88.25 -14.69 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 N-CA-C 113.62 0.97 . . . . 2.8599999999999999 113.62 171.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -58.07 -39.56 78.81 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.926 1.239 . . . . 2.5 113.19 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -57.81 -45.61 85.85 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 120.617 -1.302 . . . . 3.5800000000000001 112.631 168.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.8 tt -59.2 -38.25 79.44 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 124.186 0.994 . . . . 2.1899999999999999 111.337 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 76.9 mt -49.59 -61.71 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 118.742 0.701 . . . . 2.0499999999999998 110.281 167.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -59.02 -34.95 72.48 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 120.928 -1.108 . . . . 2.1000000000000001 113.331 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -70.24 -26.34 63.79 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.529 0.732 . . . . 3.6499999999999999 111.204 177.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -77.4 -32.48 54.82 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 117.569 -1.205 . . . . 2.6000000000000001 113.596 172.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -70.58 5.59 1.79 Allowed 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 120.288 1.404 . . . . 2.6899999999999999 112.391 169.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -114.08 -74.48 0.62 Allowed 'General case' 0 CA--C 1.534 0.335 0 O-C-N 120.223 -1.548 . . . . 2.4500000000000002 110.741 166.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.262 0 C-N-CA 129.981 3.313 . . . . 4.96 115.759 168.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 . . . . . 0 N--CA 1.485 1.308 0 N-CA-C 106.967 -1.494 . . . . 3.7599999999999998 106.967 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.6 p -67.4 148.3 51.77 Favored 'General case' 0 N--CA 1.481 1.125 0 O-C-N 121.539 -0.726 . . . . 1.9199999999999999 109.804 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -64.82 -19.26 65.76 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-O 118.015 -0.993 . . . . 2.6400000000000001 113.251 176.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.39 -53.96 35.68 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 121.439 1.927 . . . . 2.1800000000000002 109.011 172.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -63.65 -52.91 58.67 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.36 1.064 . . . . 3.2799999999999998 109.666 -179.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.3 tptt -60.54 -30.64 69.88 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 120.756 -1.215 . . . . 6.9100000000000001 113.497 174.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.02 -37.81 78.86 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 119.758 -1.839 . . . . 1.55 113.076 170.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 71.8 t -56.03 -46.76 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.688 1.131 . . . . 1.7 110.062 164.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.8 mt -54.14 -52.25 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.977 1.262 . . . . 1.8400000000000001 111.683 172.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.5 t -60.36 -39.16 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.764 1.166 . . . . 1.98 112.262 -177.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mp -68.76 -34.1 75.02 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.328 -0.857 . . . . 2.1200000000000001 113.058 173.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.3 t -75.25 -42.24 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.156 0.982 . . . . 1.76 111.391 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -63.32 -37.73 88.38 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.893 0.769 . . . . 3.7200000000000002 111.572 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -55.26 -26.73 41.81 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 114.223 1.194 . . . . 2.0499999999999998 114.223 175.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -87.87 -60.14 2.05 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.292 1.037 . . . . 3.71 112.282 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -60.5 -28.45 68.38 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-O 118.824 -0.608 . . . . 2.9199999999999999 112.442 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -54.86 -19.67 7.06 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 119.888 -1.758 . . . . 3.75 114.465 172.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -93.31 10.08 33.56 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 114.933 1.457 . . . . 3.6600000000000001 114.933 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.477 0.923 0 CA-C-N 120.482 1.492 . . . . 4.1900000000000004 109.526 162.158 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 7.0 pt . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 111.448 0.166 . . . . 4.3399999999999999 111.448 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.0 p -111.86 148.99 32.47 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.588 -1.32 . . . . 4.6299999999999999 113.337 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.409 ' HE3' ' CG ' ' A' ' 70' ' ' HIS . 21.1 mttp -64.3 -32.24 73.76 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.624 -0.672 . . . . 3.4399999999999999 111.998 174.037 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 p -69.84 -38.84 76.64 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.508 1.123 . . . . 2.6899999999999999 113.417 179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.4 m -76.23 -34.71 59.22 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 117.831 -1.081 . . . . 1.9399999999999999 113.064 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -53.97 -52.75 59.69 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.881 1.673 . . . . 3.29 112.448 -177.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -61.42 -25.33 67.13 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.274 0.842 . . . . 2.7999999999999998 113.274 177.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -89.37 -51.2 5.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.419 1.487 . . . . 3.1800000000000002 110.293 -170.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 11.2 tmm? -48.39 -41.13 28.08 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.352 1.461 . . . . 2.27 111.965 163.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.9 mt -58.54 -32.05 68.52 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.788 1.403 . . . . 2.0 114.788 173.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -92.02 -3.34 55.95 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.587 1.54 . . . . 2.75 113.418 177.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.96 -65.22 0.99 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.356 1.063 . . . . 2.8900000000000001 111.614 164.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -75.29 -18.53 60.03 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.849 -1.157 . . . . 2.5099999999999998 112.78 -169.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.93 16.8 19.32 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.906 1.282 . . . . 3.1400000000000001 113.605 177.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -49.95 -34.49 20.87 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 114.642 1.349 . . . . 1.77 114.642 -175.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.425 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 53.9 m-70 -69.16 -21.17 64.01 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.848 1.425 . . . . 2.0 114.848 -175.566 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 52.1 mtm -114.44 -15.44 12.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.91 0.884 . . . . 3.3700000000000001 112.981 169.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 tt -74.61 68.49 1.65 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 123.294 1.521 . . . . 3.4500000000000002 110.361 163.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.4 t -94.83 -70.5 0.71 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 126.052 1.741 . . . . 3.9199999999999999 108.767 171.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -77.23 138.51 39.47 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.5 0.667 . . . . 7.0300000000000002 112.019 -165.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.2 m -50.06 -29.61 9.19 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.968 1.307 . . . . 5.1699999999999999 112.776 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.64 -48.2 85.86 Favored Glycine 0 CA--C 1.532 1.101 0 CA-C-O 118.648 -1.084 . . . . 3.4100000000000001 113.087 175.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -51.31 -60.5 3.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.559 1.143 . . . . 4.21 110.062 172.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -67.1 -37.74 84.47 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 113.57 0.952 . . . . 5.3399999999999999 113.57 -171.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.74 -40.01 88.15 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 117.581 -1.199 . . . . 5.2999999999999998 113.541 176.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -53.48 -49.4 67.56 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 127.093 2.746 . . . . 2.25 110.76 174.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.66 -54.45 33.18 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.786 1.634 . . . . 2.1600000000000001 113.15 171.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.81 -29.0 69.87 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-O 118.493 -0.765 . . . . 2.0899999999999999 112.799 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt -61.0 -33.26 72.97 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-N 121.113 1.779 . . . . 3.9199999999999999 112.742 171.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.4 mt -68.78 -38.03 79.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.55 -0.295 . . . . 1.76 110.682 -178.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 23.3 mm -56.44 -53.61 38.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 125.326 1.45 . . . . 2.3100000000000001 111.76 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -67.34 -37.23 82.94 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.157 0.983 . . . . 2.23 111.678 178.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -63.29 -33.73 76.14 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.025 0.379 . . . . 3.6499999999999999 112.025 173.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 14.0 tp -78.37 -20.57 50.97 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 120.867 -1.146 . . . . 4.9800000000000004 112.1 -177.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -56.56 -25.68 52.9 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.922 0.889 . . . . 3.4300000000000002 113.127 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.91 -2.96 49.72 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 115.656 1.724 . . . . 3.0600000000000001 115.656 172.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -130.03 19.9 5.44 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.956 1.253 . . . . 3.2799999999999998 114.154 -166.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.409 ' CG ' ' HE3' ' A' ' 35' ' ' LYS . 21.9 t60 -146.25 92.21 2.15 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.235 -1.541 . . . . 7.7999999999999998 113.643 -157.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -73.54 36.0 0.09 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 127.026 2.13 . . . . 5.0700000000000003 113.089 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.79 10.2 84.95 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 126.569 2.033 . . . . 2.8799999999999999 113.672 -169.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -107.03 158.88 16.71 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.805 2.442 . . . . 5.6799999999999997 111.12 -172.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.4 mm -130.95 138.16 54.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 108.473 -0.936 . . . . 3.02 108.473 161.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.2 t -73.46 -129.05 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 127.68 2.392 . . . . 2.8700000000000001 109.999 170.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -133.19 -44.15 0.85 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 120.143 -1.598 . . . . 3.29 110.242 164.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -64.76 -20.14 66.19 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.95 1.093 . . . . 4.54 113.95 -176.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -53.2 -56.28 17.65 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.642 1.177 . . . . 3.73 112.043 173.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -58.12 -45.79 86.71 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.283 0.947 . . . . 3.77 112.151 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.5 t-105 -65.3 -40.9 94.41 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.613 0.765 . . . . 0.75 111.981 -178.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.8 m -59.71 -46.02 90.36 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.577 1.951 . . . . 3.0499999999999998 111.676 171.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.5 mt -56.8 -42.82 80.17 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.751 0.705 . . . . 1.8999999999999999 111.639 176.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.8 mm -52.67 -40.65 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 CA-C-N 119.749 1.159 . . . . 1.7 112.582 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.54 -24.96 72.65 Favored Glycine 0 N--CA 1.476 1.329 0 C-N-CA 124.557 1.075 . . . . 0.58999999999999997 113.559 177.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -71.34 -23.22 78.31 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 121.445 -1.032 . . . . 0.57999999999999996 113.447 176.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -90.13 -45.04 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 118.616 1.208 . . . . 1.99 110.568 162.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.6 m -85.72 64.67 8.75 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 127.821 2.448 . . . . 1.6000000000000001 108.883 -172.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -144.02 -60.73 0.02 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.201 1.382 . . . . 1.25 111.742 -177.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -66.21 -72.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.991 3.127 . . . . 1.1000000000000001 110.647 165.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.4 pp -66.91 -14.11 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.483 1.038 . . . . 2.29 113.666 -170.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.0 -33.94 74.03 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.67 0.989 . . . . 2.0899999999999999 113.67 -177.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -42.15 95.09 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.871 -1.143 . . . . 3.6699999999999999 112.523 170.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.2 tt -56.52 -39.21 72.95 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 124.456 1.102 . . . . 2.3399999999999999 110.516 -173.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 22.2 mt -45.39 -62.8 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.675 1.59 . . . . 1.9299999999999999 111.837 169.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -69.31 -29.38 67.21 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.687 0.795 . . . . 1.76 112.515 -175.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.264 2.5 pt-20 -83.35 -16.89 44.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.112 0.869 . . . . 2.96 112.421 177.155 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.449 ' C ' ' H ' ' A' ' 99' ' ' GLN . 4.5 mm100 -83.32 -42.11 17.49 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 115.205 1.557 . . . . 2.3599999999999999 115.205 173.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -69.83 4.28 2.09 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 123.512 1.625 . . . . 2.3999999999999999 112.028 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.449 ' H ' ' C ' ' A' ' 97' ' ' GLN . 13.8 mm-40 . . . . . 0 C--N 1.329 -0.319 0 C-N-CA 127.722 2.409 . . . . 3.1299999999999999 109.7 176.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.425 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 17.4 m-85 . . . . . 0 N--CA 1.487 1.401 0 N-CA-C 107.826 -1.176 . . . . 3.8199999999999998 107.826 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.8 p -70.2 147.62 49.6 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 118.833 0.742 . . . . 1.96 109.478 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -64.8 -18.77 65.39 Favored 'General case' 0 C--O 1.213 -0.831 0 N-CA-C 113.549 0.944 . . . . 2.9500000000000002 113.549 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.94 -54.36 27.34 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 121.072 1.76 . . . . 2.1699999999999999 108.843 172.245 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -62.84 -52.15 64.25 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.801 1.241 . . . . 3.2200000000000002 110.429 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 25.2 tptt -60.79 -29.93 69.74 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.543 0.942 . . . . 7.6500000000000004 113.543 173.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.3 -37.5 77.82 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.045 -1.659 . . . . 1.5800000000000001 112.858 170.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 91.3 t -57.61 -45.37 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-N 119.964 1.256 . . . . 1.72 109.58 166.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 6.9 mt -53.84 -53.86 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.252 0.933 . . . . 2.04 111.455 171.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 18.4 t -58.21 -42.85 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 119.532 1.06 . . . . 1.9299999999999999 111.864 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 4.4 mp -66.25 -41.82 89.42 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.296 -0.877 . . . . 2.0499999999999998 112.731 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 50.2 t -67.43 -40.88 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.85 0.86 . . . . 1.77 111.328 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 59.9 tt0 -65.44 -39.79 92.48 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 118.718 0.69 . . . . 3.7000000000000002 112.42 171.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -60.25 -19.45 54.75 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.173 1.351 . . . . 2.4399999999999999 114.123 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -91.2 -60.66 1.84 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.989 1.316 . . . . 3.3900000000000001 112.522 170.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -59.13 -27.5 65.66 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.104 0.866 . . . . 2.9700000000000002 113.135 -176.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -49.11 -19.37 0.43 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.383 1.623 . . . . 3.7799999999999998 115.383 177.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -83.55 -13.29 54.79 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 116.077 1.88 . . . . 3.5600000000000001 116.077 174.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 N--CA 1.482 1.16 0 CA-C-N 121.187 1.812 . . . . 5.5099999999999998 109.527 174.153 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 10.0 pt . . . . . 0 N--CA 1.473 0.723 0 CA-C-O 120.815 0.34 . . . . 4.0700000000000003 110.818 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 79.5 p -116.42 141.23 48.44 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.012 -1.055 . . . . 4.3399999999999999 113.08 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 11.9 mttp -53.7 -28.42 33.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.133 1.373 . . . . 3.2400000000000002 112.925 173.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 9.5 p -72.94 -34.3 66.47 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.937 1.295 . . . . 2.9700000000000002 113.982 176.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 45.4 t -82.43 -43.23 17.55 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 117.799 -1.096 . . . . 3.1600000000000001 113.335 -169.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -54.72 -48.42 72.55 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.939 1.699 . . . . 3.2400000000000002 112.566 -176.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -60.36 -27.21 67.21 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.504 0.927 . . . . 3.0699999999999998 113.504 176.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -92.94 -50.28 5.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.836 1.654 . . . . 3.1299999999999999 111.266 -170.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 10.7 tmm? -51.27 -39.84 57.61 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.724 1.21 . . . . 2.1200000000000001 111.575 167.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.0 mt -54.47 -36.99 64.7 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.481 1.289 . . . . 2.2599999999999998 114.481 174.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.84 -4.8 59.22 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.926 1.239 . . . . 2.6800000000000002 113.467 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.28 -61.21 1.56 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.227 1.011 . . . . 2.7799999999999998 111.505 163.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.27 -18.22 46.68 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.878 1.671 . . . . 2.7400000000000002 112.775 -164.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.25 20.56 13.1 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 126.319 1.848 . . . . 3.0600000000000001 113.147 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -51.8 -33.04 33.82 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.946 1.462 . . . . 1.6599999999999999 114.946 -173.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -69.24 -26.34 64.74 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.826 1.047 . . . . 2.04 113.826 -174.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 53.3 mtm -109.71 -14.47 14.33 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.026 0.93 . . . . 3.5299999999999998 112.702 171.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.09 65.0 1.09 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 122.919 1.342 . . . . 3.2400000000000002 111.037 163.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 3.5 t -88.63 -67.47 0.83 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.245 -1.343 . . . . 3.9900000000000002 108.853 170.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -80.79 139.23 36.15 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.61 0.719 . . . . 7.2599999999999998 112.185 -161.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 51.1 m -49.13 -31.99 9.16 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.867 1.267 . . . . 5.1799999999999997 112.303 173.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.58 -50.72 64.45 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.855 -0.97 . . . . 3.4700000000000002 112.802 176.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -49.31 -60.92 2.4 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.539 1.136 . . . . 4.2599999999999998 110.634 171.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -69.58 -35.74 75.63 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.716 1.006 . . . . 5.2300000000000004 113.716 -170.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.0 -40.17 90.9 Favored 'General case' 0 CA--C 1.511 -0.542 0 O-C-N 120.454 -1.404 . . . . 5.3399999999999999 112.946 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -50.47 -51.45 46.9 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 126.593 2.433 . . . . 2.2400000000000002 110.551 174.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -48.9 -56.43 8.82 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.144 0.978 . . . . 1.74 112.554 173.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.48 -34.61 71.09 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.868 0.867 . . . . 1.8999999999999999 112.738 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -59.82 -34.13 72.67 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 120.628 1.558 . . . . 4.0099999999999998 113.231 172.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.2 mt -68.93 -34.0 74.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.35 -0.387 . . . . 1.8400000000000001 111.55 -178.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 23.3 mm -64.31 -48.7 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 123.515 0.726 . . . . 1.99 110.876 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -68.77 -34.83 76.23 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.413 1.085 . . . . 2.2000000000000002 112.059 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 28.8 m-20 -62.33 -43.19 99.41 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 120.569 0.223 . . . . 3.8300000000000001 111.343 169.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 12.4 tp -67.34 -19.97 65.52 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 120.865 -1.147 . . . . 4.75 112.671 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.35 -26.3 64.94 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.77 0.656 . . . . 3.7400000000000002 112.77 176.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.76 -5.11 56.7 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.318 1.599 . . . . 3.1400000000000001 115.318 171.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -120.39 12.88 11.76 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.049 1.34 . . . . 3.2200000000000002 114.103 -167.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -143.35 90.57 2.18 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 120.377 -1.452 . . . . 7.7300000000000004 114.196 -153.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -72.58 39.39 0.08 Allowed 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 126.446 1.898 . . . . 5.2800000000000002 113.207 173.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 69.73 6.34 55.07 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 125.99 1.757 . . . . 2.5600000000000001 114.103 -171.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -96.64 163.23 13.11 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.602 1.961 . . . . 5.3700000000000001 110.875 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 19.2 mm -129.32 143.82 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 107.769 -1.197 . . . . 3.1600000000000001 107.769 157.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 22.1 t -75.2 -138.18 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.953 2.101 . . . . 2.54 110.728 171.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -125.14 -46.26 1.81 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 119.865 -1.772 . . . . 3.23 110.514 161.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -62.04 -19.89 63.37 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.44 1.274 . . . . 4.46 114.44 -178.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -52.15 -52.86 49.14 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.275 1.03 . . . . 3.4199999999999999 111.996 172.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -62.62 -45.53 92.44 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.917 -1.114 . . . . 4.5300000000000002 111.554 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.0 t-105 -62.43 -44.64 95.94 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.517 0.727 . . . . 0.81000000000000005 112.306 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 58.4 m -55.68 -50.9 69.03 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.778 1.631 . . . . 3.0 110.956 170.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 81.9 mt -60.35 -33.23 72.12 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.194 -0.908 . . . . 1.79 112.967 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 29.3 mm -55.49 -42.47 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 CA-C-N 120.564 1.529 . . . . 1.95 111.807 174.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.37 -24.72 73.68 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.745 1.164 . . . . 0.64000000000000001 113.651 178.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.02 -19.77 77.38 Favored Glycine 0 CA--C 1.536 1.353 0 O-C-N 121.269 -1.136 . . . . 0.68999999999999995 113.566 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 5.0 mp -93.74 -47.37 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 118.421 1.111 . . . . 1.8899999999999999 110.63 160.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.4 m -83.63 62.73 7.02 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 128.425 2.69 . . . . 1.6399999999999999 109.174 -173.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -142.29 -60.77 0.03 OUTLIER Glycine 0 CA--C 1.528 0.9 0 C-N-CA 125.695 1.617 . . . . 1.23 111.301 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -64.3 -73.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 124.146 3.23 . . . . 1.2 111.048 165.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.4 pp -66.37 -14.58 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 119.708 1.14 . . . . 2.3199999999999998 113.805 -169.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.63 -32.49 73.53 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.639 1.176 . . . . 2.1800000000000002 114.08 -176.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -44.93 91.43 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.603 -1.311 . . . . 3.7799999999999998 112.537 168.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.1 tt -57.48 -36.51 71.58 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.414 1.086 . . . . 2.4100000000000001 111.325 -172.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 29.2 mt -45.44 -63.05 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.872 1.669 . . . . 1.9399999999999999 110.997 170.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -65.63 -35.4 80.7 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.607 0.763 . . . . 1.8100000000000001 111.91 -176.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.297 2.2 pt-20 -76.91 -20.25 56.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.544 1.066 . . . . 3.0800000000000001 112.51 177.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . 0.448 ' C ' ' H ' ' B' ' 202' ' ' GLN . 5.2 mm100 -80.76 -42.75 21.28 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 115.329 1.604 . . . . 2.4700000000000002 115.329 174.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -70.44 6.18 1.49 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 123.609 1.671 . . . . 2.5 112.385 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.448 ' H ' ' C ' ' B' ' 200' ' ' GLN . 12.1 mm-40 -125.36 -68.44 0.84 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.506 2.322 . . . . 3.0 110.407 176.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.295 11.3 pt20 . . . . . 0 N--CA 1.477 0.879 1 C-N-CA 131.944 4.097 . . . . 4.5599999999999996 115.681 -177.79 . . . . . . . . 2 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 113.946 1.091 . . . . 3.6800000000000002 113.946 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.8 p -73.14 154.23 40.42 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.107 0.563 . . . . 2.5800000000000001 111.451 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.34 2.11 8.21 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.259 1.023 . . . . 2.6200000000000001 113.1 169.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.11 -56.33 4.16 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.598 -1.314 . . . . 2.0 109.306 158.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -76.94 -50.51 13.07 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 120.854 -1.154 . . . . 2.73 112.837 -168.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.0 tmtt? -58.38 -24.86 61.17 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.209 -0.932 . . . . 5.9800000000000004 111.494 169.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.31 -43.23 57.58 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 119.662 -1.899 . . . . 1.73 112.721 168.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 77.0 t -55.29 -35.65 37.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 CA-C-N 120.612 1.551 . . . . 1.8899999999999999 111.258 169.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 38.2 mt -53.88 -58.9 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.026 0.83 . . . . 2.2000000000000002 111.081 165.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 49.2 t -61.37 -40.16 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.28 1.032 . . . . 2.1899999999999999 113.424 -177.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.7 mp -65.26 -40.06 93.46 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.522 1.056 . . . . 2.0499999999999998 111.843 177.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.0 t -63.84 -43.8 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-O 118.747 -0.644 . . . . 1.6699999999999999 110.605 171.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.46 -43.53 75.57 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.695 0.68 . . . . 3.6499999999999999 111.51 173.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.75 -15.87 63.85 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.979 1.474 . . . . 2.3900000000000001 114.979 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -86.3 -53.41 5.04 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.109 -0.994 . . . . 3.5800000000000001 111.306 167.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -60.61 -39.41 88.05 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.804 0.668 . . . . 3.1800000000000002 112.804 -175.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -19.76 65.06 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 114.981 1.475 . . . . 4.4400000000000004 114.981 173.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -95.44 -28.98 14.65 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.695 1.198 . . . . 4.0 112.603 172.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.6 t . . . . . 0 N--CA 1.485 1.321 0 CA-C-N 118.974 0.806 . . . . 3.48 110.771 165.28 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.4 pt . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 108.995 -0.743 . . . . 3.9300000000000002 108.995 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.7 m -60.14 136.64 58.08 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.24 0.829 . . . . 3.0600000000000001 113.24 -166.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -55.75 -31.85 62.9 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 120.877 -1.14 . . . . 6.0199999999999996 113.518 176.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.72 -30.86 14.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.774 1.63 . . . . 3.23 113.151 169.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.9 m -77.58 -36.29 52.12 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.985 -1.072 . . . . 1.9099999999999999 112.622 -174.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -53.01 -56.19 17.95 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.283 0.947 . . . . 3.0899999999999999 111.023 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 13.9 ptt85 -61.62 -8.39 4.42 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.844 1.258 . . . . 4.0199999999999996 113.966 -178.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -117.0 -32.79 4.94 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.943 1.297 . . . . 4.2199999999999998 113.715 -174.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 5.6 tmm? -50.97 -42.98 60.41 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.873 0.76 . . . . 1.95 109.399 150.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.1 mt -62.68 -19.02 63.44 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 115.502 1.668 . . . . 2.2999999999999998 115.502 169.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -91.57 -35.5 14.23 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 119.714 1.143 . . . . 2.6499999999999999 112.106 172.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -81.27 -50.98 8.88 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.042 0.837 . . . . 2.7799999999999998 112.271 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -78.46 -30.58 47.49 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.907 0.776 . . . . 2.6800000000000002 111.769 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.16 19.41 20.64 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.055 1.342 . . . . 2.3900000000000001 113.763 -177.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -48.09 -35.38 11.25 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.143 1.777 . . . . 1.4299999999999999 115.228 -173.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.466 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 7.4 m-70 -65.21 -21.11 66.71 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.437 1.495 . . . . 2.3500000000000001 114.588 -178.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 39.4 ttm -95.22 10.52 35.71 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.462 1.505 . . . . 3.1099999999999999 114.325 -169.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.7 mp -81.11 169.81 16.96 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.818 1.247 . . . . 3.54 112.489 178.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.3 m -157.12 36.35 0.29 Allowed 'General case' 0 N--CA 1.476 0.838 0 O-C-N 119.843 -1.786 . . . . 4.4400000000000004 110.386 -164.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.498 ' CG ' ' H ' ' A' ' 53' ' ' THR . 19.6 t70 92.71 -175.06 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 129.592 3.157 . . . . 4.0599999999999996 107.865 -146.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.498 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 52.8 p -66.38 -12.76 58.69 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.971 1.708 . . . . 3.96 114.764 170.018 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.46 -30.72 42.12 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 125.668 1.604 . . . . 1.79 114.644 -171.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -69.24 -45.55 69.52 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.483 1.513 . . . . 3.23 110.65 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.9 ttt-85 -65.74 -47.33 75.66 Favored 'General case' 0 C--N 1.346 0.448 0 O-C-N 121.461 -0.774 . . . . 6.0300000000000002 110.039 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.8 mmtt -55.94 -29.04 59.51 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.09 0.774 . . . . 4.9100000000000001 113.09 175.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.86 -39.27 69.79 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 117.759 -1.115 . . . . 1.79 112.305 171.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.62 -44.37 93.48 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.386 1.075 . . . . 2.02 111.969 172.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -53.01 -37.57 61.6 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.376 1.07 . . . . 2.2599999999999998 112.731 175.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -61.3 -34.53 75.37 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 120.195 -1.565 . . . . 4.6699999999999999 112.797 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.4 mt -74.5 -38.2 62.93 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.04 1.336 . . . . 2.04 111.852 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.8 mm -49.56 -59.18 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 117.726 -1.13 . . . . 2.2400000000000002 109.595 170.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -62.51 -36.15 81.66 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 119.603 1.092 . . . . 3.3599999999999999 113.091 -174.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -62.71 -34.48 77.23 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.859 1.263 . . . . 3.5 113.009 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -86.36 -44.85 11.74 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.368 1.067 . . . . 4.0300000000000002 112.266 176.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -62.43 -38.76 90.97 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.281 1.433 . . . . 2.54 111.724 -168.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.78 -18.72 13.71 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.66 1.184 . . . . 2.9100000000000001 114.117 171.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -113.43 -0.54 14.44 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.082 1.753 . . . . 3.1099999999999999 113.099 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -135.24 128.77 32.54 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 120.964 1.711 . . . . 4.8700000000000001 112.042 -163.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -79.49 46.56 0.76 Allowed 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 122.599 1.19 . . . . 4.8200000000000003 112.042 -175.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 59.45 2.24 1.5 Allowed Glycine 0 CA--C 1.538 1.489 0 C-N-CA 125.24 1.4 . . . . 4.1100000000000003 113.043 -157.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -79.06 100.63 7.44 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 120.609 -1.524 . . . . 8.6999999999999993 110.977 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.5 pt -69.58 166.4 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.965 1.706 . . . . 4.3300000000000001 112.976 162.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 64.2 m -141.87 169.36 17.74 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.451 1.5 . . . . 3.2000000000000002 110.973 166.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -52.62 -55.74 20.25 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.31 1.053 . . . . 3.2400000000000002 111.927 179.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.02 -37.82 64.49 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 128.733 2.813 . . . . 2.98 111.785 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -74.77 -46.98 33.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.588 1.155 . . . . 3.6800000000000002 110.603 -171.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -51.12 -54.09 28.28 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.725 0.693 . . . . 2.9100000000000001 111.002 167.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 22.6 t-105 -62.78 -46.87 86.01 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 118.375 0.534 . . . . 0.62 111.873 -171.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 39.1 p -61.31 -43.49 98.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 117.785 -1.102 . . . . 4.0999999999999996 111.549 178.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 23.8 mt -56.44 -36.88 69.51 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.173 -0.918 . . . . 2.1200000000000001 113.231 175.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.1 mm -51.07 -36.52 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-N 120.127 1.33 . . . . 1.97 111.232 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.49 -19.65 76.42 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.479 1.037 . . . . 0.68000000000000005 114.646 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.11 -11.84 84.96 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 119.083 1.441 . . . . 0.73999999999999999 113.44 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.8 mp -105.0 -45.71 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.041 1.336 . . . . 1.9399999999999999 110.263 165.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.7 m -80.71 88.18 5.79 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 126.582 1.953 . . . . 1.74 107.782 178.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -172.22 -77.6 0.05 OUTLIER Glycine 0 CA--C 1.528 0.856 0 CA-C-O 118.384 -1.231 . . . . 1.29 112.602 -170.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -59.71 -41.53 54.61 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.417 2.745 . . . . 1.1000000000000001 112.756 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.8 pt -77.39 -11.39 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 114.216 1.191 . . . . 2.2200000000000002 114.216 174.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.16 -32.63 74.07 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 113.936 1.087 . . . . 2.2400000000000002 113.936 -166.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -43.68 97.57 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.856 -1.153 . . . . 4.1799999999999997 111.963 169.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.5 tt -61.43 -37.82 84.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.892 1.277 . . . . 2.5299999999999998 110.875 -169.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 97.3 mt -50.06 -67.14 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.29 1.436 . . . . 2.04 110.97 168.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -59.7 -29.83 68.38 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.598 -1.314 . . . . 1.78 112.998 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.24 -29.68 65.41 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.944 0.898 . . . . 3.54 111.781 174.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.437 ' C ' ' H ' ' A' ' 99' ' ' GLN . 6.4 tp-100 -77.81 -37.96 47.48 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.782 2.033 . . . . 4.9400000000000004 110.984 179.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -63.01 4.1 0.2 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 123.483 1.611 . . . . 2.5899999999999999 113.331 171.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.437 ' H ' ' C ' ' A' ' 97' ' ' GLN . 34.8 mm-40 . . . . . 0 C--N 1.326 -0.444 0 C-N-CA 125.301 1.44 . . . . 3.0 110.925 169.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 113.555 0.946 . . . . 3.5099999999999998 113.555 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 20.7 p -67.98 154.8 40.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 122.608 0.363 . . . . 2.27 110.105 -175.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -57.92 -38.39 75.81 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-O 118.322 -0.846 . . . . 2.4900000000000002 111.471 174.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.1 -53.52 49.18 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.523 1.056 . . . . 1.73 110.67 173.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 12.1 tm-20 -74.64 -47.4 32.28 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.613 -0.68 . . . . 2.8399999999999999 111.769 -170.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -60.95 -28.1 68.72 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.873 0.869 . . . . 5.5 111.908 171.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.38 -41.43 73.07 Favored 'General case' 0 C--O 1.222 -0.39 0 O-C-N 119.559 -1.963 . . . . 1.6599999999999999 112.565 166.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 64.3 t -59.71 -37.04 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 120.572 1.533 . . . . 1.8500000000000001 110.698 171.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 26.2 mt -53.41 -59.17 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 118.913 0.778 . . . . 1.8700000000000001 111.166 164.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 44.3 t -61.45 -40.83 87.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-N 119.342 0.973 . . . . 1.8 113.307 -175.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.7 mp -63.18 -45.47 91.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.593 1.157 . . . . 2.0 111.68 174.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 44.5 t -57.16 -46.45 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-O 118.794 -0.622 . . . . 1.8999999999999999 110.302 173.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.1 -44.77 75.23 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 118.849 0.749 . . . . 3.46 111.391 173.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . 0.414 HD22 ' HG3' ' B' ' 148' ' ' GLU . 0.3 OUTLIER -67.36 -15.67 63.81 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.933 1.457 . . . . 2.25 114.933 -179.332 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -85.04 -58.19 2.79 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.442 -0.786 . . . . 3.8100000000000001 111.151 166.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -57.74 -38.47 75.39 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.133 0.79 . . . . 3.1200000000000001 113.133 -175.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -19.59 65.98 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.534 1.309 . . . . 4.3899999999999997 114.534 175.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -92.86 -32.58 14.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.509 1.123 . . . . 3.8100000000000001 112.337 169.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 97.7 t . . . . . 0 N--CA 1.487 1.414 0 CA-C-N 119.348 0.976 . . . . 3.3500000000000001 111.043 167.453 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 3.8 pt . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 109.56 -0.533 . . . . 4.0199999999999996 109.56 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 2.9 m -59.53 138.86 57.56 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.995 1.109 . . . . 2.7200000000000002 113.995 -164.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . 0.456 ' HZ3' ' CD ' ' B' ' 181' ' ' GLU . 3.0 mtpp -56.89 -37.75 71.81 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 120.426 -1.421 . . . . 6.0199999999999996 110.48 169.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 66.0 m -55.94 -13.36 1.82 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.803 2.041 . . . . 4.0999999999999996 116.093 167.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 74.5 m -88.76 -39.19 14.11 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.42 1.463 . . . . 1.8500000000000001 111.975 169.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -52.54 -48.23 66.22 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 120.242 1.383 . . . . 3.6600000000000001 111.819 -179.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 19.6 ptt85 -55.23 -18.76 6.59 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.776 1.399 . . . . 4.5800000000000001 114.776 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -114.8 -32.12 5.91 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.759 1.223 . . . . 3.3999999999999999 113.659 -172.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 6.3 tmm? -50.67 -46.46 58.63 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.725 -0.472 . . . . 2.0499999999999998 109.725 153.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 4.4 mt -63.87 -27.63 69.29 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 114.923 1.453 . . . . 2.48 114.923 170.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -77.35 -33.46 55.34 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 120.258 1.39 . . . . 2.5299999999999998 112.177 175.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -84.77 -55.33 4.15 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.392 0.677 . . . . 2.2999999999999998 112.801 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.414 ' HG3' HD22 ' B' ' 121' ' ' ASN . 3.8 mm-40 -77.0 -19.52 57.17 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.639 0.654 . . . . 2.7200000000000002 112.589 -174.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.52 20.02 12.51 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.464 1.506 . . . . 2.9100000000000001 113.294 -177.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -52.13 -26.0 10.24 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 116.159 1.911 . . . . 1.3899999999999999 116.159 -172.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . 0.415 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 6.6 m-70 -77.47 -25.19 50.29 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.87 -1.144 . . . . 2.4100000000000001 113.576 -175.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 32.1 ttm -80.01 27.81 0.3 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.338 1.455 . . . . 3.46 113.973 -171.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.6 mp -102.71 173.69 6.22 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.437 1.895 . . . . 4.0199999999999996 113.289 -171.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 62.5 m -162.22 43.53 0.14 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 126.032 1.733 . . . . 4.6500000000000004 109.469 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . 0.45 ' CG ' ' H ' ' B' ' 156' ' ' THR . 7.5 t70 82.82 -175.98 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.575 2.35 . . . . 4.4900000000000002 108.498 -144.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 156' ' ' THR . . . . . 0.45 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 70.7 p -66.46 -15.82 63.64 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 128.468 2.707 . . . . 3.98 114.87 -178.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.71 -37.27 67.98 Favored Glycine 0 N--CA 1.476 1.309 0 CA-C-N 120.622 1.555 . . . . 1.8999999999999999 113.328 -173.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.97 -39.62 94.55 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.387 1.475 . . . . 3.52 110.79 176.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 43.2 ttt-85 -71.59 -38.81 70.84 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.327 -0.858 . . . . 5.5599999999999996 112.942 167.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -57.48 -33.44 68.0 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.237 -1.539 . . . . 3.9500000000000002 111.175 178.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -65.28 -13.95 59.6 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 115.973 1.842 . . . . 1.8300000000000001 115.973 171.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.01 -49.53 10.14 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.822 1.249 . . . . 1.9399999999999999 110.817 164.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -59.48 -34.53 72.7 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 125.047 1.339 . . . . 2.8500000000000001 111.686 -176.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -55.55 -31.1 61.86 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 120.861 -1.149 . . . . 4.8499999999999996 113.684 169.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 23.4 mt -82.8 -37.33 24.65 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.332 -0.855 . . . . 2.21 112.391 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 26.8 mm -47.89 -60.61 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.098 0.959 . . . . 1.8100000000000001 109.299 173.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -58.25 -39.26 78.71 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.37 0.878 . . . . 2.4300000000000002 113.37 -174.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -62.69 -29.6 70.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.594 1.558 . . . . 3.6000000000000001 112.637 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -99.69 -47.2 5.16 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.308 1.443 . . . . 4.3799999999999999 110.839 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -53.61 -48.03 69.67 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 128.863 2.865 . . . . 2.6699999999999999 111.533 -178.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.52 -15.1 15.76 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 115.009 1.485 . . . . 3.77 115.009 175.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -118.28 5.74 11.89 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.982 1.713 . . . . 4.0599999999999996 112.852 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.02 134.18 42.12 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 119.749 -1.844 . . . . 5.2999999999999998 113.627 -164.004 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -79.83 58.86 2.96 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 122.422 1.106 . . . . 4.6399999999999997 111.604 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 62.8 19.54 60.96 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.169 1.842 . . . . 4.1900000000000004 113.451 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -88.67 153.34 21.19 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 122.835 1.302 . . . . 8.8000000000000007 114.06 -163.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 5.3 pt -132.15 169.65 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 128.022 2.529 . . . . 4.75 109.784 170.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 58.6 m -142.09 176.66 8.79 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.019 1.328 . . . . 2.0499999999999998 109.562 165.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -59.15 -52.58 65.11 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 122.371 1.081 . . . . 3.3599999999999999 110.083 168.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -43.71 87.17 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 129.053 2.941 . . . . 3.0600000000000001 111.128 -178.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . 0.456 ' CD ' ' HZ3' ' B' ' 138' ' ' LYS . 10.5 tm-20 -72.64 -47.43 47.65 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.454 1.102 . . . . 3.6000000000000001 110.691 -174.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -51.33 -51.53 53.56 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.931 1.241 . . . . 3.0800000000000001 111.598 168.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -65.25 -41.79 93.94 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.394 0.516 . . . . 0.81000000000000005 112.394 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 41.7 p -65.5 -37.21 86.13 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 117.908 -1.044 . . . . 3.8999999999999999 111.777 176.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 76.3 mt -57.33 -39.91 76.88 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.973 0.806 . . . . 1.75 112.549 172.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 42.2 mm -54.07 -44.79 64.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 119.773 1.17 . . . . 2.0800000000000001 111.596 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -70.15 -5.63 54.3 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 125.081 1.324 . . . . 1.03 114.266 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -93.3 -11.97 57.86 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-O 118.495 -1.169 . . . . 0.75 113.775 170.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.9 mp -95.35 -56.21 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 119.036 1.418 . . . . 2.3500000000000001 107.895 164.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 42.1 m -74.65 98.01 3.33 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 126.252 1.821 . . . . 2.23 108.119 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -170.45 -80.18 0.05 OUTLIER Glycine 0 CA--C 1.532 1.143 0 C-N-CA 124.985 1.279 . . . . 1.45 112.787 -172.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -62.53 -43.38 22.21 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.126 2.551 . . . . 1.5800000000000001 112.125 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 10.4 pt -72.49 -10.35 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 114.313 1.227 . . . . 2.5600000000000001 114.313 173.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.92 -35.18 76.03 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.109 1.152 . . . . 2.4500000000000002 114.109 -174.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -48.82 80.06 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.471 -1.393 . . . . 4.54 111.734 166.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.14 -37.83 78.21 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.183 1.393 . . . . 2.6200000000000001 111.917 -174.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 96.5 mt -53.29 -60.7 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.441 1.496 . . . . 2.4100000000000001 111.935 168.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -63.74 -30.67 71.74 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.381 -0.824 . . . . 1.8999999999999999 112.094 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -71.72 -27.28 62.9 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.4 -0.812 . . . . 3.75 111.86 175.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . 0.405 ' C ' ' H ' ' B' ' 202' ' ' GLN . 6.0 tp-100 -73.98 -39.67 63.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.821 1.248 . . . . 5.3499999999999996 110.248 179.028 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.6 1.81 0.53 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 125.408 1.483 . . . . 3.1000000000000001 112.905 172.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.405 ' H ' ' C ' ' B' ' 200' ' ' GLN . 33.7 mm-40 -109.73 -71.35 0.77 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 120.427 -1.42 . . . . 2.98 111.579 167.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 . . . . . 0 CA--C 1.532 0.268 0 CA-C-N 114.92 -1.037 . . . . 5.9800000000000004 112.414 -164.751 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 . . . . . 0 N--CA 1.477 0.898 0 CA-C-O 120.844 0.354 . . . . 3.5499999999999998 111.22 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 70.5 p -57.53 148.21 24.53 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.84 0.856 . . . . 2.1000000000000001 109.634 176.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -59.17 -31.42 68.97 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 118.554 0.615 . . . . 2.2799999999999998 111.445 175.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.87 -41.75 98.23 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.681 -0.637 . . . . 2.3199999999999998 111.0 177.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -53.09 13.17 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 118.407 -0.806 . . . . 3.3700000000000001 110.495 175.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -42.32 -43.09 3.36 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.343 1.057 . . . . 5.6299999999999999 112.5 170.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.17 -42.09 76.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 125.054 1.342 . . . . 1.5800000000000001 112.668 -178.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 54.3 t -56.52 -46.41 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.99 0.814 . . . . 2.1899999999999999 109.762 167.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 16.3 mt -54.77 -49.15 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-N 118.413 0.551 . . . . 2.1200000000000001 111.432 174.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.7 t -65.07 -41.71 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 118.997 0.817 . . . . 1.78 112.341 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.56 -41.38 97.29 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.251 -0.905 . . . . 1.96 111.233 176.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 80.1 t -72.66 -37.33 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.275 1.43 . . . . 1.76 112.486 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -55.51 -54.75 40.01 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.312 1.045 . . . . 3.04 110.142 170.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -71.12 -9.57 58.28 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.198 1.184 . . . . 2.7400000000000002 114.198 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.423 ' HB2' ' CE2' ' A' ' 79' ' ' TYR . 60.0 t80 -79.95 -65.62 0.98 Allowed 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.853 -1.154 . . . . 3.9300000000000002 112.22 167.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -63.69 -28.63 70.03 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 118.934 -0.555 . . . . 3.6899999999999999 112.053 -170.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.0 mtpt -46.35 -38.59 9.01 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.354 1.462 . . . . 3.8799999999999999 114.44 168.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -92.41 -26.09 18.18 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.808 -0.557 . . . . 3.5 111.325 -176.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.8 t . . . . . 0 N--CA 1.473 0.678 0 C-N-CA 126.243 1.817 . . . . 3.3100000000000001 112.881 176.051 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.3 tt . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 108.379 -0.971 . . . . 3.8900000000000001 108.379 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.8 m -163.9 163.29 23.71 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 127.081 2.152 . . . . 4.7800000000000002 109.433 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.452 ' HZ1' ' HA ' ' A' ' 67' ' ' ASP . 39.4 pttt -47.15 -13.3 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.273 0 N-CA-C 118.011 2.597 . . . . 3.79 118.011 179.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.3 m -78.98 -28.02 43.5 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 119.912 -1.743 . . . . 2.8100000000000001 114.501 169.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.8 m -77.66 -48.76 16.02 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.624 1.102 . . . . 1.6100000000000001 111.477 -171.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -49.13 -49.6 41.38 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.166 0.986 . . . . 3.2599999999999998 112.032 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -58.3 -30.24 66.5 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 118.23 -0.891 . . . . 4.4900000000000002 113.16 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -96.58 -40.93 8.79 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.172 1.389 . . . . 2.8799999999999999 113.533 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 43.3 ttp -49.43 -42.1 41.83 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.863 1.665 . . . . 2.5899999999999999 112.044 163.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.0 mt -55.01 -19.99 8.18 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 114.398 1.258 . . . . 1.8999999999999999 114.398 170.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -98.75 -11.23 22.09 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.447 1.499 . . . . 2.6499999999999999 113.009 177.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 -59.5 1.77 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.275 1.03 . . . . 2.54 112.118 170.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -76.9 -26.42 54.13 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.708 1.203 . . . . 3.5899999999999999 113.156 -172.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.15 43.91 2.34 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.006 1.722 . . . . 2.73 111.745 -179.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -84.24 -17.86 38.38 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 116.566 2.061 . . . . 1.3400000000000001 116.566 -171.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.525 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 10.5 m-70 -80.92 -25.99 37.08 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 120.917 1.69 . . . . 2.1899999999999999 113.244 -168.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 76.0 mtm -97.59 15.5 23.21 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.182 1.393 . . . . 3.79 113.257 164.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.26 -152.56 0.29 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.194 1.798 . . . . 3.2200000000000002 110.853 174.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.1 t 69.11 -35.91 0.32 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.849 2.059 . . . . 6.6100000000000003 113.78 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -35.03 18.26 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 127.3 2.24 . . . . 6.3499999999999996 113.075 174.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 95.1 m 74.41 -23.45 0.23 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 127.329 2.252 . . . . 3.4900000000000002 114.123 169.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.26 -48.97 76.15 Favored Glycine 0 CA--C 1.532 1.154 0 CA-C-N 120.549 1.522 . . . . 2.5899999999999999 110.244 160.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -37.47 -65.2 0.33 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.073 2.549 . . . . 4.6299999999999999 111.254 159.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.9 tpm_? -56.77 -46.52 81.41 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 114.613 1.338 . . . . 6.96 114.613 -175.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -66.28 -35.86 81.49 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.534 0.733 . . . . 3.8700000000000001 111.586 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.19 -32.87 66.89 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 118.086 -0.959 . . . . 1.8300000000000001 112.885 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.56 -44.12 95.05 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.422 1.089 . . . . 1.8899999999999999 112.78 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.99 -22.73 59.5 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.172 0.804 . . . . 3.4900000000000002 113.172 -175.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -54.88 -37.79 66.73 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 121.552 -0.718 . . . . 3.7799999999999998 112.167 164.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 12.6 mt -74.63 -43.7 54.13 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.159 -0.928 . . . . 2.21 111.175 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.0 mm -60.22 -39.04 79.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 118.408 -0.806 . . . . 2.6800000000000002 111.384 -175.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -72.32 -37.58 68.88 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.889 0.876 . . . . 2.8500000000000001 113.297 176.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -62.82 -34.9 78.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.902 1.281 . . . . 4.2199999999999998 112.552 171.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.1 tp -82.27 -36.64 26.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.259 1.424 . . . . 3.6600000000000001 111.454 178.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.452 ' HA ' ' HZ1' ' A' ' 35' ' ' LYS . 29.4 t70 -43.71 -57.13 3.37 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.8 2.04 . . . . 4.4199999999999999 113.024 -169.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.42 -16.34 3.56 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.702 2.001 . . . . 3.4100000000000001 114.844 -177.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -110.89 -1.62 16.4 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.918 1.287 . . . . 2.54 113.059 -173.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 30.6 m80 -138.06 101.21 4.36 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.024 -1.047 . . . . 4.1900000000000004 112.755 -166.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.13 27.4 0.14 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.942 2.097 . . . . 4.6600000000000001 114.349 -171.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.77 32.8 58.72 Favored Glycine 0 CA--C 1.533 1.161 0 O-C-N 120.112 -1.618 . . . . 2.8799999999999999 110.643 -150.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.8 mmt-85 -95.34 159.17 15.13 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.051 1.34 . . . . 6.96 108.615 162.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.4 mm -145.26 140.66 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 126.454 1.902 . . . . 3.21 107.895 -173.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 t -116.97 173.47 6.63 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.671 0.748 . . . . 2.54 112.15 166.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -78.19 -47.47 17.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.355 1.062 . . . . 3.6499999999999999 111.988 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -73.3 -23.86 60.33 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.092 2.157 . . . . 2.77 113.372 -178.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -48.07 -61.19 2.1 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.807 2.043 . . . . 3.27 111.075 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.423 ' CE2' ' HB2' ' A' ' 19' ' ' PHE . 6.8 t80 -54.98 -49.29 71.81 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.312 -0.868 . . . . 3.04 111.485 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 19.6 t-105 -61.0 -48.18 83.01 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.239 0.615 . . . . 1.1000000000000001 111.881 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.5 t -73.28 -25.15 60.56 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.752 -1.118 . . . . 2.75 112.647 -178.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.7 mt -69.45 -36.11 76.3 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.562 1.073 . . . . 2.1200000000000001 112.274 170.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 21.4 mm -48.23 -44.11 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 CA-C-N 120.336 1.425 . . . . 2.0299999999999998 111.408 177.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.45 -15.1 44.72 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 124.159 0.885 . . . . 0.81000000000000005 114.998 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.86 -19.81 60.71 Favored Glycine 0 CA--C 1.533 1.161 0 CA-C-N 118.741 1.27 . . . . 0.81999999999999995 114.077 172.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.0 mp -99.13 -52.49 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-N 119.139 1.47 . . . . 2.0499999999999998 109.24 170.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.1 m -73.91 59.23 0.69 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 128.225 2.61 . . . . 2.3799999999999999 108.387 167.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -146.11 -69.63 0.01 OUTLIER Glycine 0 CA--C 1.525 0.692 0 C-N-CA 126.711 2.1 . . . . 1.26 109.299 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -58.0 -50.88 9.0 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.273 2.649 . . . . 1.6699999999999999 112.742 173.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.9 pp -90.8 -11.82 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 113.827 1.047 . . . . 2.2400000000000002 113.827 -175.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.58 -29.99 70.66 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 120.842 -1.161 . . . . 2.7200000000000002 113.448 -174.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -37.74 67.42 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.036 -1.04 . . . . 4.5800000000000001 113.792 168.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.6 tt -56.58 -40.35 75.09 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.829 1.252 . . . . 2.9300000000000002 110.807 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 57.0 mt -47.92 -62.8 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.059 1.344 . . . . 2.7400000000000002 110.1 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -73.24 -24.82 60.52 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.966 -1.084 . . . . 1.8300000000000001 112.794 -174.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -67.65 -27.89 67.24 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-O 118.489 -0.767 . . . . 3.6400000000000001 110.136 168.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -90.27 -38.59 13.31 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.328 1.851 . . . . 2.3199999999999998 115.745 178.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -61.37 -2.66 0.74 Allowed 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 121.47 1.941 . . . . 2.2000000000000002 112.054 167.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 N--CA 1.451 -0.392 0 C-N-CA 126.129 1.771 . . . . 2.0899999999999999 111.838 165.53 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.525 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 85.8 m-85 . . . . . 0 N--CA 1.475 0.802 0 N-CA-C 110.168 -0.308 . . . . 4.0899999999999999 110.168 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 81.3 p -64.14 156.8 27.32 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 121.372 -0.83 . . . . 2.2400000000000002 110.373 171.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -60.38 -19.52 56.08 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.219 0.463 . . . . 2.71 111.49 171.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -44.9 66.07 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.599 1.56 . . . . 2.3599999999999999 111.369 172.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.37 -44.57 62.38 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 117.69 -1.147 . . . . 2.9399999999999999 111.634 173.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -43.83 -48.05 8.23 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.621 1.555 . . . . 5.3899999999999997 111.088 165.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.21 -53.36 38.18 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 118.045 -0.978 . . . . 1.76 113.606 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 42.6 t -52.84 -46.61 52.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 CA-C-N 119.707 1.14 . . . . 2.2000000000000002 111.131 174.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 93.8 mt -53.16 -52.35 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.846 1.258 . . . . 2.4700000000000002 110.926 170.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 21.8 t -67.62 -37.96 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-N 119.97 1.259 . . . . 1.75 112.543 -175.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -61.78 -41.86 98.26 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.062 0.945 . . . . 2.0699999999999998 111.055 175.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 72.9 t -75.07 -40.44 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.886 1.274 . . . . 1.76 112.302 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -51.93 -56.42 14.24 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.724 1.21 . . . . 3.0800000000000001 110.086 170.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -69.78 -15.08 63.06 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.811 1.041 . . . . 3.0099999999999998 113.811 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -83.79 -60.85 1.99 Allowed 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.406 -0.809 . . . . 3.3999999999999999 113.103 172.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -58.34 -32.9 68.96 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.66 -0.65 . . . . 3.79 112.16 -174.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -41.24 -44.54 2.67 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.102 1.761 . . . . 4.0199999999999996 114.293 169.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -89.16 -29.52 19.26 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.46 0.704 . . . . 3.4199999999999999 112.282 -176.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 56.1 t . . . . . 0 N--CA 1.474 0.763 0 C-N-CA 126.217 1.807 . . . . 3.48 111.991 176.765 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.7 tt . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 107.544 -1.28 . . . . 4.0199999999999996 107.544 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 6.2 m -161.79 162.82 29.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 124.354 1.062 . . . . 4.6799999999999997 110.273 173.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . 0.463 ' HZ1' ' HA ' ' B' ' 170' ' ' ASP . 30.3 pttt -50.98 -11.06 0.08 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 128.301 2.64 . . . . 3.6200000000000001 117.066 -179.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.0 m -80.99 -27.9 35.73 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 119.706 -1.872 . . . . 2.5699999999999998 114.418 166.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 26.8 m -76.86 -46.4 24.81 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.572 -1.33 . . . . 1.3899999999999999 112.058 -169.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -51.23 -50.16 59.68 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.513 1.125 . . . . 3.8300000000000001 112.438 175.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -65.01 -12.28 48.57 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.979 1.103 . . . . 4.3600000000000003 113.979 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -98.37 -43.67 6.83 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 120.171 1.351 . . . . 2.48 111.225 170.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 63.2 ttp -54.04 -41.85 68.54 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.279 1.831 . . . . 2.9100000000000001 112.479 177.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 11.7 mt -59.86 -29.3 68.2 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.913 -1.117 . . . . 2.6499999999999999 113.625 172.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -80.48 -9.82 59.76 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.901 1.281 . . . . 2.6099999999999999 112.885 176.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.99 -64.72 1.01 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.551 1.14 . . . . 2.46 111.366 167.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -75.85 -13.71 60.28 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.557 -1.339 . . . . 3.1899999999999999 114.279 -172.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.2 18.13 9.12 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.104 1.362 . . . . 2.5299999999999998 112.748 177.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -53.75 -28.45 34.58 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 115.365 1.617 . . . . 1.26 115.365 -171.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -66.98 -25.89 66.54 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 114.128 1.159 . . . . 2.3199999999999998 114.128 -169.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 68.1 mtm -105.14 11.59 32.99 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.407 1.083 . . . . 3.8700000000000001 112.598 171.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . 0.437 HD23 ' H ' ' B' ' 154' ' ' SER . 0.2 OUTLIER -99.21 -163.76 1.07 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.448 1.899 . . . . 2.9199999999999999 110.398 -178.701 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 154' ' ' SER . . . . . 0.437 ' H ' HD23 ' B' ' 153' ' ' LEU . 5.3 t 70.53 -23.16 0.17 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.235 1.814 . . . . 7.0899999999999999 113.988 -177.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -65.54 16.67 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 128.309 2.644 . . . . 7.0099999999999998 114.638 177.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 156' ' ' THR . . . . . 0.402 ' H ' ' C ' ' B' ' 154' ' ' SER . 98.8 m 62.41 -65.83 0.09 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 128.853 2.861 . . . . 5.0899999999999999 113.548 -179.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -54.01 -40.52 66.15 Favored Glycine 0 N--CA 1.468 0.825 0 C-N-CA 125.543 1.544 . . . . 2.8500000000000001 112.692 -172.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -43.74 -67.5 0.27 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.77 1.628 . . . . 4.6399999999999997 112.232 168.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 25.0 ttt-85 -73.79 -29.58 62.26 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.105 -0.997 . . . . 6.04 112.528 -173.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -61.19 -42.42 98.55 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.574 -1.328 . . . . 4.0 112.137 171.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.12 -37.61 74.91 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.55 0.944 . . . . 1.96 113.55 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -58.02 -47.18 83.84 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.851 1.26 . . . . 1.8799999999999999 112.856 173.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.06 -23.59 60.58 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.438 -0.789 . . . . 3.3999999999999999 112.906 -173.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -54.5 -36.64 64.4 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.683 -0.635 . . . . 3.8300000000000001 112.058 164.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 7.4 mt -73.76 -46.04 48.11 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.523 -0.762 . . . . 2.0099999999999998 110.712 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 7.1 mm -60.31 -42.73 91.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.691 0.678 . . . . 2.5699999999999998 112.002 -175.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -68.65 -36.46 78.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.486 1.114 . . . . 2.6800000000000002 113.223 177.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -70.24 -37.62 75.01 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.06 1.344 . . . . 3.5299999999999998 111.57 174.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 10.5 tp -74.48 -32.74 62.65 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.62 1.168 . . . . 3.5699999999999998 111.506 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . 0.463 ' HA ' ' HZ1' ' B' ' 138' ' ' LYS . 38.4 t70 -46.4 -54.58 8.83 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 125.822 1.649 . . . . 4.0300000000000002 112.808 -172.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -61.53 -4.95 1.52 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.337 1.855 . . . . 3.3900000000000001 115.771 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -121.35 -2.76 9.49 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.526 1.13 . . . . 2.52 113.423 -176.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 66.7 m80 -137.15 89.61 2.45 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.889 -1.132 . . . . 4.54 111.978 -167.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.78 29.32 0.09 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.581 2.752 . . . . 4.75 114.564 -167.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.35 32.23 58.22 Favored Glycine 0 CA--C 1.534 1.24 0 O-C-N 120.268 -1.52 . . . . 2.5699999999999998 110.557 -149.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 47.1 mmt-85 -103.23 151.32 22.79 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.231 1.812 . . . . 6.9299999999999997 107.388 161.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 33.2 mm -144.49 140.78 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 127.281 2.232 . . . . 3.0099999999999998 106.713 -172.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.1 t -119.81 171.3 8.51 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.754 0.788 . . . . 2.6200000000000001 112.559 171.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -77.99 -46.46 21.0 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.062 0.945 . . . . 3.77 112.327 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -71.2 -23.6 62.06 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.473 1.909 . . . . 2.7799999999999998 113.213 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -48.51 -60.5 2.64 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 127.083 2.153 . . . . 3.1800000000000002 111.061 175.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -57.17 -46.21 83.01 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.299 -0.876 . . . . 3.1000000000000001 111.602 -179.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -61.86 -46.19 90.52 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.366 0.666 . . . . 1.1000000000000001 112.395 -178.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 6.5 t -69.05 -36.75 78.04 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.803 0.729 . . . . 2.8999999999999999 111.299 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 81.6 mt -61.18 -37.22 82.15 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.458 1.026 . . . . 1.8600000000000001 113.288 174.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 15.3 mm -49.51 -44.85 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 120.049 1.295 . . . . 2.1800000000000002 110.795 176.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -64.67 -13.13 55.23 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.607 1.098 . . . . 0.69999999999999996 114.601 -177.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -83.41 -20.64 59.95 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-N 118.7 1.25 . . . . 0.79000000000000004 113.906 170.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 5.1 mp -96.06 -55.56 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 119.429 1.615 . . . . 2.2200000000000002 108.797 171.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 27.6 m -73.11 59.17 0.52 Allowed 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 128.638 2.775 . . . . 2.4399999999999999 108.555 169.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -142.84 -72.11 0.03 OUTLIER Glycine 0 CA--C 1.525 0.717 0 C-N-CA 126.882 2.182 . . . . 1.27 108.458 175.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -58.94 -51.27 7.17 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.208 2.605 . . . . 1.5900000000000001 113.169 174.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.0 pp -87.18 -10.77 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.5 1.046 . . . . 2.2799999999999998 113.087 -175.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.06 -31.04 70.41 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 120.975 -1.078 . . . . 2.6499999999999999 113.054 -173.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -36.75 69.72 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 117.815 -1.088 . . . . 4.3600000000000003 113.048 172.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.7 tt -55.98 -40.15 72.86 Favored 'General case' 0 C--O 1.217 -0.605 0 C-N-CA 124.342 1.057 . . . . 3.23 110.671 -177.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 88.2 mt -48.4 -61.71 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.63 1.172 . . . . 2.5099999999999998 110.869 171.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -65.54 -34.97 79.5 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 121.595 -0.691 . . . . 1.8300000000000001 111.729 -176.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -68.49 -21.3 64.62 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 118.728 -0.653 . . . . 3.5499999999999998 110.769 176.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -91.85 -38.77 12.13 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.063 1.745 . . . . 2.2799999999999998 114.751 173.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -59.98 -6.69 1.41 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 121.229 1.831 . . . . 2.3999999999999999 112.208 164.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -104.65 -93.32 0.35 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.453 1.501 . . . . 2.1899999999999999 112.105 162.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.142 0 C-N-CA 128.424 2.689 . . . . 4.8300000000000001 113.934 -172.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.5 m-30 . . . . . 0 N--CA 1.482 1.162 0 N-CA-C 111.747 0.277 . . . . 3.3199999999999998 111.747 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.8 p -73.68 159.19 33.38 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.807 0.843 . . . . 1.7 110.351 169.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -64.95 -20.52 66.51 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.702 -0.624 . . . . 2.54 111.661 170.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.89 -45.76 77.02 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 118.749 -0.643 . . . . 1.9199999999999999 109.926 173.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.16 -49.68 66.56 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 117.331 -1.318 . . . . 3.4700000000000002 112.187 172.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -41.6 -48.46 4.03 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 121.045 1.748 . . . . 5.9000000000000004 112.273 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.71 -47.31 48.15 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-O 117.306 -1.33 . . . . 1.71 112.727 -177.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.64 -40.42 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 CA-C-N 121.14 1.791 . . . . 1.79 110.619 173.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 88.4 mt -54.17 -58.46 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.207 1.003 . . . . 2.1099999999999999 110.696 168.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.9 t -61.58 -35.15 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 125.542 1.537 . . . . 1.8799999999999999 112.964 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -69.71 -39.17 77.03 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.85 0.86 . . . . 1.8799999999999999 110.515 175.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 68.6 t -75.56 -34.41 29.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.024 0.929 . . . . 1.98 111.339 178.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -61.64 -45.5 93.76 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 124.916 1.286 . . . . 3.0499999999999998 111.262 168.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -58.56 -23.54 58.71 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.612 0.967 . . . . 2.2599999999999998 113.612 174.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -82.98 -60.87 2.02 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.822 -1.174 . . . . 3.5600000000000001 112.489 170.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -69.07 -13.74 62.61 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.761 1.023 . . . . 3.23 113.761 -174.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.5 mttp -31.83 -48.24 0.15 Allowed 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 127.872 2.469 . . . . 3.0699999999999998 112.851 162.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -98.38 6.22 47.48 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.543 1.137 . . . . 3.6600000000000001 112.664 -171.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.2 t . . . . . 0 N--CA 1.477 0.918 0 C-N-CA 124.552 1.141 . . . . 4.2400000000000002 110.189 -170.066 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 42.6 pt . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 110.109 -0.33 . . . . 3.2599999999999998 110.109 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.5 m -66.14 140.66 58.23 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.561 -1.337 . . . . 3.1600000000000001 111.549 178.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -61.95 -17.74 57.95 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.342 1.238 . . . . 4.0300000000000002 114.342 -169.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.0 p -54.37 -33.34 58.96 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.802 -1.186 . . . . 2.77 112.231 168.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.1 m -60.05 -25.59 65.47 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.644 -1.285 . . . . 2.52 113.737 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -65.5 -62.51 1.48 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.308 1.413 . . . . 3.3199999999999998 111.441 175.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -58.26 -21.92 50.41 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.202 1.001 . . . . 2.8300000000000001 112.653 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.405 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 25.5 mt-10 -93.23 -44.74 8.18 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 124.662 1.185 . . . . 3.8399999999999999 113.459 -174.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -32.1 68.04 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.593 1.088 . . . . 1.8899999999999999 111.137 163.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.6 mt -66.24 -19.23 65.76 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 115.576 1.695 . . . . 2.04 115.576 169.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.41 -24.4 13.48 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.963 1.256 . . . . 3.1299999999999999 113.475 171.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 1.6 mppt? -86.07 -48.2 8.85 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.78 1.232 . . . . 3.7000000000000002 110.639 -178.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -86.77 -36.97 18.28 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.235 1.014 . . . . 2.9300000000000002 112.238 -178.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.3 mt -103.75 50.04 0.81 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.035 0.934 . . . . 3.8399999999999999 111.883 173.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -68.17 36.3 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 125.575 1.55 . . . . 2.1000000000000001 113.61 175.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -136.42 -96.03 0.23 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.577 1.951 . . . . 2.23 110.745 -159.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.1 ptp -56.57 -20.23 19.77 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.638 1.563 . . . . 2.73 114.436 174.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.2 mp -80.65 64.23 5.36 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 123.801 1.762 . . . . 4.79 110.25 162.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.1 m -79.83 -10.74 59.82 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 113.036 -1.893 . . . . 4.3200000000000003 114.425 -158.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -151.96 164.77 36.47 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.659 1.584 . . . . 4.5999999999999996 109.639 160.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.5 m -34.47 -44.15 0.19 Allowed 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 129.443 3.097 . . . . 3.3199999999999998 112.805 160.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.34 -32.09 79.62 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 117.653 -1.637 . . . . 2.6099999999999999 114.39 -179.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -78.6 -47.67 16.67 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.214 1.507 . . . . 2.9100000000000001 109.679 170.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -48.73 -29.62 4.68 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.421 1.889 . . . . 6.3499999999999996 115.571 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.7 mtmt -48.36 -34.42 10.68 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.933 -1.104 . . . . 5.8300000000000001 113.838 168.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.59 -16.49 63.41 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.54 1.311 . . . . 1.96 114.54 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.07 -49.01 8.64 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.719 0.808 . . . . 1.78 111.67 168.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.0 -31.5 72.43 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 112.916 0.709 . . . . 2.4399999999999999 112.916 -179.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -57.31 -28.84 63.42 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.105 -0.997 . . . . 3.4100000000000001 112.703 174.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 45.9 mt -78.32 -30.52 48.31 Favored 'General case' 0 C--O 1.224 -0.238 0 O-C-N 121.637 -0.664 . . . . 1.8899999999999999 111.404 -178.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.5 mm -66.25 -49.02 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 123.94 0.896 . . . . 1.8500000000000001 110.13 -178.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.57 -37.22 85.32 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.94 1.296 . . . . 4.0 113.061 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -65.88 -25.05 67.0 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.382 1.473 . . . . 3.3700000000000001 113.979 171.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -87.94 -80.06 0.28 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 117.715 -1.136 . . . . 3.29 109.842 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -50.64 -34.7 27.24 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.437 1.471 . . . . 3.5899999999999999 114.771 -158.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -54.37 -18.86 4.57 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 115.249 1.574 . . . . 4.5099999999999998 115.249 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -132.48 5.48 4.04 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.541 1.936 . . . . 5.2699999999999996 113.866 168.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -141.4 9.79 2.06 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 116.144 1.905 . . . . 5.6100000000000003 116.144 -164.325 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -51.76 145.34 9.65 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.504 1.521 . . . . 7.1799999999999997 112.869 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 71.47 -22.91 0.64 Allowed Glycine 0 CA--C 1.535 1.334 0 C-N-CA 126.333 1.92 . . . . 3.0299999999999998 114.795 -173.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -94.39 135.11 36.17 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.294 1.437 . . . . 6.21 110.893 -178.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.2 mm -147.07 111.98 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.975 1.71 . . . . 3.2799999999999998 107.446 177.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.4 m -85.3 -158.87 0.4 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.302 1.441 . . . . 2.5499999999999998 111.334 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -109.03 -57.18 2.19 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 119.685 -1.884 . . . . 3.3399999999999999 109.988 170.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -52.32 -25.77 10.47 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 131.407 3.883 . . . . 3.0800000000000001 114.269 170.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -51.21 -59.21 4.44 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.422 1.489 . . . . 3.04 111.444 170.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -51.04 -44.71 61.11 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.6 -0.688 . . . . 3.9500000000000002 111.623 176.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 28.4 t-105 -64.52 -46.8 81.36 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.485 -0.769 . . . . 0.65000000000000002 111.996 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.9 t -74.47 -22.88 58.87 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 117.683 -1.151 . . . . 2.79 113.407 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.5 mt -65.68 -44.83 85.01 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.931 1.241 . . . . 1.76 110.331 169.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 27.4 mm -48.96 -43.87 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 CA-C-N 119.94 1.245 . . . . 1.8400000000000001 112.667 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.77 -19.51 43.55 Favored Glycine 0 CA--C 1.537 1.449 0 CA-C-N 119.468 1.031 . . . . 0.68000000000000005 114.07 177.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.11 -19.19 71.79 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 118.885 1.342 . . . . 0.64000000000000001 114.188 172.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -118.41 -43.1 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 CA-C-N 119.117 1.459 . . . . 1.96 110.325 175.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 17.6 m -77.26 52.67 0.94 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.223 1.809 . . . . 2.0299999999999998 109.749 166.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.68 -64.39 0.03 OUTLIER Glycine 0 CA--C 1.528 0.862 0 C-N-CA 126.955 2.216 . . . . 1.1299999999999999 109.912 179.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -63.28 -59.15 0.24 Allowed 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.204 2.603 . . . . 1.3200000000000001 112.624 173.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.1 pt -78.04 -17.55 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 114.028 1.121 . . . . 2.1899999999999999 114.028 -173.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.55 -37.46 75.74 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.308 -0.87 . . . . 2.1800000000000002 112.505 -173.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt -60.91 -29.42 69.58 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 120.639 -1.288 . . . . 6.1100000000000003 113.238 176.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.8 tt -77.85 -23.05 49.04 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.444 1.498 . . . . 2.9500000000000002 112.963 178.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.3 mt -51.75 -48.64 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 118.955 0.798 . . . . 2.0299999999999998 110.466 168.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.41 -33.86 73.1 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 114.194 1.183 . . . . 4.04 114.194 -179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.83 -55.65 24.37 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.328 1.051 . . . . 5.6799999999999997 111.71 172.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -56.56 -46.05 80.95 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.865 0.866 . . . . 2.6400000000000001 113.299 -175.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -80.29 2.41 24.73 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.677 0.791 . . . . 2.9100000000000001 111.797 -175.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.473 0.715 0 C-N-CA 123.734 0.813 . . . . 2.1699999999999999 111.041 162.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 112.695 0.628 . . . . 3.4300000000000002 112.695 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 66.1 p -71.66 150.57 44.45 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.312 0.645 . . . . 1.98 110.006 164.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -53.47 -36.9 62.15 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.312 1.045 . . . . 2.3399999999999999 111.097 175.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.61 -42.88 93.64 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.719 1.608 . . . . 1.9199999999999999 111.726 178.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -51.47 24.93 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 121.401 -0.812 . . . . 3.3500000000000001 110.323 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -55.14 -30.36 59.64 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.423 1.089 . . . . 5.8099999999999996 112.125 172.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.65 -44.26 62.1 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.563 -1.335 . . . . 1.77 113.221 170.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 54.0 t -59.18 -39.33 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 120.877 1.671 . . . . 1.79 109.834 172.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 63.1 mt -54.77 -57.79 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.853 -1.07 . . . . 1.8200000000000001 110.824 167.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 5.6 t -56.55 -39.35 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 CA-C-N 120.502 1.501 . . . . 1.8500000000000001 113.035 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.67 -40.42 84.46 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.359 -0.838 . . . . 1.9099999999999999 111.953 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 68.7 t -72.74 -34.51 47.35 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.635 0 C-N-CA 123.51 0.724 . . . . 1.95 110.987 177.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -65.22 -41.82 94.04 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.523 1.129 . . . . 3.0600000000000001 112.281 172.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . 0.422 HD22 ' CG ' ' B' ' 144' ' ' MET . 40.0 t30 -58.67 -24.03 60.48 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.961 -1.087 . . . . 2.21 113.603 173.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -84.67 -61.12 1.87 Allowed 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.13 -0.981 . . . . 3.4900000000000002 112.674 172.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -68.1 -14.67 63.15 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.44 0.904 . . . . 3.29 113.44 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mttp -32.61 -48.14 0.18 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 127.156 2.182 . . . . 3.1400000000000001 113.349 164.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -97.64 6.78 47.53 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.371 1.468 . . . . 3.5 113.235 -172.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 45.9 t . . . . . 0 N--CA 1.474 0.755 0 C-N-CA 124.238 1.015 . . . . 4.1699999999999999 109.982 -171.549 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 31.6 pt . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 109.375 -0.602 . . . . 3.2799999999999998 109.375 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 15.2 m -64.47 140.76 58.9 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.171 -0.956 . . . . 3.0699999999999998 112.212 178.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -60.71 -16.73 42.73 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.606 1.335 . . . . 3.8500000000000001 114.606 -169.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 14.3 p -56.76 -33.95 67.11 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.583 -1.323 . . . . 2.5899999999999999 112.48 168.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 63.9 m -57.93 -28.47 64.31 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.862 -1.149 . . . . 2.29 113.293 174.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . 0.404 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 73.8 t80 -62.14 -63.15 1.34 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.295 1.407 . . . . 3.21 111.735 175.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -60.1 -20.8 60.02 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.585 0.754 . . . . 2.6400000000000001 112.02 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . 0.424 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 26.7 mt-10 -90.24 -50.26 6.08 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 117.8 -1.095 . . . . 3.6200000000000001 112.482 -175.193 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 144' ' ' MET . . . . . 0.422 ' CG ' HD22 ' B' ' 121' ' ' ASN . 0.0 OUTLIER -55.06 -32.07 61.63 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.092 0.86 . . . . 1.8999999999999999 111.54 164.248 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 10.0 mt -61.05 -52.26 65.69 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.247 -0.908 . . . . 1.96 112.039 168.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.03 -18.95 60.78 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.643 1.11 . . . . 3.1200000000000001 113.242 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 2.0 mppt? -92.02 -48.66 6.63 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.972 1.309 . . . . 3.6200000000000001 111.232 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -93.57 -28.39 16.07 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.518 1.508 . . . . 2.9900000000000002 114.901 -175.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 60.0 mt -104.79 25.07 10.85 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.66 1.184 . . . . 2.9700000000000002 112.201 172.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -54.51 -10.4 0.41 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.84 2.056 . . . . 1.46 116.319 -173.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.64 -64.39 1.15 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.99 -1.069 . . . . 2.5800000000000001 110.509 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.7 ptp -59.26 -33.17 70.72 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.063 0.847 . . . . 3.0 113.005 170.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 2.3 mp -86.79 67.78 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 123.445 1.593 . . . . 5.1100000000000003 110.212 170.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 3.3 m -74.06 -11.16 60.24 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 112.873 -1.967 . . . . 4.1399999999999997 114.978 -157.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -175.72 164.99 3.05 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.298 2.239 . . . . 5.4299999999999997 110.301 178.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 9.3 m -29.15 -48.99 0.07 Allowed 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 130.167 3.387 . . . . 3.8100000000000001 113.861 160.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -63.75 -32.96 85.92 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-N 119.857 1.208 . . . . 3.0 113.863 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -77.44 -49.16 15.39 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.757 1.223 . . . . 2.77 109.202 170.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 17.4 ttp180 -50.08 -29.36 8.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.078 1.751 . . . . 5.8200000000000003 114.78 179.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 32.9 mtmt -49.83 -30.68 10.25 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.34 1.427 . . . . 5.6699999999999999 114.308 170.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.68 -20.86 52.97 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.363 1.246 . . . . 1.98 114.363 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -77.49 -52.5 8.97 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.151 0.887 . . . . 1.79 110.675 162.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -61.98 -34.26 75.81 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.387 0.675 . . . . 2.0099999999999998 112.759 -175.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.35 -30.27 64.69 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.396 -0.815 . . . . 3.6600000000000001 112.958 174.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 38.4 mt -74.8 -34.25 62.36 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.649 -0.657 . . . . 1.8200000000000001 111.244 -178.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 28.7 mm -61.84 -48.73 87.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.247 1.019 . . . . 1.8 110.479 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -64.91 -40.93 95.83 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.773 1.229 . . . . 4.0599999999999996 112.32 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -61.0 -26.11 67.37 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.053 1.341 . . . . 3.4300000000000002 113.838 171.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -83.58 -80.13 0.19 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 117.368 -1.301 . . . . 3.4199999999999999 109.465 169.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -50.08 -33.08 17.33 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 120.513 1.506 . . . . 3.46 114.602 -160.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -53.51 -21.01 5.57 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 115.274 1.583 . . . . 4.1299999999999999 115.274 173.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -128.83 9.71 5.89 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.033 1.733 . . . . 4.96 113.494 168.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.8 6.3 0.91 Allowed 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 116.397 1.999 . . . . 5.0700000000000003 116.397 -159.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -50.96 144.42 8.72 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 122.226 1.012 . . . . 7.0800000000000001 112.7 172.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 71.56 -20.44 0.8 Allowed Glycine 0 CA--C 1.535 1.313 0 C-N-CA 126.211 1.862 . . . . 2.9900000000000002 114.925 -173.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -99.79 135.11 41.7 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.418 1.487 . . . . 6.0800000000000001 110.422 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.3 mm -145.22 113.71 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 107.023 -1.473 . . . . 3.7000000000000002 107.023 177.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 2.4 t -87.19 -173.14 4.27 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.678 1.126 . . . . 2.04 113.14 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -92.89 -56.62 2.93 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.031 -1.668 . . . . 3.3199999999999998 110.769 172.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -61.33 -23.55 65.81 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 129.048 2.939 . . . . 3.02 113.138 176.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -47.62 -58.92 3.68 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.492 1.517 . . . . 3.1499999999999999 110.856 167.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -51.99 -45.52 64.53 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 120.931 -1.106 . . . . 3.7999999999999998 112.372 177.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.3 t-105 -65.82 -47.37 75.25 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.65 -0.69 . . . . 0.65000000000000002 111.875 -178.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 8.2 t -72.7 -24.1 60.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 117.684 -1.15 . . . . 2.75 112.975 177.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . 0.404 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 82.5 mt -65.82 -45.24 83.02 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.882 1.219 . . . . 1.6599999999999999 110.815 170.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 34.9 mm -48.03 -43.42 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 CA-C-N 120.734 1.606 . . . . 1.8600000000000001 112.51 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -58.59 -19.57 42.55 Favored Glycine 0 CA--C 1.538 1.476 0 CA-C-N 118.57 0.623 . . . . 0.72999999999999998 114.497 177.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.74 -19.36 79.24 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 118.619 1.209 . . . . 0.77000000000000002 114.147 174.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -117.1 -47.79 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 118.829 1.314 . . . . 2.2999999999999998 110.108 177.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 20.7 m -74.23 50.68 0.4 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.679 1.991 . . . . 2.0899999999999999 109.573 166.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -138.97 -64.48 0.04 OUTLIER Glycine 0 CA--C 1.527 0.815 0 C-N-CA 127.022 2.249 . . . . 1.1000000000000001 109.481 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -62.0 -54.44 1.5 Allowed 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.198 2.599 . . . . 1.3400000000000001 112.8 172.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 4.2 pt -84.78 -19.38 8.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 N-CA-C 114.672 1.36 . . . . 2.3100000000000001 114.672 -175.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -53.33 -43.0 67.31 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.963 0.905 . . . . 2.4199999999999999 112.498 -174.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -54.45 -27.93 40.77 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.167 1.173 . . . . 5.8600000000000003 114.167 175.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.22 -19.07 61.78 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.443 1.897 . . . . 2.4100000000000001 111.735 178.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 98.2 mt -57.68 -43.71 84.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 O-C-N 120.062 -1.649 . . . . 2.8500000000000001 110.561 166.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -74.89 -0.39 18.38 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 115.145 1.535 . . . . 4.3200000000000003 115.145 177.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -88.63 -66.09 0.95 Allowed 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.568 1.147 . . . . 4.9400000000000004 111.2 153.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -54.65 -44.94 73.69 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 114.301 1.223 . . . . 2.3799999999999999 114.301 -167.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -80.86 10.71 4.66 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 123.026 1.393 . . . . 2.73 111.006 -175.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -114.65 -54.07 2.6 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.432 1.493 . . . . 2.9700000000000002 109.885 166.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 . . . . . 0 CA--C 1.538 0.505 0 C-N-CA 127.153 2.181 . . . . 6.0599999999999996 113.887 178.427 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 114.517 1.303 . . . . 3.8900000000000001 114.517 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.5 p -66.4 147.84 52.72 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.187 0.595 . . . . 2.4100000000000001 109.915 164.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -67.12 -17.8 65.03 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 119.276 -0.392 . . . . 2.2799999999999998 111.712 170.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.6 -48.94 62.86 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.617 1.098 . . . . 2.02 110.062 173.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -51.39 66.99 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.421 -0.585 . . . . 3.3700000000000001 109.421 175.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -53.89 -37.1 63.39 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.764 0.653 . . . . 4.9900000000000002 112.764 176.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.58 -37.95 88.21 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 117.609 -1.186 . . . . 2.1000000000000001 112.896 172.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 16.8 t -58.52 -44.93 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-N 120.914 1.688 . . . . 2.1200000000000001 110.516 168.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.8 mt -54.69 -46.93 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 CA-C-N 118.765 0.711 . . . . 2.0299999999999998 110.663 172.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 42.0 t -69.09 -40.49 80.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 124.057 0.943 . . . . 1.8600000000000001 112.994 -176.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -62.74 -39.85 95.41 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.122 -0.986 . . . . 1.97 111.051 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 84.1 t -74.76 -38.14 43.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.72 0.808 . . . . 1.6399999999999999 112.582 177.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -51.12 -52.16 46.43 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.015 0.926 . . . . 3.1699999999999999 109.848 168.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -60.38 -30.66 69.72 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.486 1.291 . . . . 2.2400000000000002 114.486 -175.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -80.81 -54.16 5.85 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.225 -0.922 . . . . 3.0600000000000001 111.812 175.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -69.63 -23.44 63.5 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.734 1.013 . . . . 3.6200000000000001 113.734 -174.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 42.2 pttt -60.74 -9.25 3.73 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 115.712 1.745 . . . . 3.0499999999999998 115.712 175.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -107.03 2.28 24.94 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.877 1.271 . . . . 3.6200000000000001 114.264 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.485 1.289 0 CA-C-N 120.111 1.323 . . . . 3.6800000000000002 110.987 179.561 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.2 pt . . . . . 0 N--CA 1.477 0.875 0 N-CA-C 110.28 -0.267 . . . . 3.6200000000000001 110.28 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.0 m -92.97 152.15 19.5 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.624 -0.672 . . . . 3.3599999999999999 110.457 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.409 ' HZ1' ' C ' ' A' ' 66' ' ' LEU . 19.1 mtpt -52.48 -33.18 43.57 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.324 1.45 . . . . 3.54 114.768 -176.395 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.3 t -69.59 -23.35 63.52 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.545 1.313 . . . . 2.6299999999999999 114.545 172.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.1 m -77.19 -44.48 29.99 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.85 1.205 . . . . 1.5 111.385 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -51.49 -54.2 29.63 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.416 1.007 . . . . 3.1800000000000002 111.85 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -57.88 -27.03 62.9 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.91 1.078 . . . . 3.3999999999999999 113.91 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -94.98 -48.8 5.83 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.63 1.572 . . . . 2.8700000000000001 110.74 -171.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -49.5 -40.12 36.47 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.713 2.405 . . . . 1.8899999999999999 112.24 165.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.1 mt -60.25 -20.27 58.22 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.948 1.462 . . . . 1.98 114.948 176.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -92.82 -14.33 27.93 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.592 1.157 . . . . 2.5899999999999999 112.428 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.36 -53.54 3.89 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.553 1.141 . . . . 2.2999999999999998 112.599 172.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -78.34 -16.7 57.43 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.55 -0.719 . . . . 2.5299999999999998 112.287 -174.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.51 24.88 9.66 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.427 1.891 . . . . 2.8500000000000001 111.576 179.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -61.94 -39.09 90.87 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.405 2.002 . . . . 1.6200000000000001 116.405 -162.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.505 ' H ' ' CD2' ' A' ' 48' ' ' HIS . 0.5 OUTLIER -69.58 -19.8 63.66 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.975 1.262 . . . . 2.1400000000000001 113.228 -174.036 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 52.0 tpp -77.64 -26.55 50.57 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.233 1.813 . . . . 2.8100000000000001 113.016 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.0 mp -56.75 111.57 1.05 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.069 0.948 . . . . 3.46 110.399 174.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.2 m -100.73 -3.89 29.24 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.364 1.066 . . . . 3.7000000000000002 111.769 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -178.75 175.46 1.06 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 131.366 3.866 . . . . 3.8100000000000001 106.768 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -53.99 -26.08 24.21 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 117.021 -1.466 . . . . 4.7400000000000002 111.78 160.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -51.53 -39.96 46.23 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 127.344 2.402 . . . . 2.0699999999999998 115.0 -174.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -57.07 -47.63 80.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 117.951 0.875 . . . . 3.7200000000000002 110.78 170.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -70.98 -32.24 69.03 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.392 0.677 . . . . 6.2699999999999996 112.207 175.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -58.84 -38.01 77.73 Favored 'General case' 0 N--CA 1.481 1.078 0 O-C-N 119.516 -1.99 . . . . 4.21 111.334 173.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.77 -14.22 62.36 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.059 1.503 . . . . 2.1800000000000002 115.059 172.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.64 -53.83 5.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.389 0.995 . . . . 2.1800000000000002 110.82 164.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.47 -34.98 69.58 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.965 0.906 . . . . 2.0600000000000001 112.866 -177.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -61.34 -24.31 66.36 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.682 0.993 . . . . 3.5800000000000001 113.682 174.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.5 mt -78.63 -37.5 42.03 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.257 -0.902 . . . . 1.74 111.135 174.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.4 mm -58.19 -44.6 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.196 0.998 . . . . 1.96 111.558 -176.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -67.22 -38.8 85.87 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.234 1.813 . . . . 2.9500000000000002 113.173 176.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -62.56 -27.65 69.33 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.916 -0.49 . . . . 4.4900000000000002 111.972 172.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.409 ' C ' ' HZ1' ' A' ' 35' ' ' LYS . 7.4 mp -86.82 -19.89 28.33 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 113.565 0.95 . . . . 4.71 113.565 174.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.49 -25.21 67.89 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 120.419 1.463 . . . . 3.6200000000000001 111.507 168.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.2 -10.79 59.79 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.474 1.287 . . . . 3.1099999999999999 114.474 170.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -136.79 -14.08 1.65 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.805 1.78 . . . . 2.71 115.805 -171.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -155.45 119.02 4.45 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 121.195 1.816 . . . . 3.6800000000000002 114.036 -159.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.9 40.28 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 130.375 3.47 . . . . 4.4400000000000004 116.563 -170.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.18 13.4 76.51 Favored Glycine 0 CA--C 1.537 1.415 0 O-C-N 119.502 -1.999 . . . . 5.1299999999999999 114.283 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -86.38 -171.51 3.59 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.212 1.405 . . . . 8.0199999999999996 108.303 155.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 41.9 pt -147.94 161.6 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.966 1.706 . . . . 5.4800000000000004 107.911 150.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.8 m -74.08 169.1 18.2 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 112.745 0.646 . . . . 2.3700000000000001 112.745 164.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -63.1 -52.91 60.79 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.07 -1.019 . . . . 3.1200000000000001 111.069 169.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.6 -33.76 60.92 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 128.142 2.577 . . . . 3.0800000000000001 113.224 172.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.83 -38.99 76.7 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 118.44 -0.791 . . . . 4.1500000000000004 112.622 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -53.09 -47.31 68.67 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.655 1.571 . . . . 2.8300000000000001 110.393 172.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 28.5 t-105 -64.55 -45.86 85.29 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 118.455 -0.783 . . . . 0.69999999999999996 111.987 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.13 -40.64 98.19 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.549 1.068 . . . . 2.4900000000000002 112.039 -177.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 91.1 mt -63.88 -34.11 77.2 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.839 -0.6 . . . . 1.77 112.1 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.45 -36.21 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 119.896 1.225 . . . . 1.8300000000000001 111.6 179.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.48 -18.02 67.25 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.929 1.252 . . . . 0.66000000000000003 114.41 178.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.47 -29.58 59.66 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-N 119.007 1.404 . . . . 0.84999999999999998 112.737 176.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.8 mp -86.95 -45.14 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.264 1.026 . . . . 1.8500000000000001 109.537 168.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.4 m -82.55 57.28 3.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 127.546 2.338 . . . . 1.8799999999999999 109.989 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -132.74 -67.56 0.08 OUTLIER Glycine 0 CA--C 1.527 0.793 0 C-N-CA 125.825 1.678 . . . . 1.0700000000000001 110.093 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -66.02 -51.77 1.11 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.269 2.646 . . . . 1.1100000000000001 112.576 175.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.6 pt -71.84 -17.83 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 N-CA-C 113.95 1.093 . . . . 2.0800000000000001 113.95 -175.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -50.36 -55.73 14.38 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.763 0.825 . . . . 1.74 111.994 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -61.84 -32.69 73.04 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 120.569 -1.332 . . . . 3.9300000000000002 113.168 176.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.0 tt -60.39 -40.79 92.17 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 121.146 1.794 . . . . 2.4100000000000001 111.024 178.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 74.7 mt -53.84 -54.46 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-O 122.156 0.979 . . . . 2.1299999999999999 110.429 172.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -67.76 -28.38 67.57 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.228 -0.92 . . . . 1.72 113.279 -177.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -73.88 -29.2 61.96 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.597 1.159 . . . . 3.6200000000000001 111.356 173.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.525 ' C ' ' H ' ' A' ' 99' ' ' GLN . 12.8 mm100 -74.16 -42.5 59.81 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.288 1.035 . . . . 2.1299999999999999 111.538 174.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -73.47 17.28 0.15 Allowed 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 123.736 1.731 . . . . 2.96 112.211 172.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.525 ' H ' ' C ' ' A' ' 97' ' ' GLN . 2.6 mm-40 . . . . . 0 CA--C 1.536 0.423 0 C-N-CA 125.522 1.529 . . . . 2.6000000000000001 110.398 161.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 118.983 -0.532 . . . . 4.21 112.36 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 8.3 p -62.68 152.3 35.84 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.223 -0.658 . . . . 2.1400000000000001 109.223 173.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -63.85 -27.54 69.24 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 118.415 -0.802 . . . . 2.52 111.489 170.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.56 -46.46 85.8 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.759 1.618 . . . . 1.96 109.83 176.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -50.15 32.2 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.597 -0.69 . . . . 2.9300000000000002 111.142 -177.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -48.74 -38.66 22.27 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.804 1.241 . . . . 5.7800000000000002 113.255 167.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.98 -42.9 94.14 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 120.783 -1.198 . . . . 1.9299999999999999 113.233 171.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 14.0 t -55.74 -42.58 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 CA-C-N 120.917 1.689 . . . . 2.23 110.666 170.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 59.9 mt -56.4 -51.22 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 118.638 -0.696 . . . . 2.21 110.189 172.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 36.1 t -65.79 -36.6 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.346 0.975 . . . . 1.77 113.342 -176.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -64.26 -37.97 89.37 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.997 -1.064 . . . . 1.99 111.44 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 89.3 t -83.21 -35.32 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 118.619 -0.705 . . . . 1.6100000000000001 112.396 -178.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -51.16 -54.98 20.33 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.511 1.125 . . . . 3.3300000000000001 109.634 165.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -57.78 -37.56 73.92 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 113.207 0.817 . . . . 2.3300000000000001 113.207 -176.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -76.59 -55.87 5.13 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 122.02 -0.425 . . . . 3.6400000000000001 110.785 -177.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -68.15 -24.05 64.94 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.675 0.991 . . . . 3.6600000000000001 113.675 -175.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -56.81 -16.21 6.17 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 120.979 1.718 . . . . 2.8700000000000001 115.137 176.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -90.69 -0.7 57.78 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.824 1.787 . . . . 3.3199999999999998 115.824 173.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.6 m . . . . . 0 N--CA 1.479 1.003 0 C-N-CA 125.075 1.35 . . . . 3.5299999999999998 109.787 176.988 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 28.5 pt . . . . . 0 N--CA 1.479 0.991 0 CA-C-O 120.572 0.225 . . . . 3.25 111.092 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 20.6 m -91.26 155.14 18.77 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 120.396 -1.44 . . . . 2.9399999999999999 110.737 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -55.48 -30.75 61.16 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.016 0.926 . . . . 3.6200000000000001 113.118 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 39.3 t -69.18 -20.4 64.0 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 115.31 1.596 . . . . 2.7799999999999998 115.31 170.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 16.4 m -74.49 -41.46 60.67 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 120.638 1.563 . . . . 1.54 111.444 176.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -56.35 -53.46 57.08 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 118.906 0.776 . . . . 3.46 111.29 -178.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.4 ptt180 -57.12 -23.62 48.41 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.109 0.964 . . . . 3.3199999999999998 113.092 178.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 tm-20 -99.48 -45.11 5.93 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.024 1.33 . . . . 2.9300000000000002 112.131 -173.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 11.9 tmm? -51.62 -36.44 45.83 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.062 1.745 . . . . 1.76 112.175 167.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 12.4 mt -65.94 -12.4 54.5 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 115.917 1.821 . . . . 2.0699999999999998 115.917 172.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -86.26 -25.14 25.7 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 123.826 0.85 . . . . 2.4500000000000002 112.592 169.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.02 -61.39 1.41 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.761 1.624 . . . . 2.4399999999999999 112.45 -175.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -70.51 -16.12 62.86 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.604 0.761 . . . . 2.6400000000000001 111.658 -175.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.83 17.12 11.85 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.683 1.993 . . . . 2.79 113.472 177.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -49.49 -37.73 27.49 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.468 1.655 . . . . 1.78 115.468 -171.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . 0.417 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 12.3 m-70 -63.45 -28.46 69.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.882 1.273 . . . . 2.3500000000000001 113.917 -175.548 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 60.1 tpp -81.79 -22.88 36.89 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.177 1.391 . . . . 2.6499999999999999 113.421 -172.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 11.2 mp -58.13 116.32 3.47 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.251 1.42 . . . . 3.5699999999999998 111.024 176.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 45.9 m -97.46 -4.85 37.32 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.836 0.854 . . . . 3.7999999999999998 112.616 172.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 12.4 t70 175.71 179.23 0.16 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 129.939 3.295 . . . . 3.9500000000000002 106.694 -168.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 12.4 t -55.49 -26.23 41.5 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 116.931 -1.509 . . . . 4.6299999999999999 112.077 160.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -51.32 -46.1 52.23 Favored Glycine 0 N--CA 1.471 1.023 0 C-N-CA 126.468 1.985 . . . . 2.1600000000000001 115.46 -171.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -53.81 -45.05 70.68 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.244 1.022 . . . . 3.6899999999999999 111.173 171.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.7 ttt-85 -74.13 -33.78 63.67 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.516 0.726 . . . . 5.9400000000000004 111.99 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 60.0 mmtt -56.62 -38.18 71.72 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 120.82 1.645 . . . . 4.0599999999999996 111.448 172.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -65.49 -14.46 61.06 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 115.089 1.515 . . . . 2.2599999999999998 115.089 173.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -85.67 -50.62 7.05 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.565 1.075 . . . . 2.2000000000000002 111.886 165.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.61 -37.63 76.29 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.957 0.903 . . . . 2.1400000000000001 112.458 -178.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -60.42 -25.29 65.85 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.506 0.928 . . . . 3.5299999999999998 113.506 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 15.6 mt -76.21 -37.7 57.41 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.13 -0.981 . . . . 1.8799999999999999 111.123 176.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 28.1 mm -57.13 -43.73 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.076 0.95 . . . . 2.0 111.337 -175.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -69.32 -41.11 77.15 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.505 1.922 . . . . 3.1200000000000001 113.054 175.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -59.53 -27.18 65.97 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.862 -0.524 . . . . 4.5999999999999996 112.138 170.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 6.2 mp -86.57 -19.62 29.15 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 114.227 1.195 . . . . 4.3700000000000001 114.227 174.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -22.71 67.04 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 120.296 1.407 . . . . 3.77 112.026 167.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -74.59 -9.56 58.69 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.309 1.225 . . . . 3.3399999999999999 114.309 168.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -138.0 -14.95 1.35 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 116.455 2.02 . . . . 2.77 116.455 -170.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -154.7 122.06 5.68 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 121.079 1.763 . . . . 3.77 114.187 -159.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -71.75 41.81 0.08 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 128.936 2.894 . . . . 4.4299999999999997 116.034 -171.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 76.32 0.36 66.26 Favored Glycine 0 CA--C 1.534 1.269 0 O-C-N 119.996 -1.69 . . . . 5.0999999999999996 114.195 177.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -78.94 -175.47 4.53 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.309 1.444 . . . . 8.0199999999999996 108.826 160.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 16.6 pt -147.51 155.74 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 128.098 2.559 . . . . 5.2699999999999996 106.871 158.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 4.2 m -77.65 -177.53 4.86 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.464 0.706 . . . . 2.4399999999999999 112.687 165.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -69.51 -54.27 15.0 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 122.281 1.038 . . . . 3.3199999999999998 110.462 169.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.68 -37.35 18.3 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 128.99 2.916 . . . . 3.1400000000000001 113.7 172.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -66.96 -42.97 84.27 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.14 0.976 . . . . 4.7000000000000002 112.886 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -53.8 -47.4 70.86 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.362 -1.462 . . . . 3.02 111.176 173.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 28.7 t-105 -63.41 -45.07 92.69 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 118.621 -0.704 . . . . 0.82999999999999996 111.484 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.91 -41.71 97.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.734 0.814 . . . . 2.4199999999999999 111.569 -179.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.0 mt -64.82 -33.44 76.01 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.399 -0.81 . . . . 1.8700000000000001 112.446 179.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 36.8 mm -56.98 -34.66 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 CA-C-N 120.698 1.59 . . . . 1.8100000000000001 111.823 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.66 -20.19 69.89 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 124.292 0.949 . . . . 0.66000000000000003 114.079 176.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.78 -27.6 68.74 Favored Glycine 0 CA--C 1.529 0.916 0 CA-C-N 118.282 1.041 . . . . 0.76000000000000001 113.218 177.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -89.82 -42.75 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.446 1.099 . . . . 1.8999999999999999 110.127 167.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 6.2 m -83.14 57.34 3.89 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.935 2.094 . . . . 1.8799999999999999 110.5 -177.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -126.17 -71.64 0.19 Allowed Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.831 1.682 . . . . 1.1499999999999999 110.57 177.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.5 -44.19 1.15 Allowed 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 123.017 2.478 . . . . 1.2 112.71 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 12.9 pt -72.0 -22.35 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 119.091 0.859 . . . . 2.25 113.128 -173.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -45.41 -62.65 1.19 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.374 1.47 . . . . 1.7 112.988 177.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -64.37 -26.82 68.64 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 120.539 -1.351 . . . . 4.5199999999999996 113.36 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.47 -41.78 97.76 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.796 1.634 . . . . 2.4399999999999999 110.621 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 53.4 mt -53.69 -56.06 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-O 121.867 0.842 . . . . 2.3900000000000001 110.682 170.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 43.4 t60 -63.19 -28.95 70.4 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.09 1.144 . . . . 1.8200000000000001 114.09 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -74.43 -28.24 60.97 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.796 1.238 . . . . 3.71 111.657 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . 0.527 ' C ' ' H ' ' B' ' 202' ' ' GLN . 2.8 mm100 -74.72 -40.56 61.24 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.501 1.12 . . . . 2.25 111.164 171.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -73.2 19.59 0.09 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 126.662 1.985 . . . . 2.8799999999999999 112.293 170.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.527 ' H ' ' C ' ' B' ' 200' ' ' GLN . 1.6 mm-40 -127.97 -61.68 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 125.238 1.415 . . . . 2.8500000000000001 109.652 159.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.307 12.2 pt20 . . . . . 0 N--CA 1.475 0.793 0 C-N-CA 130.127 3.371 . . . . 5.75 115.366 -171.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 118.918 -0.563 . . . . 4.1200000000000001 110.476 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 60.1 p -65.7 148.87 51.05 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 120.142 1.337 . . . . 2.02 110.138 168.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -63.71 -36.65 84.56 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.743 -0.598 . . . . 2.0899999999999999 111.644 -175.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.72 -48.39 80.95 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.273 1.429 . . . . 2.3900000000000001 110.031 174.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -72.82 -43.52 62.58 Favored 'General case' 0 C--O 1.23 0.072 0 CA-C-N 118.142 0.428 . . . . 3.6699999999999999 111.442 -173.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -48.51 -42.86 34.34 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.921 1.288 . . . . 6.1500000000000004 111.432 163.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.96 -30.22 65.07 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 116.762 -1.59 . . . . 1.8400000000000001 114.511 175.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.7 t -55.59 -33.81 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 CA-C-N 122.447 2.385 . . . . 2.0600000000000001 111.095 167.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 16.8 mt -56.89 -63.34 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 CA-C-N 119.588 1.085 . . . . 2.5 111.401 162.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.7 t -50.1 -43.31 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.095 1.358 . . . . 1.73 113.279 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.4 mp -66.44 -39.93 89.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.541 1.136 . . . . 2.1200000000000001 112.245 176.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.3 t -68.61 -45.98 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.906 0.883 . . . . 1.8400000000000001 110.258 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.3 tt0 -55.88 -44.86 78.54 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.364 0.529 . . . . 3.1200000000000001 111.027 171.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -69.1 -17.42 63.85 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 115.23 1.567 . . . . 2.3999999999999999 115.23 -170.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -80.74 -61.48 1.96 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.208 0.603 . . . . 3.1699999999999999 111.368 161.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -68.12 -22.9 64.86 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.376 0.88 . . . . 3.1099999999999999 113.376 -164.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -49.1 -24.2 1.53 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 125.018 1.327 . . . . 3.8900000000000001 113.084 170.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -94.43 -2.76 51.36 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.512 1.525 . . . . 3.3900000000000001 114.998 178.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.479 0.997 0 C-N-CA 125.593 1.557 . . . . 2.73 112.8 -178.368 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.9 pt . . . . . 0 CA--C 1.536 0.426 0 N-CA-C 107.42 -1.326 . . . . 4.2999999999999998 107.42 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.2 m -99.8 168.9 9.6 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 121.69 -0.631 . . . . 3.3399999999999999 111.302 172.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.02 -35.48 15.54 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.835 2.054 . . . . 3.3900000000000001 112.525 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.6 p -55.44 -19.62 9.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.889 2.076 . . . . 2.3399999999999999 114.843 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m -79.17 -46.44 17.93 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.398 0.999 . . . . 3.04 111.253 175.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -51.47 -51.87 51.36 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.556 1.142 . . . . 3.02 111.768 -177.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -52.67 -26.78 14.77 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.177 1.177 . . . . 4.8399999999999999 114.177 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -108.04 -40.08 5.32 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.457 1.103 . . . . 3.7599999999999998 112.792 -172.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -46.32 -46.17 17.97 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.122 0.969 . . . . 1.8300000000000001 110.577 162.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.3 mt -45.85 -67.1 0.31 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.453 1.501 . . . . 2.02 111.703 165.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -67.27 -12.04 59.06 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 115.544 1.683 . . . . 3.1699999999999999 115.544 -172.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.81 -43.44 10.64 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.505 0.928 . . . . 2.5499999999999998 113.505 169.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -104.14 -31.06 9.83 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.761 1.225 . . . . 2.7000000000000002 113.375 -166.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.3 mt -109.34 62.64 0.6 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 127.819 2.448 . . . . 3.7200000000000002 109.838 164.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -94.65 -12.26 27.7 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 115.147 1.536 . . . . 1.3100000000000001 115.147 -177.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 -91.14 -36.76 13.79 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 120.425 -1.422 . . . . 2.3500000000000001 113.014 -173.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.2 mmm -81.31 5.14 18.2 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.302 1.441 . . . . 3.1800000000000002 111.25 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.4 tp -66.88 83.49 0.11 Allowed 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 127.566 2.346 . . . . 4.3399999999999999 110.952 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.6 t -69.38 59.94 0.13 Allowed 'General case' 0 CA--C 1.549 0.94 0 O-C-N 121.281 -0.887 . . . . 5.4900000000000002 111.529 165.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.443 ' CG ' ' H ' ' A' ' 53' ' ' THR . 32.0 t70 51.09 -132.25 1.94 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 129.639 3.176 . . . . 3.9700000000000002 112.879 171.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.443 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 89.1 m -71.42 -36.85 71.44 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 126.665 1.986 . . . . 5.1200000000000001 109.951 -172.3 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.18 -51.35 59.37 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-N 119.518 1.054 . . . . 2.7200000000000002 111.63 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -60.15 -52.31 65.86 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.28 1.032 . . . . 3.96 112.53 174.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.5 ttt-85 -76.65 -31.66 57.48 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.628 -0.67 . . . . 5.6500000000000004 112.608 -170.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -68.2 -32.6 72.94 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 120.112 -1.617 . . . . 4.46 112.33 167.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.68 -19.83 59.46 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.392 1.256 . . . . 1.8400000000000001 114.392 169.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.85 -56.51 4.53 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 119.994 1.27 . . . . 1.6799999999999999 111.869 162.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.96 -31.44 72.55 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.172 1.175 . . . . 2.0899999999999999 114.172 -173.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -57.36 -28.4 63.14 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.35 -0.843 . . . . 3.4199999999999999 113.173 173.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.8 mt -75.37 -43.72 48.89 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.039 0.935 . . . . 1.8100000000000001 110.802 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.0 mm -56.9 -53.65 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.066 1.746 . . . . 2.0499999999999998 110.728 -175.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -58.92 -29.68 67.26 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.997 1.319 . . . . 2.5800000000000001 113.624 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.5 -24.72 42.1 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.484 1.914 . . . . 3.23 113.524 176.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 mt -124.05 -20.56 5.3 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.672 2.101 . . . . 4.3499999999999996 116.672 -168.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -61.89 -25.33 67.49 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.627 1.103 . . . . 3.2999999999999998 110.734 154.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -79.47 -21.29 45.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.53 1.532 . . . . 3.8799999999999999 114.836 171.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -128.58 17.04 6.43 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 119.939 1.245 . . . . 3.8700000000000001 114.031 -174.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -153.78 126.99 8.46 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 120.556 -1.34 . . . . 4.3399999999999999 111.736 173.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.07 59.26 3.22 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.284 2.234 . . . . 5.2999999999999998 114.226 -148.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.65 4.59 26.32 Favored Glycine 0 CA--C 1.534 1.277 0 O-C-N 120.727 -1.233 . . . . 3.27 112.566 -165.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 75.2 mmt-85 -75.29 151.55 38.32 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 127.006 2.122 . . . . 5.8899999999999997 111.413 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.6 mm -140.06 113.52 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 105.134 -2.173 . . . . 3.5699999999999998 105.134 166.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.2 m -79.72 173.68 12.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 118.967 0.803 . . . . 2.1899999999999999 112.153 168.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -55.03 -50.12 69.86 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.828 0.823 . . . . 3.4199999999999999 111.403 156.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.76 -26.58 67.79 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.492 1.917 . . . . 3.3199999999999998 113.994 -174.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -58.94 -55.24 37.68 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.938 1.295 . . . . 3.4900000000000002 110.952 173.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -54.85 -48.36 73.0 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 120.726 -1.234 . . . . 3.8199999999999998 111.668 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 24.6 t-105 -63.02 -44.03 97.08 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.163 0.801 . . . . 0.63 113.163 -177.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.9 t -67.58 -42.68 82.13 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.288 0.949 . . . . 2.8199999999999998 110.997 178.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.1 -39.12 93.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 117.975 -1.012 . . . . 1.8799999999999999 112.337 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 28.7 mm -52.47 -40.58 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 CA-C-N 120.62 1.555 . . . . 1.8400000000000001 111.5 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -68.19 -22.07 74.22 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.843 0.735 . . . . 0.70999999999999996 113.922 -178.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.38 -30.15 76.1 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-N 118.343 1.072 . . . . 0.68000000000000005 112.368 174.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -89.03 -47.73 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.069 0.947 . . . . 1.9099999999999999 109.514 167.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.2 m -83.62 59.35 5.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.327 2.251 . . . . 1.8799999999999999 110.948 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -151.06 -57.35 0.01 OUTLIER Glycine 0 CA--C 1.529 0.95 0 C-N-CA 126.642 2.068 . . . . 1.05 110.974 -178.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.02 -60.46 0.44 Allowed 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.445 2.097 . . . . 1.21 111.569 167.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.2 pt -64.24 -18.32 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 115.425 1.639 . . . . 2.3500000000000001 115.425 -175.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.32 -45.52 69.06 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.282 1.433 . . . . 2.2200000000000002 113.026 -175.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -60.75 -36.76 79.72 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.618 0.767 . . . . 6.25 112.786 178.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.3 tt -75.15 -44.59 46.03 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.702 1.601 . . . . 2.1600000000000001 109.875 -176.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 42.2 mt -52.51 -60.58 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.495 0.718 . . . . 2.1699999999999999 109.491 168.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -55.52 -40.54 71.94 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 118.42 -0.8 . . . . 2.1400000000000001 112.99 -176.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -69.66 -36.7 76.27 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 119.672 -0.811 . . . . 3.3100000000000001 111.638 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -70.82 -34.29 71.57 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 117.708 -1.139 . . . . 3.8799999999999999 113.879 -174.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -63.33 -12.24 28.32 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.443 1.02 . . . . 2.8100000000000001 112.396 172.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.052 0 C-N-CA 125.613 1.565 . . . . 2.96 112.907 179.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 109.966 -0.383 . . . . 4.3399999999999999 109.966 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 10.4 p -59.78 147.94 36.21 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 120.707 0.289 . . . . 1.78 110.642 -165.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . 0.462 ' CD ' ' HZ1' ' B' ' 113' ' ' LYS . 22.4 tp10 -63.96 -32.52 74.09 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 121.925 -0.484 . . . . 2.2999999999999998 111.942 -174.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.9 -47.68 76.92 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.427 1.091 . . . . 2.02 110.164 171.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.04 -44.98 52.44 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 119.544 1.065 . . . . 3.46 112.748 -172.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . 0.462 ' HZ1' ' CD ' ' B' ' 110' ' ' GLU . 44.6 tttm -42.72 -47.21 5.35 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.368 1.467 . . . . 5.8099999999999996 112.43 157.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.27 -31.96 69.56 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 117.165 -1.398 . . . . 1.6599999999999999 114.284 176.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 32.8 t -59.72 -33.58 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 121.253 1.842 . . . . 2.1899999999999999 110.747 171.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 11.8 mt -55.9 -63.59 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 CA-C-N 119.377 0.99 . . . . 2.6699999999999999 110.58 164.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 83.4 t -55.35 -40.47 57.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.398 1.479 . . . . 1.6599999999999999 112.936 -173.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -62.57 -35.01 78.11 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.118 0.967 . . . . 2.1699999999999999 112.319 175.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 70.5 t -80.86 -41.54 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.538 1.135 . . . . 1.75 110.735 -177.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 64.7 tt0 -56.96 -45.67 82.71 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.363 0.529 . . . . 3.0600000000000001 111.087 171.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -59.25 -27.94 66.26 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 114.51 1.3 . . . . 2.1600000000000001 114.51 -177.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -79.46 -60.35 2.4 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.236 0.926 . . . . 3.2000000000000002 111.296 173.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -65.73 -24.14 66.9 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.1 0.778 . . . . 3.1299999999999999 113.1 -169.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -51.55 -23.51 4.24 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.547 1.314 . . . . 3.9199999999999999 114.547 175.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -89.55 -11.09 43.79 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 115.045 1.498 . . . . 3.7000000000000002 115.045 175.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 CA--C 1.546 0.819 0 C-N-CA 126.267 1.827 . . . . 2.8799999999999999 111.864 -169.571 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 8.8 pt . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 108.368 -0.975 . . . . 4.4900000000000002 108.368 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 75.7 m -100.06 174.27 6.25 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.259 0.624 . . . . 3.6299999999999999 110.837 169.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -48.12 -30.74 4.81 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 113.767 1.025 . . . . 3.0499999999999998 113.767 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 14.1 p -50.46 -30.36 12.52 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.628 1.344 . . . . 2.4900000000000002 114.628 172.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 51.0 m -82.4 -32.42 29.14 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.41 1.004 . . . . 1.3 112.754 174.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -60.95 -48.57 81.21 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 120.007 1.276 . . . . 3.1699999999999999 111.38 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -56.86 -28.63 61.99 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.114 0.783 . . . . 5.1200000000000001 113.114 174.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.36 -52.09 5.83 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 125.253 1.421 . . . . 2.6299999999999999 111.81 -173.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 7.0 tmm? -47.24 -41.02 17.77 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.792 1.237 . . . . 1.97 111.402 167.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 30.7 mt -56.52 -70.86 0.1 Allowed 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 123.949 0.899 . . . . 1.96 111.502 167.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -72.37 -1.7 16.52 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.742 1.756 . . . . 3.6899999999999999 115.742 -171.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.25 -50.84 3.51 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.704 1.602 . . . . 2.4100000000000001 114.767 166.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -100.28 -26.18 14.0 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.102 1.319 . . . . 2.96 113.468 -172.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 22.2 mt -101.89 65.12 0.98 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.633 1.173 . . . . 4.0700000000000003 110.3 160.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -96.96 -8.79 29.74 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.636 1.347 . . . . 1.28 114.636 -177.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 36.3 m-70 -93.89 -32.08 14.06 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.489 -1.382 . . . . 2.2799999999999998 113.458 -171.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.0 mmm -91.25 -2.39 57.46 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.817 2.047 . . . . 3.1600000000000001 111.365 173.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.4 tp -71.47 74.45 0.76 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.857 2.063 . . . . 3.1099999999999999 111.322 -173.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 33.8 t -68.64 72.98 0.24 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.302 1.841 . . . . 4.9699999999999998 112.635 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 21.8 t70 38.2 -133.43 0.13 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 130.146 3.378 . . . . 4.3300000000000001 113.258 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 81.8 m -69.76 -40.99 75.76 Favored 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 125.097 1.359 . . . . 5.4400000000000004 111.19 -165.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.37 -48.17 87.49 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 119.562 1.074 . . . . 2.7599999999999998 111.747 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -72.47 -41.73 65.72 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.108 0.781 . . . . 3.8500000000000001 113.108 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -67.12 -40.24 86.8 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 120.256 -1.527 . . . . 5.9199999999999999 112.124 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 27.5 mmmt -67.23 -31.36 71.67 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 120.617 -1.302 . . . . 4.7300000000000004 112.401 170.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.49 -19.81 65.81 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 114.651 1.352 . . . . 1.8100000000000001 114.651 169.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.28 -57.7 3.64 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.808 1.185 . . . . 1.9399999999999999 111.632 162.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -65.73 -26.37 67.71 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.736 1.013 . . . . 2.25 113.736 -172.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -56.47 -34.07 66.55 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.014 -1.054 . . . . 3.46 112.254 169.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 21.0 mt -75.7 -34.59 60.41 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.803 0.441 . . . . 1.78 111.593 -177.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 38.7 mm -62.47 -55.23 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 124.746 1.218 . . . . 2.2999999999999998 109.744 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -60.73 -33.71 73.31 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.899 0.857 . . . . 2.3900000000000001 112.88 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -64.48 -24.53 67.65 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.469 1.508 . . . . 3.3799999999999999 113.308 174.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.32 -23.48 4.14 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 115.526 1.676 . . . . 3.77 115.526 -165.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -61.74 -13.61 24.78 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.065 -1.022 . . . . 3.2999999999999998 112.139 153.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.86 -12.53 59.41 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 115.435 1.643 . . . . 3.5600000000000001 115.435 163.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -134.48 -3.64 2.66 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.049 1.87 . . . . 3.1800000000000002 116.049 -169.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -149.8 90.36 1.69 Allowed 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 120.853 1.66 . . . . 3.9300000000000002 114.72 -170.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -81.07 116.42 21.0 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.094 1.757 . . . . 6.04 112.894 -178.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 67.02 8.59 50.27 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 115.989 1.156 . . . . 2.8599999999999999 115.989 165.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 36.2 mmt-85 -112.31 163.57 14.23 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.078 1.751 . . . . 6.2800000000000002 110.428 173.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.8 mm -149.82 129.78 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 126.375 1.87 . . . . 3.2599999999999998 106.469 161.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 11.3 m -93.25 171.75 8.73 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.216 1.006 . . . . 2.0699999999999998 111.065 171.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -71.37 -50.36 32.99 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 122.048 0.928 . . . . 3.6499999999999999 111.956 173.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -70.79 -18.48 62.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.189 2.196 . . . . 3.04 113.621 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -54.38 -55.7 26.02 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.93 1.692 . . . . 3.4399999999999999 111.569 167.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -55.22 -44.8 75.76 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.662 -1.274 . . . . 3.9199999999999999 111.824 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 22.9 t-105 -62.93 -45.62 91.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.742 -0.647 . . . . 0.81999999999999995 112.419 -177.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 6.8 t -71.59 -40.09 70.12 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 118.668 -0.682 . . . . 2.6299999999999999 111.827 178.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 85.9 mt -56.42 -49.31 74.9 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 117.888 -1.053 . . . . 1.8 111.091 173.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 26.7 mm -50.13 -36.97 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-N 120.53 1.514 . . . . 1.8300000000000001 112.63 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.42 -26.87 66.92 Favored Glycine 0 CA--C 1.53 1.023 0 CA-C-O 119.121 -0.821 . . . . 0.58999999999999997 113.257 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -73.9 -31.5 60.0 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 118.313 1.056 . . . . 0.88 113.922 178.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.1 mp -85.99 -36.0 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 118.638 1.219 . . . . 1.8700000000000001 110.877 173.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 62.6 m -71.46 -54.63 9.99 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.17 1.388 . . . . 2.9199999999999999 111.475 -176.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -46.63 -41.85 13.44 Favored Glycine 0 CA--C 1.539 1.588 0 CA-C-O 117.264 -1.853 . . . . 2.4100000000000001 116.705 -175.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.92 -51.91 2.02 Favored 'Trans proline' 0 C--N 1.353 0.812 0 CA-C-N 122.173 2.986 . . . . 1.5 112.046 175.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 25.2 pt -81.11 -15.49 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 N-CA-C 114.722 1.379 . . . . 2.0099999999999998 114.722 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -49.8 -43.76 48.65 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.692 1.597 . . . . 2.0699999999999998 112.849 -178.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 2.6 ptpp? -59.7 -36.31 76.26 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.962 0.905 . . . . 6.3499999999999996 113.349 175.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 3.4 tt -77.89 -41.31 37.07 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.894 1.678 . . . . 2.3999999999999999 110.091 -176.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 24.2 mt -56.22 -60.86 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.413 0.685 . . . . 2.3199999999999998 109.347 168.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -54.58 -39.36 67.72 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 113.256 0.836 . . . . 2.2200000000000002 113.256 -177.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -68.89 -38.02 79.39 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 119.745 -0.782 . . . . 3.29 111.627 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -70.14 -34.23 72.78 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 117.959 -1.019 . . . . 3.9399999999999999 113.281 -173.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -63.01 -9.7 11.1 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.407 1.003 . . . . 2.7599999999999998 112.942 171.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -114.15 -39.14 3.96 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.773 1.629 . . . . 3.0699999999999998 113.33 177.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 . . . . . 0 CA--C 1.541 0.617 0 C-N-CA 127.185 2.194 . . . . 7.7800000000000002 112.159 -172.885 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 . . . . . 0 CA--C 1.547 0.834 0 N-CA-C 112.322 0.489 . . . . 3.8799999999999999 112.322 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.1 p -62.67 144.95 55.76 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 108.006 -1.109 . . . . 2.0800000000000001 108.006 159.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.41 -43.54 98.57 Favored 'General case' 0 C--O 1.213 -0.834 0 CA-C-O 116.815 -1.564 . . . . 2.5499999999999998 110.071 176.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -46.89 -48.44 21.18 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 120.3 1.409 . . . . 2.0499999999999998 110.363 177.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -71.54 -51.21 24.75 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 118.045 -0.979 . . . . 2.9399999999999999 112.581 -175.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 34.5 tptt -61.84 -23.89 66.55 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 121.456 1.935 . . . . 6.9400000000000004 114.082 170.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.04 -38.79 72.55 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 125.338 1.455 . . . . 2.2200000000000002 111.302 167.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.86 -41.09 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 121.04 1.745 . . . . 1.8799999999999999 110.07 169.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 16.6 mm -53.07 -50.56 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 119.567 1.076 . . . . 2.8599999999999999 111.063 167.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.7 t -62.43 -38.03 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.823 1.192 . . . . 2.1400000000000001 111.99 179.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp -70.52 -26.84 63.77 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 120.705 -1.247 . . . . 2.1200000000000001 112.584 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 97.3 t -81.41 -38.3 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 118.932 0.787 . . . . 1.8999999999999999 111.311 175.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -52.57 -48.66 66.05 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.984 0.914 . . . . 3.3599999999999999 110.512 165.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -63.98 -15.39 59.18 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.516 1.673 . . . . 2.48 115.516 -171.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -88.86 -60.56 1.92 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.846 0.858 . . . . 3.1299999999999999 111.886 166.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -68.23 -22.39 64.79 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.383 1.253 . . . . 2.9900000000000002 114.383 -169.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.1 ptmt -52.54 -19.89 2.58 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 115.707 1.743 . . . . 3.25 115.707 -177.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -96.53 -1.43 47.17 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 115.36 1.615 . . . . 4.9800000000000004 115.36 174.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 19.9 m . . . . . 0 N--CA 1.485 1.292 0 CA-C-N 120.704 1.593 . . . . 3.73 112.377 -172.562 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 37.7 pt . . . . . 0 N--CA 1.471 0.613 0 CA-C-O 121.268 0.556 . . . . 3.7599999999999998 111.331 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.0 m -71.05 145.87 49.66 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.646 -0.659 . . . . 3.0699999999999998 110.578 170.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -59.39 -25.9 64.67 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 119.765 -1.834 . . . . 3.0299999999999998 113.12 172.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.1 p -72.71 -20.42 61.22 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 114.04 1.126 . . . . 2.2400000000000002 114.04 169.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 39.6 m -71.54 -21.03 61.95 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 120.748 -1.22 . . . . 1.3700000000000001 111.527 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -58.98 -59.24 5.78 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.548 1.067 . . . . 3.6400000000000001 111.206 172.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -61.84 -19.67 62.84 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.878 0.871 . . . . 3.2200000000000002 113.301 -176.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -88.82 -49.88 6.56 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 127.175 2.19 . . . . 2.9399999999999999 110.685 179.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 7.1 tmm? -54.4 -40.13 67.93 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.642 1.577 . . . . 1.6799999999999999 111.599 173.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.3 mt -49.77 -32.64 14.3 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.252 1.421 . . . . 1.76 113.206 168.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.84 -5.61 50.61 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.103 1.32 . . . . 3.25 113.823 -178.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.23 -51.58 4.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.676 0.79 . . . . 2.27 111.186 168.074 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -96.06 -21.38 18.0 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.597 0.962 . . . . 2.8100000000000001 113.597 -167.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.01 34.61 4.84 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.427 1.891 . . . . 2.6200000000000001 111.616 -176.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -80.42 -15.23 57.3 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 116.727 2.121 . . . . 1.53 116.727 -156.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 15.3 m-70 -79.73 -49.52 11.94 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 121.324 1.875 . . . . 2.27 112.388 -167.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 76.4 mtm -72.13 -19.83 61.71 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.925 1.69 . . . . 3.4300000000000002 112.861 170.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.7 tp -86.13 50.89 2.07 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.927 1.291 . . . . 3.8399999999999999 110.061 178.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 2.5 m -71.02 -9.03 57.33 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 115.801 1.778 . . . . 4.3399999999999999 115.801 -153.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.515 ' CG ' ' H ' ' A' ' 53' ' ' THR . 22.6 t70 -162.28 174.98 12.1 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.423 1.889 . . . . 5.4000000000000004 111.44 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.515 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 9.5 m -48.66 -37.0 17.24 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 130.232 3.413 . . . . 4.04 111.943 162.383 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.0 -45.82 91.97 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 119.235 0.925 . . . . 2.7999999999999998 112.217 172.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -69.47 -42.39 74.93 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.93 0.892 . . . . 4.4400000000000004 109.975 175.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.75 -30.45 22.7 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.801 1.64 . . . . 5.8799999999999999 114.114 172.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.5 mtmt -59.96 -22.23 62.23 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.28 1.4 . . . . 4.8700000000000001 113.293 174.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.48 -15.32 57.01 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 114.866 1.432 . . . . 1.8600000000000001 114.866 169.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.74 -49.31 10.58 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.402 1.081 . . . . 1.5600000000000001 110.799 162.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -67.71 -29.46 68.72 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.735 1.214 . . . . 2.0600000000000001 114.105 -176.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.2 ptmt -50.34 -35.68 28.87 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 119.563 1.074 . . . . 4.7300000000000004 111.663 165.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.7 mt -78.23 -44.97 24.17 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 123.305 0.642 . . . . 2.1200000000000001 111.15 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 23.0 mm -52.55 -49.53 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 123.734 0.646 . . . . 2.0 110.468 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -65.43 -40.12 92.92 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.503 0.927 . . . . 2.3399999999999999 113.503 178.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -61.97 -29.66 70.4 Favored 'General case' 0 CA--C 1.554 1.123 0 N-CA-C 113.224 0.824 . . . . 4.3200000000000003 113.224 172.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.84 -26.15 21.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.745 1.218 . . . . 2.98 112.158 179.209 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -64.16 -22.21 66.85 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.83 -1.168 . . . . 2.8599999999999999 113.772 165.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.43 -15.98 60.89 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 114.294 1.22 . . . . 3.1299999999999999 114.294 164.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -126.56 -13.38 5.98 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 116.887 2.18 . . . . 2.6000000000000001 116.887 -166.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.14 125.31 27.66 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 121.963 2.165 . . . . 4.1600000000000001 111.873 174.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -80.1 58.52 3.0 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.933 2.093 . . . . 4.2300000000000004 111.955 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 76.12 2.5 72.6 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.594 1.093 . . . . 3.4500000000000002 113.819 -174.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -77.22 163.0 26.93 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.407 1.104 . . . . 7.54 110.855 177.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 36.0 mm -138.61 140.11 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.479 1.511 . . . . 3.23 108.084 171.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.9 t -95.24 -146.49 0.27 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 127.05 2.14 . . . . 2.6800000000000002 112.061 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -112.92 -59.67 1.99 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.03 1.732 . . . . 3.9700000000000002 109.904 152.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.53 -22.63 61.93 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.079 2.151 . . . . 3.5 112.943 -170.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -47.57 -59.62 3.13 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 127.335 2.254 . . . . 3.1299999999999999 111.09 167.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -54.17 -44.21 71.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.381 0.992 . . . . 3.9500000000000002 112.202 -179.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.8 t-105 -63.1 -48.07 80.12 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 118.881 -0.581 . . . . 0.83999999999999997 111.887 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.9 t -71.22 -26.45 62.93 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.931 0.787 . . . . 2.79 112.304 178.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.0 mt -66.15 -46.43 77.47 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.448 -1.263 . . . . 1.8700000000000001 111.338 170.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.7 mm -51.99 -41.4 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 CA-C-N 121.808 2.094 . . . . 1.8799999999999999 112.038 176.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.57 -21.96 71.17 Favored Glycine 0 CA--C 1.532 1.118 0 O-C-N 121.568 -0.708 . . . . 0.97999999999999998 113.565 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.29 -23.36 68.48 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 118.631 -1.094 . . . . 1.01 114.279 -177.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -92.04 -42.68 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 125.441 1.496 . . . . 2.29 110.044 166.137 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.2 m -78.77 60.11 2.71 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.528 2.331 . . . . 1.8799999999999999 110.691 -177.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -130.33 -77.2 0.17 Allowed Glycine 0 CA--C 1.532 1.154 0 C-N-CA 126.206 1.86 . . . . 1.0700000000000001 111.094 173.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -62.32 -38.0 57.23 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.146 2.564 . . . . 1.1699999999999999 112.735 -178.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.2 pp -77.82 -14.75 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 112.864 0.69 . . . . 2.3300000000000001 112.864 174.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.67 -33.02 41.56 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.798 -1.188 . . . . 2.25 113.512 -174.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.82 -33.57 71.93 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 120.095 -1.628 . . . . 3.4700000000000002 111.657 163.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.04 -40.01 90.64 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 118.407 -0.806 . . . . 3.0499999999999998 111.687 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 92.3 mt -45.71 -62.68 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.617 0.767 . . . . 1.8700000000000001 110.212 164.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -60.43 -42.81 96.86 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.088 -0.505 . . . . 1.79 111.875 -172.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.298 4.1 pt-20 -76.38 -19.97 57.63 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 112.818 0.673 . . . . 3.2799999999999998 112.818 -176.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -85.11 -37.24 20.49 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.984 1.714 . . . . 2.4900000000000002 115.297 173.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -73.07 -16.48 61.48 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.178 0.899 . . . . 2.48 110.992 176.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 . . . . . 0 N--CA 1.466 0.338 0 C-N-CA 125.047 1.339 . . . . 2.2999999999999998 111.085 170.12 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 C--O 1.242 0.71 0 N-CA-C 111.552 0.205 . . . . 3.4300000000000002 111.552 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 11.7 p -57.93 151.35 18.42 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.053 -0.721 . . . . 1.9199999999999999 109.053 166.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -68.55 -31.44 70.66 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 116.498 -1.715 . . . . 3.2000000000000002 111.614 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.98 -48.62 70.17 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 121.418 1.917 . . . . 2.0299999999999998 109.746 171.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -72.25 -51.35 21.35 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.442 -0.789 . . . . 2.8999999999999999 112.325 -174.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -62.29 -24.07 67.08 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 121.324 1.875 . . . . 7.96 114.078 170.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.43 -43.24 73.78 Favored 'General case' 0 C--O 1.222 -0.376 0 O-C-N 120.233 -1.542 . . . . 2.0099999999999998 111.461 166.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.04 -43.17 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 121.512 1.96 . . . . 1.9199999999999999 110.69 169.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 22.3 mm -52.93 -55.57 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.045 0.838 . . . . 3.2799999999999998 111.648 168.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 6.7 t -61.15 -38.71 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.61 1.164 . . . . 1.8700000000000001 112.32 -177.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.8 mp -66.84 -32.59 73.96 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.237 -0.914 . . . . 2.1499999999999999 111.848 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 79.4 t -80.01 -38.94 19.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.267 1.027 . . . . 1.8400000000000001 111.025 177.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -55.05 -46.82 75.38 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.279 1.031 . . . . 3.1800000000000002 110.5 168.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -59.44 -24.8 63.83 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 115.303 1.594 . . . . 2.3700000000000001 115.303 -173.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -87.96 -58.4 2.58 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.158 1.383 . . . . 3.52 112.302 171.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -64.79 -26.69 68.46 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 112.582 0.586 . . . . 2.9199999999999999 112.582 -172.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -53.43 -16.51 1.45 Allowed 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.017 1.488 . . . . 3.2799999999999998 115.017 174.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -90.24 -5.51 56.27 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 114.744 1.387 . . . . 4.0300000000000002 114.744 173.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 22.4 m . . . . . 0 N--CA 1.484 1.261 0 CA-C-N 121.271 1.85 . . . . 3.3399999999999999 112.418 -171.788 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 31.3 pt . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 112.064 0.394 . . . . 3.1000000000000001 112.064 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 69.0 m -85.95 151.17 23.96 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.201 -0.937 . . . . 2.6499999999999999 111.172 169.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . 0.476 ' HE3' ' HA ' ' B' ' 170' ' ' ASP . 0.0 OUTLIER -58.06 -28.99 65.03 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.238 -1.539 . . . . 3.8999999999999999 112.667 175.764 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 43.9 p -70.5 -24.51 62.86 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.616 -1.303 . . . . 2.27 114.218 171.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 20.0 m -72.53 -26.3 61.7 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 120.794 -1.191 . . . . 1.4299999999999999 112.195 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -60.97 -51.25 70.06 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.137 -0.977 . . . . 3.2799999999999998 112.103 173.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -67.08 -25.93 66.47 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.597 -0.689 . . . . 3.27 112.312 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.92 -52.52 28.49 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 124.314 1.046 . . . . 3.1899999999999999 110.714 170.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 2.2 ttm -55.39 -39.83 70.63 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.976 1.31 . . . . 2.29 110.696 179.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.7 mt -56.53 -62.1 1.96 Allowed 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 125.825 1.65 . . . . 1.71 112.25 165.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -63.85 -16.76 62.13 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 120.349 1.431 . . . . 3.2999999999999998 114.779 -176.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.78 -56.8 3.31 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.331 0.969 . . . . 2.1200000000000001 112.019 170.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -93.88 -19.48 20.93 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 113.606 0.965 . . . . 2.8300000000000001 113.606 -165.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 3.9 mt -122.33 57.21 1.09 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 129.135 2.974 . . . . 2.54 109.739 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -96.2 -16.82 21.23 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.724 1.75 . . . . 1.3799999999999999 115.724 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -82.72 -27.51 31.1 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 121.087 1.767 . . . . 2.6099999999999999 114.131 -172.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 65.3 mtm -89.26 6.1 41.85 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.413 1.885 . . . . 3.3500000000000001 113.207 174.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 2.3 tp -83.36 -167.37 1.67 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 128.148 2.579 . . . . 3.5099999999999998 111.49 173.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 15.5 m -174.6 -45.63 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 128.524 2.73 . . . . 4.0899999999999999 109.266 171.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . 0.441 ' CG ' ' H ' ' B' ' 156' ' ' THR . 17.4 t70 -151.69 179.07 8.72 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-O 123.437 1.589 . . . . 4.96 112.192 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 156' ' ' THR . . . . . 0.441 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 12.5 m -35.38 -40.99 0.16 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 128.802 2.841 . . . . 3.77 112.673 151.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.96 -47.76 47.43 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 124.923 1.249 . . . . 2.29 113.351 176.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -64.15 -48.17 77.04 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.904 0.881 . . . . 4.5300000000000002 110.391 173.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -55.86 -33.4 64.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.992 1.717 . . . . 6.0700000000000003 114.074 -178.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -55.69 -22.95 25.81 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 120.99 -1.069 . . . . 5.9100000000000001 113.721 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -80.94 -14.89 57.56 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.044 1.498 . . . . 1.9399999999999999 115.044 172.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -80.15 -52.19 8.06 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.58 1.082 . . . . 1.6299999999999999 110.485 160.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -66.42 -29.8 70.03 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.775 1.23 . . . . 1.95 113.323 -172.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt -50.13 -35.18 24.78 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 118.911 0.778 . . . . 5.0099999999999998 112.406 165.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.5 mt -81.32 -40.86 22.96 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.64 -0.663 . . . . 2.21 111.322 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.62 -48.98 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 123.23 0.612 . . . . 1.97 111.102 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -65.04 -24.42 67.48 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.002 1.112 . . . . 2.2999999999999998 114.002 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -82.36 -41.05 20.49 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.293 1.22 . . . . 4.1500000000000004 114.293 173.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.56 -32.04 20.9 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 121.12 -0.988 . . . . 3.4300000000000002 112.45 -171.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . 0.476 ' HA ' ' HE3' ' B' ' 138' ' ' LYS . 7.9 t70 -60.26 -44.88 94.91 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.256 -0.902 . . . . 3.0 111.228 174.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.99 -12.0 7.02 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.168 1.787 . . . . 3.0299999999999998 115.363 174.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -117.11 -4.06 11.48 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.758 1.223 . . . . 2.2799999999999998 113.628 -177.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -154.96 95.29 1.73 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.697 1.135 . . . . 4.6399999999999997 110.104 -168.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -76.23 79.94 3.02 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.631 1.572 . . . . 4.21 112.858 -164.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 68.24 -4.67 4.56 Favored Glycine 0 CA--C 1.535 1.304 0 O-C-N 121.03 -1.043 . . . . 3.1400000000000001 113.114 -166.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 64.3 mmt-85 -68.52 147.95 51.25 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.799 1.24 . . . . 7.0599999999999996 109.702 174.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 35.6 mm -142.55 137.92 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 126.464 1.905 . . . . 3.2200000000000002 107.37 176.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 9.1 t -92.12 -142.87 0.2 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.961 1.704 . . . . 2.6099999999999999 111.512 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -117.82 -56.71 2.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.404 1.881 . . . . 3.9900000000000002 110.284 158.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -61.68 -27.41 68.67 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 128.508 2.723 . . . . 3.0 114.32 -177.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -43.54 -58.78 2.46 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.336 1.854 . . . . 3.0099999999999998 111.054 165.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -54.5 -43.88 72.22 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.239 -0.913 . . . . 3.9199999999999999 111.772 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 35.4 t-105 -62.3 -47.94 82.07 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 122.123 -0.361 . . . . 0.80000000000000004 111.753 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 13.2 t -71.74 -25.81 62.21 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 118.215 -0.898 . . . . 2.7000000000000002 112.274 177.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 62.1 mt -63.96 -48.97 74.37 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 117.28 -1.343 . . . . 1.8500000000000001 110.737 168.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 38.7 mm -50.27 -41.88 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 CA-C-N 121.348 1.885 . . . . 1.8500000000000001 112.065 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.55 -25.1 72.69 Favored Glycine 0 CA--C 1.531 1.057 0 O-C-N 121.534 -0.729 . . . . 0.94999999999999996 113.744 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.94 -21.68 75.83 Favored Glycine 0 CA--C 1.533 1.182 0 CA-C-O 118.672 -1.071 . . . . 1.0700000000000001 114.438 -176.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -88.49 -48.4 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 125.12 1.368 . . . . 2.23 109.161 163.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 1.5 m -86.44 44.71 1.17 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.621 1.968 . . . . 2.5600000000000001 111.9 -165.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -118.42 -71.39 0.39 Allowed Glycine 0 CA--C 1.53 1.027 0 C-N-CA 126.603 2.049 . . . . 1.29 111.036 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.14 -30.66 82.54 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.471 2.781 . . . . 1.8200000000000001 114.176 -178.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 7.7 pt -83.88 -13.75 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 119.713 1.142 . . . . 2.46 113.518 172.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.95 -34.94 76.17 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.31 1.226 . . . . 2.02 114.31 -169.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -56.78 -36.29 69.69 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.434 -1.416 . . . . 3.9900000000000002 111.808 168.289 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.02 -40.04 75.44 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 123.625 0.77 . . . . 3.2799999999999998 111.369 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 90.3 mt -47.41 -62.33 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.768 0.827 . . . . 2.1000000000000001 110.85 166.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -56.35 -46.67 79.87 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.514 0.561 . . . . 1.6799999999999999 112.514 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.305 2.6 pt-20 -78.6 -13.19 59.95 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.977 0.732 . . . . 2.9100000000000001 112.977 -173.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -81.45 -25.81 35.81 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 115.058 1.503 . . . . 2.3300000000000001 115.058 169.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -75.13 -15.63 60.58 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.12 0.968 . . . . 2.23 111.228 170.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -102.49 -61.81 1.35 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.965 1.306 . . . . 2.3399999999999999 110.876 -179.553 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.254 7.5 pt20 . . . . . 0 N--CA 1.48 1.057 1 C-N-CA 132.026 4.13 . . . . 5.6100000000000003 115.72 171.744 . . . . . . . . 2 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 . . . . . 0 CA--C 1.544 0.714 0 N-CA-C 112.34 0.496 . . . . 3.7799999999999998 112.34 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 17.1 p -78.95 166.75 22.03 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 120.795 -1.191 . . . . 2.1800000000000002 110.953 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.472 ' CD ' ' HZ1' ' A' ' 10' ' ' LYS . 4.3 tp10 -56.58 -34.13 66.85 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.28 0.632 . . . . 2.25 112.47 176.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -45.7 90.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.17 1.388 . . . . 1.8999999999999999 110.122 175.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -76.23 -47.99 21.93 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.993 0.917 . . . . 2.9300000000000002 111.423 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.472 ' HZ1' ' CD ' ' A' ' 7' ' ' GLU . 40.2 tttm -44.89 -46.69 11.01 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.248 1.419 . . . . 6.6500000000000004 113.104 159.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.99 88.08 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.563 -1.208 . . . . 1.6100000000000001 112.896 175.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.5 t -57.76 -38.61 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 120.87 1.668 . . . . 1.72 110.377 174.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.4 mt -63.64 -43.37 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 121.634 -0.666 . . . . 2.3999999999999999 111.277 173.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.8 t -68.28 -39.82 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 124.394 1.077 . . . . 1.5900000000000001 111.986 179.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.4 mp -59.83 -45.29 92.85 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.75 1.159 . . . . 1.97 110.212 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.6 t -64.66 -42.22 94.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 124.896 1.278 . . . . 1.6599999999999999 112.32 177.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -56.57 -49.28 75.33 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.408 1.083 . . . . 3.3799999999999999 111.13 168.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.16 -24.62 61.47 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.91 0.707 . . . . 2.5899999999999999 112.91 -170.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -71.2 -63.15 1.16 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.983 0.513 . . . . 3.1099999999999999 112.185 161.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -63.53 -32.59 74.09 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.792 -0.623 . . . . 3.0899999999999999 112.376 -163.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.8 pttt -55.57 -23.38 26.66 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.585 1.328 . . . . 3.04 114.585 175.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -78.95 -31.03 44.9 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.623 -1.298 . . . . 3.6000000000000001 112.607 174.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.1 m . . . . . 0 N--CA 1.486 1.333 0 CA-C-N 120.824 1.647 . . . . 2.7400000000000002 111.72 176.379 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.0 pt . . . . . 0 CA--C 1.533 0.289 0 N-CA-C 108.907 -0.775 . . . . 4.2599999999999998 108.907 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 72.1 m -113.92 167.64 10.48 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.606 0.763 . . . . 3.7400000000000002 109.512 160.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.41 -18.28 4.01 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 115.583 1.697 . . . . 3.3199999999999998 115.583 176.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.3 p -57.15 -20.73 28.01 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.384 -1.447 . . . . 2.4300000000000002 114.286 165.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.7 m -82.44 -33.01 28.69 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.725 -1.234 . . . . 1.3799999999999999 113.52 171.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -55.3 -52.38 63.63 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.789 1.177 . . . . 3.79 111.37 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -16.32 8.81 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.688 1.195 . . . . 3.5800000000000001 113.976 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -106.86 -38.58 6.03 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 124.826 1.251 . . . . 3.04 112.529 -174.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.2 ttm -47.99 -44.58 30.74 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.767 0.827 . . . . 2.3500000000000001 110.286 156.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.2 mt -62.46 -12.64 23.17 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 116.006 1.854 . . . . 1.8500000000000001 116.006 170.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -104.96 -15.56 15.09 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 124.761 1.224 . . . . 2.3300000000000001 113.505 174.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.51 -47.56 3.9 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.326 1.051 . . . . 2.2599999999999998 112.924 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -94.73 -9.53 34.42 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.223 1.374 . . . . 2.9399999999999999 113.967 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -120.14 34.11 5.34 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.849 1.66 . . . . 2.3300000000000001 112.601 171.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -78.65 -21.2 48.69 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 116.209 1.929 . . . . 1.6499999999999999 116.209 -161.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -94.18 -14.35 25.69 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.237 1.381 . . . . 2.48 112.989 -170.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 50.2 mtm -85.53 -18.1 34.43 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.625 1.17 . . . . 3.3100000000000001 112.922 162.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.55 125.99 26.93 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 120.643 -1.286 . . . . 3.3199999999999998 108.618 163.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.6 p -171.81 -57.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.568 -0.707 . . . . 4.6399999999999997 109.449 -158.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -79.49 147.2 32.32 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.511 0.724 . . . . 5.4500000000000002 109.25 155.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.3 m -69.15 -30.17 68.35 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.785 0.834 . . . . 3.3700000000000001 110.473 171.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -55.8 -33.74 60.29 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 124.461 1.029 . . . . 2.0699999999999998 113.098 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -59.78 -56.0 27.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.319 1.047 . . . . 3.73 111.514 -179.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.6 ttt-85 -73.33 -33.29 65.05 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.148 0.795 . . . . 5.71 113.148 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -55.65 -38.11 69.12 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 119.562 -1.961 . . . . 3.71 112.163 171.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.96 -10.14 55.79 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.571 1.693 . . . . 1.8100000000000001 115.571 172.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.32 -57.32 3.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.585 1.084 . . . . 1.78 111.019 162.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.18 -29.42 70.35 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.49 0.716 . . . . 2.96 112.085 -172.295 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -62.64 -28.07 69.65 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 120.434 -1.416 . . . . 3.29 114.311 172.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.9 mt -78.54 -36.76 44.3 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.315 0.646 . . . . 1.8700000000000001 110.554 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.4 mm -51.6 -55.48 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 126.271 1.828 . . . . 2.0299999999999998 109.55 178.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -60.1 -31.15 69.77 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.67 0.989 . . . . 2.7400000000000002 113.67 -178.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -31.61 65.64 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.405 1.482 . . . . 3.9199999999999999 112.55 175.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.4 -29.98 21.08 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.335 1.454 . . . . 2.9199999999999999 111.587 177.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -55.4 -52.01 64.98 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.757 1.623 . . . . 2.9900000000000002 109.503 164.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.97 -14.69 24.47 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 115.553 1.686 . . . . 2.8199999999999998 115.553 175.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -118.73 -7.39 10.52 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.152 1.538 . . . . 2.3500000000000001 115.152 -175.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -147.45 125.28 11.92 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 121.019 1.736 . . . . 4.6299999999999999 111.051 -179.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -114.88 149.82 36.56 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.632 0.773 . . . . 5.2300000000000004 110.44 163.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.54 -43.67 0.59 Allowed Glycine 0 CA--C 1.53 1.002 0 C-N-CA 126.598 2.047 . . . . 3.8300000000000001 114.346 -178.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -88.93 140.66 29.21 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.296 1.439 . . . . 6.6799999999999997 112.342 -173.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 46.7 mm -114.29 129.61 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 N-CA-C 106.357 -1.72 . . . . 3.3300000000000001 106.357 154.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.2 t -84.9 -171.71 3.79 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.392 0.615 . . . . 2.0099999999999998 112.489 -179.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -94.51 -57.76 2.39 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 119.253 -2.154 . . . . 3.1200000000000001 110.404 167.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -51.46 -29.13 15.23 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 130.713 3.605 . . . . 3.3300000000000001 114.94 170.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -49.72 -58.67 4.87 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.306 1.442 . . . . 3.23 111.306 171.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -52.44 -48.21 65.94 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.211 -0.931 . . . . 3.1099999999999999 111.652 176.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.4 t-105 -64.54 -45.56 86.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 119.054 -0.498 . . . . 0.58999999999999997 111.416 -171.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.2 t -71.17 -29.39 65.13 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 117.753 -1.117 . . . . 2.96 112.229 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.89 -35.51 76.95 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.459 1.027 . . . . 1.73 112.207 174.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.3 mm -52.26 -38.72 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 CA-C-N 120.322 1.419 . . . . 1.79 111.359 173.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.79 -14.02 64.64 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.422 1.487 . . . . 0.58999999999999997 115.309 177.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.29 -24.94 64.7 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-N 119.394 1.597 . . . . 0.80000000000000004 112.842 173.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -97.08 -41.99 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.305 1.442 . . . . 2.29 109.96 171.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.4 m -80.93 64.12 5.57 Favored 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 127.014 2.126 . . . . 1.72 108.342 173.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -159.87 -55.67 0.01 OUTLIER Glycine 0 CA--C 1.531 1.038 0 C-N-CA 126.04 1.781 . . . . 1.3200000000000001 110.937 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.09 -73.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.344 2.696 . . . . 1.6299999999999999 111.341 161.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.5 pt -73.51 -18.33 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 N-CA-C 114.7 1.37 . . . . 2.52 114.7 -170.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.23 -39.29 69.55 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.227 1.011 . . . . 2.3399999999999999 112.606 -178.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -63.28 -41.79 99.05 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.5 -0.75 . . . . 6.8700000000000001 111.863 175.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.5 tt -65.18 -40.89 94.9 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 117.908 -1.044 . . . . 2.3799999999999999 110.818 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -45.72 -51.28 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 119.375 0.988 . . . . 1.97 110.726 174.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -63.71 -39.18 93.66 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.605 0.965 . . . . 1.98 113.605 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -85.41 -24.09 27.66 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.18 0.9 . . . . 2.7799999999999998 112.978 -177.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.504 ' C ' ' H ' ' A' ' 99' ' ' GLN . 5.3 tp60 -66.89 -46.36 75.15 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.159 1.383 . . . . 3.0800000000000001 109.166 164.521 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -84.16 41.16 0.8 Allowed 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 124.914 2.292 . . . . 3.1099999999999999 111.002 176.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.504 ' H ' ' C ' ' A' ' 97' ' ' GLN . 1.7 mm-40 . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 111.862 -2.426 . . . . 2.77 107.361 149.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 . . . . . 0 CA--C 1.54 0.576 0 CA-C-O 121.091 0.472 . . . . 3.6400000000000001 111.976 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.3 p -82.74 168.99 16.67 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 121.526 -0.734 . . . . 2.2200000000000002 110.359 177.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -63.8 -48.78 75.51 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-O 117.022 -1.466 . . . . 2.5600000000000001 110.509 171.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.25 -47.23 36.11 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 120.2 1.363 . . . . 1.73 111.0 178.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -73.49 -53.91 9.5 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 126.078 1.751 . . . . 2.96 112.503 -173.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -47.55 -36.64 10.83 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.125 1.37 . . . . 5.2400000000000002 113.299 161.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.61 -38.82 64.96 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 120.716 -1.24 . . . . 1.55 112.003 176.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.94 -40.99 79.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 120.914 1.688 . . . . 1.75 110.385 166.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 97.1 mt -58.74 -49.04 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 118.867 0.758 . . . . 2.1299999999999999 112.103 171.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.8 t -61.38 -43.3 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.98 1.312 . . . . 1.6000000000000001 112.265 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -60.77 -44.01 97.32 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.825 1.193 . . . . 1.9399999999999999 110.778 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 55.5 t -63.38 -42.55 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 124.325 1.05 . . . . 1.6599999999999999 111.836 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -55.54 -47.75 75.81 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 119.972 1.26 . . . . 3.6000000000000001 110.514 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.9 -24.9 60.89 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 112.694 0.627 . . . . 2.5600000000000001 112.694 -168.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -74.02 -59.72 2.59 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.898 0.479 . . . . 3.2200000000000002 112.111 163.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -64.34 -32.68 74.39 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.6 -0.714 . . . . 3.0299999999999998 112.286 -165.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 37.4 pttt -54.84 -24.57 23.67 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.437 1.273 . . . . 2.98 114.437 175.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -77.39 -31.29 54.09 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 117.49 -1.243 . . . . 3.3100000000000001 112.963 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.486 1.37 0 CA-C-N 120.901 1.682 . . . . 2.7200000000000002 112.125 -179.056 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 3.2 pt . . . . . 0 CA--C 1.533 0.316 0 N-CA-C 108.62 -0.882 . . . . 4.3200000000000003 108.62 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 66.3 m -117.17 168.95 9.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.744 0.818 . . . . 3.6299999999999999 109.457 161.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.6 -16.96 2.77 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 116.02 1.859 . . . . 3.4700000000000002 116.02 175.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.9 p -59.59 -20.48 56.09 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 119.636 -1.915 . . . . 2.3500000000000001 114.455 165.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 23.6 m -78.88 -31.68 45.57 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 120.439 -1.413 . . . . 1.3100000000000001 112.983 170.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -61.05 -49.38 77.58 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.592 1.157 . . . . 3.4900000000000002 112.039 -178.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 1.2 ptt180 -55.58 -15.55 3.02 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.899 1.074 . . . . 3.52 113.899 173.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -106.03 -38.33 6.34 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 125.451 1.5 . . . . 2.73 112.525 -175.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.5 ttm -49.79 -44.39 49.0 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.247 1.019 . . . . 2.27 110.45 159.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 28.7 mt -65.04 -0.6 1.66 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 126.214 1.806 . . . . 1.8899999999999999 115.644 171.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -120.78 -14.71 8.5 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 125.452 1.501 . . . . 2.3500000000000001 114.046 174.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.86 -53.23 2.8 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.171 0.988 . . . . 2.46 113.47 175.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -85.69 -34.65 21.23 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 120.585 1.539 . . . . 2.79 112.545 177.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.22 47.38 0.9 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.753 1.221 . . . . 2.8300000000000001 111.595 179.284 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -89.69 -16.32 30.65 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 115.685 1.735 . . . . 1.6000000000000001 115.685 -160.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -97.82 -22.72 16.22 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 120.454 1.479 . . . . 2.23 113.278 -167.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 60.2 mtm -79.64 -19.38 49.26 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.672 -1.268 . . . . 3.4100000000000001 111.947 166.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 5.9 mp -63.28 125.54 24.46 Favored 'General case' 0 C--O 1.222 -0.358 0 O-C-N 121.399 -0.813 . . . . 3.1499999999999999 108.815 160.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 18.4 p -172.74 -68.72 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.996 -1.113 . . . . 4.3899999999999997 107.996 -161.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -66.14 139.52 58.15 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.723 0.773 . . . . 5.7000000000000002 109.392 155.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 37.8 m -68.0 -28.02 67.06 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.003 0.921 . . . . 3.4500000000000002 110.441 174.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.76 -32.02 58.45 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.544 1.069 . . . . 2.1400000000000001 112.953 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -64.78 -55.65 18.42 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.262 1.031 . . . . 3.73 111.522 -175.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 31.0 ttt-85 -71.74 -36.22 70.37 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.441 0.904 . . . . 5.4299999999999997 113.441 173.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -53.42 -42.88 67.5 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.829 1.65 . . . . 4.0700000000000003 111.859 172.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.66 -23.3 58.96 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.206 -1.378 . . . . 1.8200000000000001 114.521 174.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.4 -52.01 11.75 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.818 1.19 . . . . 1.75 111.799 167.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.42 -27.38 68.51 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 124.062 0.945 . . . . 2.5800000000000001 112.807 -175.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.1 mtmt -63.19 -31.21 72.3 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.345 -1.472 . . . . 4.8700000000000001 113.742 169.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 7.9 mt -76.25 -36.72 58.34 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.12 0.568 . . . . 2.04 111.209 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 34.8 mm -53.84 -58.81 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.046 1.339 . . . . 2.0899999999999999 110.099 175.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -59.06 -34.8 72.36 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.328 0.862 . . . . 2.3100000000000001 113.328 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -63.68 -36.6 84.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.54 1.136 . . . . 4.1399999999999997 112.205 173.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.67 -28.85 24.44 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.343 1.057 . . . . 3.1699999999999999 111.749 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -55.67 -55.51 31.32 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.252 1.021 . . . . 3.0099999999999998 110.264 163.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -56.52 -24.76 48.76 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.694 1.368 . . . . 2.73 114.694 176.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -103.6 -9.23 19.39 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 114.576 1.324 . . . . 2.3799999999999999 114.576 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -150.55 122.57 8.22 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 121.394 1.906 . . . . 4.6500000000000004 112.083 -177.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -100.42 153.1 19.62 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.289 0.635 . . . . 5.0099999999999998 110.315 153.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.56 -45.54 1.28 Allowed Glycine 0 CA--C 1.53 0.976 0 C-N-CA 126.876 2.179 . . . . 3.6099999999999999 115.489 168.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 23.6 mmt85 -84.47 154.19 22.9 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.352 1.461 . . . . 6.5599999999999996 111.89 -176.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.9 mm -131.67 129.2 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 126.236 1.814 . . . . 3.29 106.324 159.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 2.8 t -87.11 -174.2 4.79 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 112.779 0.659 . . . . 2.04 112.779 -177.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -89.82 -58.12 2.62 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 119.234 -2.166 . . . . 3.1099999999999999 110.029 163.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -54.53 -28.51 45.91 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.184 3.394 . . . . 3.1600000000000001 114.19 176.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -46.87 -59.93 2.76 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.148 1.379 . . . . 3.3100000000000001 111.287 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -52.0 -46.71 65.01 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.41 -0.806 . . . . 3.2999999999999998 111.498 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 -65.92 -42.65 89.84 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 119.009 -0.519 . . . . 0.66000000000000003 111.908 -174.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 11.2 t -70.5 -28.88 65.31 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 117.662 -1.161 . . . . 2.8700000000000001 112.262 174.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.7 mt -69.92 -40.97 75.25 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.801 1.182 . . . . 1.8200000000000001 112.106 172.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.5 mm -53.44 -37.19 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 CA-C-N 121.232 1.833 . . . . 1.77 111.989 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.22 -13.12 59.59 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 124.917 1.246 . . . . 0.56000000000000005 115.126 177.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -81.31 -19.61 66.33 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-N 119.535 1.668 . . . . 1.04 113.778 173.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.1 mp -100.39 -44.57 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 124.815 1.246 . . . . 2.3999999999999999 109.411 168.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.7 m -77.82 58.51 1.89 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.86 2.064 . . . . 1.8799999999999999 109.24 169.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -158.68 -58.54 0.01 OUTLIER Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.359 1.933 . . . . 1.3700000000000001 111.141 -172.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -61.66 -71.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.373 2.715 . . . . 1.9099999999999999 111.242 163.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 16.8 pt -76.38 -18.22 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 115.1 1.519 . . . . 2.5099999999999998 115.1 -170.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.0 -35.26 76.36 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.078 0.77 . . . . 2.52 113.078 -172.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -60.38 -38.49 84.08 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.918 -0.489 . . . . 7.1399999999999997 111.923 175.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.4 tt -71.67 -34.67 69.89 Favored 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 124.343 1.057 . . . . 2.7400000000000002 111.466 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 91.0 mt -47.16 -50.81 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 CA-C-N 119.83 1.195 . . . . 1.9199999999999999 110.098 172.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 13.3 t60 -63.86 -25.16 68.04 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.495 1.295 . . . . 2.04 114.495 -176.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -98.35 -27.0 14.3 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.769 1.168 . . . . 2.8300000000000001 113.17 176.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . 0.525 ' C ' ' H ' ' B' ' 202' ' ' GLN . 4.8 tp60 -72.0 -45.65 60.15 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 124.546 1.139 . . . . 2.6499999999999999 109.824 173.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -83.26 36.3 0.52 Allowed 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 124.374 2.035 . . . . 3.1200000000000001 110.969 175.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.525 ' H ' ' C ' ' B' ' 200' ' ' GLN . 0.9 OUTLIER -117.06 -52.79 2.5 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 112.803 -1.999 . . . . 2.3500000000000001 108.247 151.369 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 . . . . . 0 CA--C 1.543 0.71 0 C-N-CA 125.537 1.535 . . . . 6.54 114.814 -176.544 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 . . . . . 0 N--CA 1.472 0.636 0 N-CA-C 113.186 0.81 . . . . 3.4100000000000001 113.186 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p -71.51 168.12 18.23 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.952 0.901 . . . . 2.27 111.251 -169.874 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -61.2 -59.92 4.57 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-O 118.502 -0.761 . . . . 2.6800000000000002 109.941 169.287 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -46.64 -41.91 15.48 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.158 1.383 . . . . 1.8799999999999999 111.243 -178.168 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -70.78 -58.02 4.06 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 125.357 1.463 . . . . 2.6899999999999999 113.181 179.131 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -54.24 -26.54 29.26 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 120.622 1.556 . . . . 6.4400000000000004 113.438 168.341 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.75 -42.44 58.22 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 125.456 1.502 . . . . 1.6399999999999999 110.716 174.492 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.5 t -58.9 -38.24 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 120.144 1.338 . . . . 1.8300000000000001 110.754 165.501 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.5 mt -58.25 -48.78 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-O 117.481 -1.247 . . . . 1.97 111.183 168.664 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.8 t -60.77 -35.53 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 CA-C-N 121.029 1.74 . . . . 1.9299999999999999 113.085 178.39 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp -67.15 -48.66 67.36 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.042 -1.036 . . . . 1.8 111.775 170.384 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.1 t -57.59 -40.92 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 125.319 1.448 . . . . 1.8500000000000001 111.797 173.59 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -68.33 -47.87 66.38 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 126.991 2.116 . . . . 3.1499999999999999 111.154 -179.343 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -75.17 -5.27 43.5 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.8 1.037 . . . . 2.6699999999999999 113.8 -179.851 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -84.08 -60.01 2.23 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.272 -0.893 . . . . 3.8300000000000001 112.239 162.277 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -64.64 -30.88 71.91 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.075 -1.016 . . . . 2.96 113.575 -175.0 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -48.8 -34.11 11.73 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 114.277 1.214 . . . . 3.9100000000000001 114.277 167.633 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -95.42 -36.87 11.18 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.865 0.866 . . . . 3.6699999999999999 110.385 -176.012 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.8 t . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 114.244 1.201 . . . . 3.73 114.244 175.866 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 29.7 pt . . . . . 0 N--CA 1.467 0.398 0 N-CA-C 109.377 -0.601 . . . . 3.25 109.377 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.4 m -98.77 139.83 33.87 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.011 0.924 . . . . 2.5899999999999999 109.353 163.143 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -54.45 -31.04 54.68 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 122.861 1.315 . . . . 3.2400000000000002 113.28 -177.19 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.2 p -60.77 -24.22 65.6 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.864 1.666 . . . . 2.2000000000000002 114.615 173.723 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.5 m -80.78 -33.43 34.94 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.08 0.952 . . . . 1.49 112.425 174.691 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -59.98 -49.28 78.28 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.072 -1.018 . . . . 3.4100000000000001 111.309 178.232 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 24.5 ptt180 -58.97 -25.21 63.36 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.94 0.718 . . . . 3.04 112.94 176.159 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -88.08 -47.54 8.42 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 125.298 1.439 . . . . 2.5499999999999998 111.276 -178.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -45.77 -43.39 13.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.332 1.453 . . . . 1.77 111.43 167.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 44.5 mt -67.9 -4.26 12.32 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 115.474 1.657 . . . . 2.0699999999999998 115.474 175.252 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -98.22 -19.25 17.97 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.166 1.787 . . . . 2.7400000000000002 113.611 166.657 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.47 -57.1 2.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.371 1.468 . . . . 2.23 112.774 -178.669 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -79.2 -15.8 57.51 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.097 -1.002 . . . . 3.6699999999999999 111.849 -178.085 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -126.66 45.85 2.6 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 127.508 2.323 . . . . 2.8399999999999999 110.672 176.101 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -87.34 -16.41 35.11 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 116.057 1.873 . . . . 1.3700000000000001 116.057 -175.314 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -98.57 -17.84 18.46 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 121.402 1.91 . . . . 2.04 112.196 -175.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.0 tpp -77.03 -13.29 59.98 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.874 1.67 . . . . 2.5299999999999998 112.543 166.423 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.3 tp -72.97 89.85 1.45 Allowed 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 124.142 1.925 . . . . 4.6799999999999997 112.813 -173.648 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.6 t -82.38 71.94 9.44 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 112.999 -1.909 . . . . 4.6900000000000004 110.027 163.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.1 t70 82.26 159.78 0.14 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 127.627 2.371 . . . . 3.8700000000000001 116.266 165.114 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -28.21 -41.28 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 130.959 3.704 . . . . 2.98 114.475 159.371 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.91 -50.87 62.76 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-N 119.596 1.089 . . . . 1.8600000000000001 112.36 176.296 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -64.39 -32.21 73.74 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.892 -0.769 . . . . 4.1399999999999997 112.263 172.795 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -66.33 -50.47 63.49 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 120.104 1.32 . . . . 7.71 112.871 173.506 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.8 mmmt -49.26 -40.84 35.72 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 119.144 0.884 . . . . 6.0999999999999996 112.283 170.022 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.16 -18.72 59.59 Favored 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 115.622 1.712 . . . . 2.48 115.622 177.453 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -78.2 -52.87 8.03 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.797 0.839 . . . . 1.96 111.882 163.188 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -60.28 -29.41 68.79 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.888 2.075 . . . . 2.7200000000000002 113.433 -177.163 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 ptmm? -56.51 -32.03 64.66 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 120.763 -1.21 . . . . 4.4000000000000004 113.015 167.562 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.9 mt -67.38 -42.15 83.83 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.493 -0.754 . . . . 1.8 111.507 176.406 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.9 mm -57.79 -50.09 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.774 1.23 . . . . 2.1800000000000002 110.385 -173.013 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -67.31 -36.57 81.76 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.373 1.069 . . . . 2.29 112.621 -179.085 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -65.81 -28.44 69.0 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 112.747 0.647 . . . . 4.9000000000000004 112.747 172.628 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 tt -91.94 -21.72 20.41 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.409 1.083 . . . . 3.5699999999999998 113.121 -178.366 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -59.21 -19.1 42.56 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.014 1.116 . . . . 2.5699999999999998 114.014 162.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.66 -9.28 59.8 Favored 'General case' 0 CA--C 1.553 1.096 0 N-CA-C 115.26 1.578 . . . . 2.9300000000000002 115.26 164.849 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -148.13 59.22 1.1 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 120.547 1.521 . . . . 3.1600000000000001 114.048 -166.116 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.9 t60 -168.64 112.93 0.59 Allowed 'General case' 0 N--CA 1.48 1.029 0 O-C-N 120.11 -1.619 . . . . 5.2400000000000002 113.34 -173.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.93 30.38 0.17 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.276 2.23 . . . . 7.1600000000000001 113.864 -175.785 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.93 8.06 72.25 Favored Glycine 0 CA--C 1.537 1.424 0 O-C-N 120.07 -1.644 . . . . 3.3199999999999998 113.468 -169.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 10.8 mmt-85 -98.98 98.7 9.72 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 125.964 1.706 . . . . 5.7199999999999998 108.909 -178.148 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.5 mm -68.69 113.16 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 N-CA-C 105.729 -1.952 . . . . 2.8599999999999999 105.729 164.801 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.8 m -80.25 165.64 22.16 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.049 0.841 . . . . 1.9399999999999999 112.297 167.798 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -59.59 -48.75 80.42 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 122.508 1.147 . . . . 3.4199999999999999 110.407 161.607 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.1 -22.73 66.04 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.722 2.009 . . . . 2.8700000000000001 113.482 177.457 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -66.66 -50.13 63.95 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.304 0.957 . . . . 2.8100000000000001 111.098 174.968 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -56.09 -49.8 72.83 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 120.857 -1.152 . . . . 2.8700000000000001 111.694 173.314 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.1 t-105 -63.64 -47.99 79.1 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 121.69 -0.631 . . . . 0.57999999999999996 112.206 -176.095 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 t -67.04 -26.79 66.93 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.354 -0.831 . . . . 2.5499999999999998 111.978 -179.945 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.6 mt -72.43 -35.59 68.37 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.306 -1.331 . . . . 1.77 112.921 171.725 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.5 mm -57.47 -39.29 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 CA-C-N 121.605 2.002 . . . . 1.8799999999999999 111.912 178.271 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.5 -10.84 67.44 Favored Glycine 0 N--CA 1.475 1.298 0 C-N-CA 124.291 0.948 . . . . 0.73999999999999999 114.045 175.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.99 -17.91 66.34 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.792 1.187 . . . . 0.77000000000000002 113.562 176.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -104.09 -45.7 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.667 1.187 . . . . 2.1899999999999999 109.637 166.999 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 30.7 m -75.02 96.53 3.21 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.103 1.361 . . . . 1.75 109.042 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -168.97 -74.02 0.04 OUTLIER Glycine 0 CA--C 1.532 1.127 0 CA-C-O 118.44 -1.2 . . . . 1.24 113.481 -175.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -63.18 -45.81 11.5 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.652 2.235 . . . . 1.3100000000000001 111.531 179.325 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.1 pt -71.82 -13.53 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 114.019 1.118 . . . . 2.3599999999999999 114.019 176.013 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.78 -52.96 63.33 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.148 1.34 . . . . 2.1000000000000001 112.922 177.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -61.01 -33.56 73.45 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.423 -1.423 . . . . 3.8700000000000001 112.669 173.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.6 -45.55 86.48 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.478 0.711 . . . . 1.98 110.865 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.8 mt -49.77 -58.3 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.273 0.629 . . . . 1.78 110.277 168.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -73.16 -20.01 61.0 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.434 0.901 . . . . 2.9300000000000002 113.434 -169.643 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.287 4.0 pt-20 -88.07 -21.9 24.46 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.586 0.754 . . . . 2.6899999999999999 111.987 175.055 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.48 ' C ' ' H ' ' A' ' 99' ' ' GLN . 4.4 mm100 -79.96 -38.72 31.7 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 125.057 1.343 . . . . 2.7400000000000002 114.336 172.23 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.62 9.84 0.58 Allowed 'General case' 0 N--CA 1.487 1.391 0 CA-C-O 123.659 1.695 . . . . 2.5600000000000001 112.682 177.438 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.48 ' H ' ' C ' ' A' ' 97' ' ' GLN . 6.7 mm-40 . . . . . 0 C--N 1.327 -0.398 0 C-N-CA 126.827 2.051 . . . . 3.0 109.965 175.208 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 114.992 1.479 . . . . 3.3999999999999999 114.992 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.7 p -65.29 156.29 32.47 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.232 1.013 . . . . 1.95 110.252 -173.494 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . 0.444 ' CD ' ' HZ3' ' B' ' 113' ' ' LYS . 2.8 tp10 -58.25 -33.82 69.78 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 118.555 0.616 . . . . 2.3500000000000001 112.39 179.767 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 tt -67.57 -44.11 78.99 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.769 1.628 . . . . 1.96 110.605 177.956 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -72.83 -46.01 55.33 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.35 -0.844 . . . . 2.77 111.287 -178.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . 0.444 ' HZ3' ' CD ' ' B' ' 110' ' ' GLU . 8.5 tmtt? -53.05 -39.23 63.1 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.828 1.651 . . . . 5.9500000000000002 111.101 165.503 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.08 -44.85 78.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 120.686 -1.259 . . . . 1.76 112.73 173.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 75.7 t -55.4 -41.5 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 121.132 1.787 . . . . 1.7 110.608 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 91.1 mt -56.35 -48.33 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 119.322 0.965 . . . . 1.8400000000000001 111.465 170.583 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 37.7 t -65.01 -36.58 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 119.887 1.221 . . . . 1.72 113.3 178.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.99 -45.83 80.19 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.13 -0.981 . . . . 1.8500000000000001 110.783 172.602 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 48.2 t -62.49 -40.67 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.105 1.362 . . . . 1.9399999999999999 111.647 176.116 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -64.67 -49.07 72.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.462 1.505 . . . . 3.02 111.347 176.163 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -80.65 14.0 2.3 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.232 1.013 . . . . 2.8100000000000001 113.672 -179.052 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -108.31 -58.14 2.03 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.271 1.428 . . . . 3.4500000000000002 111.321 163.963 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -64.35 -27.46 69.04 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 120.71 -1.244 . . . . 3.02 113.506 -175.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 17.3 mtpt -45.98 -37.41 6.52 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.186 1.18 . . . . 3.6600000000000001 114.186 164.62 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -90.74 -34.6 15.3 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.956 1.302 . . . . 3.9300000000000002 111.258 -176.431 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 67.3 t . . . . . 0 N--CA 1.482 1.138 0 C-N-CA 124.93 1.292 . . . . 3.5699999999999998 113.485 175.233 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 14.4 pt . . . . . 0 N--CA 1.471 0.607 0 CA-C-O 121.334 0.588 . . . . 3.9399999999999999 111.993 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 51.5 m -93.45 138.66 31.54 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 108.621 -0.881 . . . . 2.6499999999999999 108.621 156.63 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . 0.428 ' HE2' ' CD2' ' B' ' 173' ' ' HIS . 78.5 mttt -55.03 -32.13 61.61 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 119.918 1.235 . . . . 3.1600000000000001 113.313 -173.762 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 50.1 p -64.82 -17.3 64.11 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.533 1.533 . . . . 2.21 114.798 176.078 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 43.4 m -85.8 -35.94 20.38 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.947 1.249 . . . . 1.3300000000000001 112.329 -179.608 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . 0.433 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 11.3 t80 -49.92 -54.14 21.59 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.542 1.137 . . . . 3.5800000000000001 111.047 173.756 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -62.11 -17.83 58.93 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.213 0.82 . . . . 2.8999999999999999 113.213 179.505 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -94.94 -43.83 7.99 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.671 1.588 . . . . 2.3100000000000001 112.516 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -49.39 -41.59 39.86 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.926 -1.109 . . . . 1.6899999999999999 110.483 162.275 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 17.2 mt -67.49 -8.25 32.11 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 116.389 1.996 . . . . 2.3300000000000001 116.389 171.073 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -93.88 -23.02 18.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.95 1.3 . . . . 2.6200000000000001 113.697 164.843 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.13 -60.99 1.43 Allowed 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.841 1.201 . . . . 2.5 113.54 -178.502 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -76.46 -10.68 59.57 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.619 -1.3 . . . . 3.1899999999999999 112.638 -174.573 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.88 31.75 5.24 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 128.012 2.525 . . . . 2.3599999999999999 111.678 175.142 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -69.16 -29.64 67.69 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.967 1.469 . . . . 1.28 114.967 -171.717 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -86.83 -24.98 24.77 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.391 0.996 . . . . 2.0299999999999998 111.416 -171.786 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 5.0 tpp -61.81 -17.54 56.57 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.189 0.996 . . . . 2.6800000000000002 112.719 167.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 16.8 tp -80.9 88.71 5.87 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 123.258 1.504 . . . . 3.8599999999999999 112.168 -169.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 40.2 t -71.27 65.37 0.41 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 113.825 -1.534 . . . . 4.8200000000000003 110.63 158.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 35.2 t70 95.38 156.09 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 129.37 3.068 . . . . 3.8500000000000001 115.936 166.761 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.6 m -34.16 -38.6 0.06 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 130.878 3.671 . . . . 2.9300000000000002 114.496 158.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -57.89 -43.49 94.79 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 120.1 1.318 . . . . 1.8999999999999999 111.748 176.131 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -68.93 -21.36 64.21 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 113.413 0.894 . . . . 4.1900000000000004 113.413 172.857 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -75.06 -45.45 41.41 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 121.182 1.81 . . . . 8.1799999999999997 112.741 167.617 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -53.18 -40.61 64.49 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.548 0.613 . . . . 4.71 111.419 175.367 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -51.85 -45.28 63.96 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.388 0.884 . . . . 2.4900000000000002 113.388 171.698 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -63.49 -38.65 91.96 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.175 0.99 . . . . 1.96 113.176 177.011 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -32.77 74.5 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.694 0.998 . . . . 2.4100000000000001 113.694 175.537 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -53.63 -40.95 66.23 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.423 1.01 . . . . 4.1900000000000004 111.795 173.138 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.38 -39.87 92.25 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.149 -0.932 . . . . 2.0099999999999998 111.416 179.202 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 24.8 mm -61.58 -46.92 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 123.887 0.875 . . . . 2.21 110.967 -178.107 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -69.29 -37.48 77.85 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.036 0.446 . . . . 2.8799999999999999 112.184 177.579 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 -64.61 -26.73 68.53 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 112.646 0.61 . . . . 4.71 112.646 176.706 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.55 -28.12 18.7 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.613 0.765 . . . . 3.5099999999999998 113.02 179.616 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.42 -37.95 40.55 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.715 0.806 . . . . 2.98 112.663 164.11 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -63.89 -10.67 22.14 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 115.5 1.667 . . . . 3.1299999999999999 115.5 173.681 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -131.46 6.54 4.45 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.86 1.43 . . . . 3.1000000000000001 114.86 -173.069 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . 0.428 ' CD2' ' HE2' ' B' ' 138' ' ' LYS . 8.2 t60 -156.99 114.92 3.2 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 116.121 1.897 . . . . 4.1500000000000004 116.121 -158.459 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.35 6.74 9.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 128.328 2.651 . . . . 5.4800000000000004 114.977 -170.137 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . 0.421 ' H ' ' CD2' ' B' ' 173' ' ' HIS . . . 92.04 10.94 60.66 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 125.689 1.614 . . . . 3.2000000000000002 112.952 -166.395 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -76.03 67.56 2.39 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.301 1.84 . . . . 7.0199999999999996 110.877 170.11 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 41.4 mm -52.7 133.65 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.431 1.092 . . . . 3.2400000000000002 110.483 175.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.74 164.99 16.49 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.094 1.758 . . . . 2.1299999999999999 110.678 -179.496 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -66.22 -43.21 87.34 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 122.171 0.986 . . . . 3.6000000000000001 111.534 169.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.15 -25.56 67.09 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.815 2.446 . . . . 3.0600000000000001 113.391 177.251 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -62.75 -59.68 4.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 118.76 0.709 . . . . 3.6800000000000002 110.269 175.525 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -52.82 -49.03 66.48 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.612 -0.68 . . . . 3.2400000000000002 110.653 178.327 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 21.0 t-105 -61.84 -48.48 80.38 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.447 0.536 . . . . 0.68999999999999995 112.447 -177.185 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.5 t -70.72 -27.15 63.76 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.078 -0.963 . . . . 2.5299999999999998 112.075 -179.279 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . 0.433 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 53.2 mt -72.99 -38.98 66.43 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 116.895 -1.526 . . . . 1.79 112.656 171.775 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 25.9 mm -52.96 -42.66 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 CA-C-N 121.683 2.038 . . . . 1.71 111.579 178.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.65 -14.32 64.79 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.556 1.074 . . . . 0.65000000000000002 114.688 177.305 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -79.27 -20.33 69.86 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 118.493 1.147 . . . . 0.75 112.916 176.289 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -101.36 -40.78 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 CA-C-N 118.317 1.058 . . . . 2.29 110.046 167.019 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 14.0 m -79.17 86.74 4.94 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.606 1.562 . . . . 1.8400000000000001 109.0 -178.724 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -164.21 -72.91 0.03 OUTLIER Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.39 1.472 . . . . 1.1699999999999999 113.204 -174.491 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -62.4 -45.69 14.16 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.999 2.466 . . . . 1.1200000000000001 111.913 178.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 21.0 pt -68.92 -17.7 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 113.889 1.07 . . . . 2.0 113.889 174.42 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -55.11 -56.23 22.24 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.216 1.371 . . . . 2.1400000000000001 113.629 -178.849 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -60.81 -35.02 75.44 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.685 -1.259 . . . . 4.1200000000000001 112.439 175.701 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 5.4 tt -61.48 -47.16 86.95 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.189 0.996 . . . . 2.29 110.249 178.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 45.9 mt -51.17 -59.83 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.386 1.074 . . . . 1.9299999999999999 110.835 171.545 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -71.13 -18.28 62.52 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.423 0.897 . . . . 2.9500000000000002 113.423 -174.264 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.328 5.0 pt-20 -85.39 -28.12 25.35 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.868 0.758 . . . . 2.8199999999999998 112.462 173.262 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . 0.414 ' C ' ' H ' ' B' ' 202' ' ' GLN . 6.3 mm100 -80.02 -35.43 37.31 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.059 1.344 . . . . 2.8399999999999999 114.579 174.407 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -72.6 8.75 1.31 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 123.527 1.632 . . . . 2.3399999999999999 112.266 176.325 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.414 ' H ' ' C ' ' B' ' 200' ' ' GLN . 6.9 mm-40 -125.41 -67.64 0.88 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 126.661 1.985 . . . . 3.4199999999999999 110.089 174.42 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 . . . . . 0 N--CA 1.48 1.064 0 C-N-CA 128.839 2.855 . . . . 5.3200000000000003 115.349 171.53 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 114.489 1.292 . . . . 3.9900000000000002 114.489 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 p -73.2 150.93 41.69 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.212 0.605 . . . . 1.98 110.362 -161.973 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -59.62 -34.19 72.45 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.59 1.086 . . . . 2.9300000000000002 113.507 -176.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.62 -56.86 13.9 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.161 -0.681 . . . . 2.48 109.161 172.066 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -62.58 -61.36 2.48 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 124.13 0.972 . . . . 3.04 110.318 -172.132 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -20.93 66.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.035 0.534 . . . . 6.0099999999999998 110.761 -172.597 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.13 -23.64 57.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 120.195 -1.566 . . . . 1.9299999999999999 113.541 172.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.8 t -57.09 -32.76 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.674 1.579 . . . . 1.8300000000000001 110.784 168.306 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.7 mt -56.08 -57.74 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 CA-C-N 118.661 0.664 . . . . 2.1299999999999999 109.869 167.542 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.1 t -55.7 -39.72 56.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 125.301 1.44 . . . . 2.21 112.377 -178.483 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 mp -67.13 -24.32 65.9 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.676 1.19 . . . . 1.8400000000000001 113.425 176.323 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.0 t -89.33 -45.9 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.824 0.738 . . . . 2.2200000000000002 111.537 175.692 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -45.94 -55.76 6.35 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.215 1.406 . . . . 3.3799999999999999 111.843 -178.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -47.5 -43.29 24.47 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.968 1.707 . . . . 3.25 114.515 178.705 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -81.83 -21.55 37.53 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.127 0.971 . . . . 3.2400000000000002 113.209 -174.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -85.77 -32.06 22.03 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.154 -0.966 . . . . 3.6600000000000001 112.454 165.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.8 tttp -50.39 -38.63 43.75 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.585 1.954 . . . . 5.1799999999999997 113.843 178.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -85.5 8.95 17.26 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.321 1.449 . . . . 3.4700000000000002 114.212 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.8 m . . . . . 0 N--CA 1.475 0.807 0 C-N-CA 125.541 1.536 . . . . 3.2400000000000002 110.37 178.006 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.8 pt . . . . . 0 N--CA 1.477 0.896 0 N-CA-C 110.01 -0.367 . . . . 3.3599999999999999 110.01 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.8 t -81.48 137.61 35.59 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.457 -1.402 . . . . 3.0699999999999998 108.285 157.026 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -58.47 -32.5 68.81 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.917 -1.114 . . . . 3.3799999999999999 110.986 170.219 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m -66.26 -18.68 65.5 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.849 1.659 . . . . 2.6499999999999999 114.182 170.052 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 53.2 m -69.21 -41.94 76.4 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.742 1.61 . . . . 1.4099999999999999 111.386 173.057 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -50.46 -50.42 52.41 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.664 1.186 . . . . 3.3500000000000001 113.009 -171.459 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -59.7 -25.66 64.96 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.835 1.654 . . . . 5.2000000000000002 113.757 178.586 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -98.96 -44.44 6.32 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 124.991 1.316 . . . . 2.7599999999999998 111.851 -175.641 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 17.9 ptm -57.42 -32.43 66.86 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.66 -1.275 . . . . 4.0499999999999998 111.848 169.514 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.3 mt -61.14 -14.1 22.4 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.388 1.625 . . . . 2.2599999999999998 115.388 166.109 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -109.44 -5.35 15.82 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 120.322 1.419 . . . . 3.2599999999999998 114.175 169.082 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.76 -74.72 0.5 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.74 1.155 . . . . 2.2000000000000002 109.824 166.445 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -59.1 -34.52 72.1 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.555 1.142 . . . . 3.3799999999999999 113.823 -177.284 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.18 9.47 34.12 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.243 1.572 . . . . 2.5 115.243 -173.583 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -48.16 -34.58 10.19 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.518 1.673 . . . . 1.3400000000000001 115.518 -172.181 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -62.01 -34.98 77.2 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.965 -1.085 . . . . 2.3199999999999998 112.931 -177.333 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.9 tpp -85.0 -3.04 58.63 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.949 1.7 . . . . 2.4700000000000002 112.871 -178.467 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.2 mp -96.61 112.32 24.12 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.182 1.393 . . . . 3.1200000000000001 111.351 -178.813 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 t -75.56 62.96 1.47 Allowed 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.418 -0.801 . . . . 4.9100000000000001 109.376 152.565 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.6 t70 38.29 -109.61 0.08 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.234 2.214 . . . . 7.1500000000000004 111.802 -166.661 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.84 -14.44 36.92 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 126.481 1.913 . . . . 3.2000000000000002 114.213 -173.896 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -63.85 -30.86 78.92 Favored Glycine 0 CA--C 1.533 1.166 0 CA-C-N 120.732 1.606 . . . . 3.1600000000000001 111.175 168.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -78.46 -75.65 0.22 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.16 0.584 . . . . 4.21 110.464 157.793 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.0 ttp-105 -51.91 -28.75 17.39 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 117.837 2.532 . . . . 6.3700000000000001 117.837 -161.816 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -53.69 -35.85 61.54 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 121.122 1.783 . . . . 4.5499999999999998 112.684 170.311 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.33 -26.37 68.4 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.796 1.406 . . . . 2.1200000000000001 114.796 172.888 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.33 -42.59 68.38 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.561 1.073 . . . . 1.8400000000000001 111.366 171.224 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -68.31 -29.67 68.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.747 1.219 . . . . 1.97 112.991 -175.778 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -48.69 -40.05 26.8 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.013 0.911 . . . . 4.1699999999999999 113.042 165.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.9 mt -78.55 -36.65 44.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.729 -1.123 . . . . 2.3399999999999999 111.672 -176.596 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.9 mm -54.68 -53.69 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 122.99 0.516 . . . . 2.2000000000000002 110.386 175.41 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -65.45 -34.42 78.25 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.284 0.846 . . . . 2.6400000000000001 113.284 -179.508 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -62.59 -29.22 70.44 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.312 1.045 . . . . 3.3999999999999999 112.584 176.201 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -88.56 -37.23 15.86 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.246 1.018 . . . . 3.7400000000000002 111.669 170.865 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.84 -24.43 67.74 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.914 -1.116 . . . . 3.3799999999999999 113.945 177.618 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.86 -11.99 21.9 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.927 1.455 . . . . 3.5600000000000001 114.927 169.823 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -160.31 -17.89 0.06 Allowed 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 118.609 2.818 . . . . 4.4000000000000004 118.609 -171.747 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -96.47 114.68 26.37 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 121.511 1.959 . . . . 5.3600000000000003 111.149 175.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -63.54 -18.27 63.67 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.943 2.497 . . . . 4.0499999999999998 115.631 -172.207 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 118.0 2.03 16.49 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.943 -0.921 . . . . 3.2000000000000002 113.269 -160.736 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -66.18 145.49 55.73 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.726 1.263 . . . . 5.25 110.057 137.731 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 13.6 mt -128.33 149.57 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 127.227 2.211 . . . . 3.6800000000000002 106.02 167.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.7 t -123.75 159.98 28.29 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 114.0 1.111 . . . . 2.21 114.0 -174.372 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -73.74 -30.56 62.89 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 120.49 -1.381 . . . . 3.5 113.647 -173.177 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -70.3 -25.61 63.41 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.169 1.388 . . . . 3.9399999999999999 112.739 168.882 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.5 tt0 -58.01 -58.19 9.5 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.276 1.03 . . . . 3.3500000000000001 111.33 -175.523 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -56.14 -46.86 79.09 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.963 -1.086 . . . . 3.3399999999999999 112.403 -176.287 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.8 t-105 -61.46 -45.94 92.16 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.856 -0.592 . . . . 0.71999999999999997 111.278 178.223 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -38.22 90.11 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.595 0.758 . . . . 2.5800000000000001 111.61 178.504 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.2 mt -60.75 -46.05 91.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 118.269 -0.872 . . . . 2.2000000000000002 111.754 174.782 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 31.0 mm -51.35 -40.56 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 CA-C-N 120.485 1.493 . . . . 1.78 112.872 -178.726 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.86 -16.81 57.35 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.079 0.847 . . . . 0.68000000000000005 114.452 177.151 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.4 -19.61 76.19 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 121.124 -1.221 . . . . 0.89000000000000001 113.358 172.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.8 mp -103.02 -48.67 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 118.695 1.248 . . . . 1.9399999999999999 109.879 171.083 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.6 m -72.44 53.76 0.31 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.587 2.355 . . . . 2.4300000000000002 110.077 163.634 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -127.46 -71.46 0.17 Allowed Glycine 0 CA--C 1.528 0.886 0 C-N-CA 128.422 2.915 . . . . 1.02 107.998 172.111 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.9 -52.3 0.7 Allowed 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.441 2.76 . . . . 1.0800000000000001 113.484 175.844 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -72.29 -18.95 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 119.632 1.105 . . . . 2.1699999999999999 113.716 -173.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -51.15 -59.63 3.98 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.191 1.397 . . . . 1.6399999999999999 112.325 -178.522 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -56.09 -45.29 79.43 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.477 0.547 . . . . 3.3500000000000001 112.477 175.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -56.97 -42.65 80.54 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 125.094 1.358 . . . . 2.1899999999999999 111.286 -174.704 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.2 mt -54.95 -55.92 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.776 0.83 . . . . 3.0099999999999998 110.756 176.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -63.43 -37.39 87.09 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.446 -0.784 . . . . 2.3500000000000001 112.189 -179.568 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -66.37 -32.57 74.04 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.004 0.921 . . . . 3.1099999999999999 110.932 177.117 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -69.97 -40.44 75.37 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 117.496 -1.24 . . . . 2.96 113.414 170.456 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -59.33 -41.5 89.29 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.2 1.364 . . . . 2.7400000000000002 111.432 177.578 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.715 0 O-C-N 121.456 -0.778 . . . . 3.27 111.01 179.194 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 112.501 0.556 . . . . 3.8700000000000001 112.501 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 3.1 p -74.3 152.08 39.71 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.434 0.294 . . . . 1.75 111.059 -160.06 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -60.1 -21.96 62.16 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.218 1.192 . . . . 2.3799999999999999 114.218 -177.61 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 tt -80.56 -48.04 13.31 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.767 0.827 . . . . 2.6299999999999999 110.183 171.614 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -67.36 -58.48 4.7 Favored 'General case' 0 C--N 1.333 -0.131 0 C-N-CA 123.404 0.682 . . . . 2.9199999999999999 111.036 -175.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -20.1 56.75 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.152 0.981 . . . . 5.5 112.072 -176.689 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.3 -34.33 74.52 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.321 -1.487 . . . . 1.76 113.425 170.183 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 58.6 t -58.02 -32.9 44.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.254 0.934 . . . . 1.6899999999999999 110.905 175.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 44.0 mt -55.92 -57.66 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 109.079 -0.711 . . . . 2.2599999999999998 109.079 168.735 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 72.3 t -60.74 -36.54 71.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 125.756 1.622 . . . . 2.2200000000000002 112.932 -176.251 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.65 -38.57 84.02 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.641 -0.662 . . . . 1.99 112.135 175.121 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 60.2 t -76.32 -39.05 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-N 118.503 0.592 . . . . 2.0600000000000001 110.955 178.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -51.93 -45.88 64.48 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.868 1.667 . . . . 2.7999999999999998 111.36 175.562 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -58.97 -33.77 71.04 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.362 1.465 . . . . 3.3300000000000001 114.405 175.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -80.82 -43.78 19.51 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.656 0.662 . . . . 3.3799999999999999 112.311 -179.541 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -72.3 -27.31 62.37 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.406 -0.809 . . . . 3.6200000000000001 112.654 176.452 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -42.2 -43.74 3.49 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.179 1.792 . . . . 4.4000000000000004 114.128 171.432 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 -97.77 18.67 15.18 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.132 1.373 . . . . 3.6000000000000001 113.732 -172.159 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 34.9 m . . . . . 0 N--CA 1.479 0.996 0 C-N-CA 126.152 1.781 . . . . 2.9900000000000002 110.278 178.224 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 43.3 pt . . . . . 0 N--CA 1.482 1.135 0 N-CA-C 110.325 -0.25 . . . . 3.5 110.325 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 33.7 t -85.52 136.55 33.37 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.595 -1.316 . . . . 2.98 108.703 157.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 17.5 ttpt -59.47 -30.72 68.73 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.97 -1.081 . . . . 3.4199999999999999 111.628 174.638 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 1.7 m -67.62 -18.59 65.02 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.918 1.687 . . . . 2.5899999999999999 113.879 171.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.6 m -70.59 -40.78 73.05 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 120.29 1.405 . . . . 1.3600000000000001 112.316 175.168 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -51.21 -53.55 34.04 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.646 1.179 . . . . 3.4199999999999999 113.12 -173.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -54.75 -22.43 14.09 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.074 1.75 . . . . 5.3700000000000001 114.076 178.254 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -106.46 -38.24 6.25 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.999 1.32 . . . . 3.2599999999999998 113.064 -176.268 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -47.31 -43.16 22.4 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.778 1.231 . . . . 2.0099999999999998 110.847 161.613 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 25.5 mt -63.26 -12.1 26.48 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 116.174 1.916 . . . . 2.27 116.174 171.578 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -113.98 -8.13 13.09 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.106 1.521 . . . . 3.4500000000000002 115.106 167.672 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -76.41 0.44 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.363 0.983 . . . . 2.1600000000000001 110.015 167.225 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -58.92 -36.3 74.52 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.525 1.511 . . . . 3.5800000000000001 114.4 -178.856 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.25 9.5 43.26 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 115.359 1.614 . . . . 2.6099999999999999 115.359 -174.35 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -47.17 -33.62 5.43 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.197 1.925 . . . . 1.3899999999999999 116.197 -170.522 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -65.07 -35.38 80.98 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.942 1.246 . . . . 2.3599999999999999 113.341 -175.5 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 18.3 tpp -78.99 -8.76 59.2 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.304 1.442 . . . . 2.4700000000000002 113.142 -177.09 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.5 mp -92.34 114.43 26.98 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 120.58 -1.325 . . . . 3.1299999999999999 112.522 -172.185 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 29.8 t -73.93 60.75 0.76 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 115.784 -0.644 . . . . 4.9100000000000001 109.533 154.059 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 35.3 t70 36.86 -107.64 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.832 2.053 . . . . 6.7699999999999996 112.007 -165.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.04 -17.92 26.91 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 126.805 2.042 . . . . 3.29 113.853 -174.189 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -62.55 -29.33 73.23 Favored Glycine 0 N--CA 1.473 1.164 0 CA-C-N 120.908 1.685 . . . . 3.2400000000000002 111.259 169.614 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -81.18 -74.57 0.32 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.896 0.878 . . . . 3.9300000000000002 110.95 160.492 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 25.8 ttp-105 -53.69 -27.86 30.29 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 117.67 2.47 . . . . 6.3300000000000001 117.67 -164.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -54.12 -37.46 64.37 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 121.344 1.884 . . . . 4.5199999999999996 112.454 171.905 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.63 -26.54 63.83 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.747 1.388 . . . . 2.04 114.747 172.329 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.44 -43.24 50.72 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.895 1.278 . . . . 1.98 111.37 174.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.64 -28.35 67.65 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.678 1.191 . . . . 1.8899999999999999 112.354 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -50.24 -39.47 44.77 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 122.068 0.937 . . . . 4.1500000000000004 112.923 165.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 9.5 mt -77.21 -35.49 55.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.755 -1.111 . . . . 2.27 111.819 -174.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 37.7 mm -56.09 -52.14 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 122.781 0.432 . . . . 2.1099999999999999 110.208 176.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -65.42 -34.12 77.55 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.14 0.793 . . . . 2.5800000000000001 113.14 -179.633 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -62.3 -29.25 70.3 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.05 0.94 . . . . 3.3900000000000001 112.455 176.419 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -90.04 -34.76 15.83 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.513 1.125 . . . . 3.7999999999999998 111.654 171.606 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.28 -22.4 66.94 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.517 -1.364 . . . . 3.4199999999999999 114.135 175.319 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.34 -11.59 43.49 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.031 1.493 . . . . 3.46 115.031 168.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -162.05 -15.27 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.19 0 N-CA-C 119.097 2.999 . . . . 4.3399999999999999 119.097 -170.648 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -101.23 116.2 32.26 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.986 2.175 . . . . 5.5300000000000002 110.935 175.601 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -68.51 -11.5 59.94 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 128.406 2.682 . . . . 3.9199999999999999 116.732 -166.546 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 110.89 0.15 28.72 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-O 118.694 -1.059 . . . . 3.1099999999999999 113.283 -160.396 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -67.15 144.76 55.85 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 119.199 1.499 . . . . 5.3899999999999997 109.612 136.916 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 13.3 mt -129.89 146.16 34.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 C-N-CA 126.666 1.986 . . . . 3.9500000000000002 106.137 167.126 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.4 t -106.32 177.74 4.77 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.293 1.037 . . . . 2.0699999999999998 113.658 -176.895 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -80.81 -48.94 11.73 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.029 -1.045 . . . . 3.1499999999999999 111.954 171.53 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -64.35 -27.58 69.12 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.734 1.613 . . . . 3.71 112.451 176.726 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -54.4 -54.11 45.06 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.363 0.665 . . . . 3.3300000000000001 110.938 173.62 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -62.61 -47.16 84.99 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.801 -1.187 . . . . 3.71 112.324 -175.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 49.0 t-105 -60.58 -46.99 88.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 119.182 -0.437 . . . . 0.68999999999999995 111.228 178.236 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.99 -31.94 69.88 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.725 -0.655 . . . . 2.5 112.105 -178.469 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 28.2 mt -60.46 -47.86 84.27 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.129 0.877 . . . . 1.96 111.459 171.164 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.9 mm -53.15 -37.71 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 120.188 1.358 . . . . 2.0600000000000001 112.592 179.27 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -59.42 -19.86 48.94 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 118.925 0.784 . . . . 0.67000000000000004 113.898 175.216 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.33 -19.96 79.17 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-N 118.545 1.173 . . . . 0.87 113.846 173.239 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -106.06 -35.43 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.484 1.642 . . . . 1.9299999999999999 110.977 173.495 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 40.7 m -72.75 65.35 0.7 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.537 1.935 . . . . 2.3799999999999999 109.445 167.155 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -150.51 -78.87 0.02 OUTLIER Glycine 0 CA--C 1.529 0.929 0 C-N-CA 126.088 1.804 . . . . 1.1699999999999999 111.329 -174.711 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -63.26 -46.51 9.79 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.129 2.553 . . . . 1.28 112.446 179.288 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 5.8 pt -75.93 -23.34 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 N-CA-C 113.447 0.906 . . . . 2.3199999999999998 113.447 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -53.73 -56.67 15.36 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.475 1.11 . . . . 1.6599999999999999 112.173 -173.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -57.62 -46.5 84.02 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.88 0.696 . . . . 3.5099999999999998 112.88 174.61 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.4 tt -57.78 -40.35 79.62 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 125.351 1.461 . . . . 2.3700000000000001 111.304 -173.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 20.1 mt -56.21 -57.81 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.269 1.028 . . . . 3.1299999999999999 110.345 175.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -60.76 -36.83 79.93 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.522 -0.736 . . . . 2.3100000000000001 112.088 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -67.33 -33.49 75.36 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.7 0.8 . . . . 3.21 110.766 177.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -68.72 -40.72 79.79 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.123 1.369 . . . . 2.9700000000000002 113.019 171.873 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -61.23 -37.34 82.68 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 120.256 1.389 . . . . 2.6699999999999999 111.644 178.396 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.44 -41.8 84.15 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.624 -0.672 . . . . 3.1299999999999999 110.889 178.021 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 . . . . . 0 CA--C 1.541 0.617 0 CA-C-N 114.545 -1.207 . . . . 5.8399999999999999 112.616 177.082 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 110.096 -0.335 . . . . 3.5600000000000001 110.096 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.8 p -106.6 162.04 14.1 Favored 'General case' 0 N--CA 1.485 1.32 0 O-C-N 121.284 -0.885 . . . . 1.6699999999999999 111.089 167.762 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -70.27 -23.37 62.87 Favored 'General case' 0 C--O 1.22 -0.458 0 O-C-N 121.47 -0.769 . . . . 2.9100000000000001 112.98 172.876 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -40.79 97.76 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.903 1.683 . . . . 1.8899999999999999 108.788 172.374 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -67.98 -63.85 0.98 Allowed 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 125.151 1.38 . . . . 2.6000000000000001 111.641 178.016 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -50.81 -27.75 7.94 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.012 1.733 . . . . 6.4100000000000001 114.05 170.827 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.34 -45.08 66.87 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 119.938 -1.726 . . . . 1.8 113.204 167.789 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 67.3 t -59.24 -32.81 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-N 121.046 1.748 . . . . 1.9399999999999999 110.86 170.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.6 mt -59.0 -60.14 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.362 -1.304 . . . . 1.8400000000000001 110.503 165.086 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.5 t -56.08 -33.9 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 126.218 1.807 . . . . 1.99 113.056 -176.439 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.75 -39.56 91.2 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.32 -0.863 . . . . 2.25 111.605 171.068 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 71.1 t -73.23 -40.35 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.657 1.183 . . . . 1.9299999999999999 111.545 174.198 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -54.85 -46.01 74.61 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.184 1.356 . . . . 5.6699999999999999 109.977 171.426 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -76.41 -24.05 54.04 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.143 1.164 . . . . 2.04 114.143 -177.193 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -75.32 -45.75 37.63 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.144 -1.598 . . . . 4.04 110.921 167.62 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -71.52 -21.17 61.95 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.718 1.007 . . . . 4.1600000000000001 113.718 -172.795 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -48.64 -20.08 0.42 Allowed 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 114.512 1.301 . . . . 5.04 114.512 169.172 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -100.56 -6.23 25.66 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.935 1.694 . . . . 4.1200000000000001 115.336 -179.364 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.481 1.105 0 CA-C-N 119.804 1.184 . . . . 3.9500000000000002 111.93 -175.316 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 12.1 pt . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 112.063 0.394 . . . . 3.8399999999999999 112.063 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.5 m -121.71 135.66 54.95 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.2 -0.938 . . . . 3.2200000000000002 111.037 -179.728 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -62.8 -32.73 73.97 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.078 -1.014 . . . . 3.6499999999999999 111.947 -178.771 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 m -57.34 -19.42 22.58 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.418 1.887 . . . . 2.96 115.109 169.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.7 m -82.81 -30.18 28.98 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.177 0.899 . . . . 1.8600000000000001 112.905 178.119 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.4 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 36.6 t80 -57.22 -47.88 80.21 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.533 1.515 . . . . 3.3399999999999999 112.317 -176.831 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -57.8 -23.09 50.84 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.086 1.354 . . . . 2.9399999999999999 114.215 174.435 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -100.18 -37.18 9.04 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.264 1.425 . . . . 3.2400000000000002 112.259 -175.474 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 3.5 ttm -48.32 -44.76 34.4 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.355 -1.466 . . . . 1.8799999999999999 110.283 157.539 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 26.3 mt -64.82 -33.33 75.74 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 114.827 1.417 . . . . 2.04 114.827 175.656 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -87.68 -11.55 48.02 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 120.358 1.436 . . . . 2.9500000000000002 114.028 -178.769 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.89 -64.2 1.08 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 126.388 1.875 . . . . 3.9100000000000001 111.691 173.514 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -74.52 -22.56 58.98 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 118.099 -0.953 . . . . 3.79 113.489 -173.377 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 24.2 mt -113.63 31.82 6.24 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.73 1.212 . . . . 3.3500000000000001 112.707 165.771 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -55.69 -31.1 62.14 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.348 -1.47 . . . . 1.6000000000000001 114.247 -175.404 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -78.55 -49.45 13.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.666 0.786 . . . . 2.1800000000000002 109.893 -168.703 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.4 mtm -79.35 -18.68 51.97 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.939 1.088 . . . . 3.4199999999999999 113.939 174.842 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mp -65.25 -48.99 71.35 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 120.208 1.367 . . . . 4.0099999999999998 110.355 161.45 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.6 m 73.81 -40.71 0.47 Allowed 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.684 1.994 . . . . 4.4400000000000004 114.623 168.427 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -157.47 161.49 38.88 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 123.845 1.783 . . . . 4.2000000000000002 112.614 -179.031 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -33.05 -44.77 0.12 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 130.605 3.562 . . . . 3.5499999999999998 114.445 163.194 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -67.46 -47.22 64.08 Favored Glycine 0 N--CA 1.468 0.777 0 C-N-CA 124.657 1.122 . . . . 2.4500000000000002 112.469 -174.943 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -65.22 -38.93 91.97 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 117.58 0.69 . . . . 2.7999999999999998 111.334 173.26 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.7 ttt-85 -58.28 -24.35 59.2 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.981 -1.074 . . . . 5.6799999999999997 113.392 177.77 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -57.16 -35.65 69.8 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.793 -1.192 . . . . 4.1500000000000004 112.927 170.648 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.42 -14.66 63.16 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.524 1.305 . . . . 2.0299999999999998 114.524 176.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.66 -54.14 4.91 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.698 1.199 . . . . 2.0099999999999998 111.872 165.288 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.14 -32.15 73.61 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.167 0.587 . . . . 2.02 112.402 -176.498 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -57.21 -30.14 64.3 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.223 -0.923 . . . . 3.4500000000000002 112.905 172.746 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.6 mt -75.41 -37.24 60.57 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.857 -0.527 . . . . 2.04 111.517 177.254 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.9 mm -56.54 -50.54 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 123.378 0.671 . . . . 2.1800000000000002 110.495 -177.764 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -64.28 -41.78 96.73 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.364 1.066 . . . . 2.4399999999999999 112.969 179.039 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -59.5 -32.5 70.35 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.107 1.363 . . . . 3.0499999999999998 112.6 174.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.42 -31.29 20.13 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.792 1.237 . . . . 3.3799999999999999 110.961 175.601 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.18 -35.3 79.85 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.702 1.601 . . . . 3.8300000000000001 114.528 -177.55 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.39 -10.6 3.31 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 114.432 1.271 . . . . 3.3799999999999999 114.432 171.357 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -131.14 -10.91 3.73 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.98 1.844 . . . . 3.3100000000000001 115.98 -167.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.84 134.89 11.11 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 121.803 2.092 . . . . 4.3799999999999999 114.674 -160.049 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -74.41 12.65 0.72 Allowed 'General case' 0 N--CA 1.479 0.976 0 O-C-N 120.172 -1.58 . . . . 5.1699999999999999 112.817 167.974 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.84 49.8 16.13 Favored Glycine 0 C--N 1.339 0.706 0 C-N-CA 124.474 1.035 . . . . 5.7300000000000004 111.07 -172.5 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.1 mmt85 -65.88 85.25 0.08 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 105.65 -1.982 . . . . 7.0499999999999998 105.65 159.784 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 9.3 mm -69.85 86.91 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 108.384 -0.969 . . . . 3.48 108.384 -173.021 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.4 m -66.61 159.26 27.9 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.141 0.976 . . . . 2.4300000000000002 110.315 171.776 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -51.76 -42.87 62.7 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 122.276 1.036 . . . . 4.0 110.873 171.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -74.98 -20.22 59.76 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 131.288 3.835 . . . . 3.6200000000000001 114.872 173.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -68.27 -55.04 13.56 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 122.003 2.183 . . . . 3.79 107.243 167.439 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -57.92 -52.45 65.43 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.049 -1.032 . . . . 2.77 112.712 176.657 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -64.25 -41.24 97.05 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.266 -0.897 . . . . 0.89000000000000001 113.065 -176.697 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.59 -37.37 73.9 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.19 0.904 . . . . 2.7200000000000002 111.054 177.652 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 64.6 mt -66.03 -40.32 90.95 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 117.947 -1.025 . . . . 2.1499999999999999 112.289 177.325 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 36.7 mm -56.46 -34.27 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-N 121.417 1.917 . . . . 1.8899999999999999 112.303 177.502 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -73.81 -1.88 59.84 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.247 1.403 . . . . 1.1499999999999999 114.917 176.178 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.72 -28.21 19.58 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-N 118.715 1.257 . . . . 0.67000000000000004 114.211 173.086 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -93.68 -40.23 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-N 118.417 1.109 . . . . 2.0800000000000001 110.104 172.724 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 11.5 m -75.65 124.58 27.48 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.357 1.463 . . . . 2.0699999999999998 108.415 176.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 139.25 -70.66 0.46 Allowed Glycine 0 N--CA 1.472 1.047 0 CA-C-O 117.918 -1.49 . . . . 1.8600000000000001 113.21 -176.023 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -59.87 -45.58 23.88 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.021 2.481 . . . . 1.1899999999999999 111.677 178.276 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -84.97 -5.46 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 113.403 0.89 . . . . 2.3100000000000001 113.403 175.225 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.05 81.9 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.815 1.188 . . . . 2.0899999999999999 112.711 -174.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -65.91 -36.62 83.9 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.106 -0.996 . . . . 4.3499999999999996 113.564 174.131 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -60.5 -38.64 84.96 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 117.87 -1.062 . . . . 2.8300000000000001 110.385 177.061 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.7 mt -49.25 -65.52 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 123.63 0.772 . . . . 2.21 111.133 170.247 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -61.72 -33.59 74.29 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.903 -0.498 . . . . 2.6000000000000001 111.994 -175.115 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.308 2.8 pt-20 -86.97 -9.91 54.46 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 119.029 -0.51 . . . . 3.23 112.244 -176.048 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.445 ' C ' ' H ' ' A' ' 99' ' ' GLN . 0.2 OUTLIER -78.05 -36.11 48.79 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.025 1.73 . . . . 3.0299999999999998 113.16 163.525 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -71.08 8.11 1.04 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 124.026 1.869 . . . . 2.4500000000000002 112.208 174.326 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.445 ' H ' ' C ' ' A' ' 97' ' ' GLN . 15.0 mm-40 . . . . . 0 C--N 1.324 -0.538 0 C-N-CA 127.007 2.123 . . . . 3.3999999999999999 109.515 176.501 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.522 0.201 . . . . 3.6099999999999999 110.49 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.2 p -104.93 158.44 16.54 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.968 0.907 . . . . 1.8100000000000001 110.662 169.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -68.54 -25.27 64.84 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 118.945 0.793 . . . . 3.1499999999999999 112.366 175.544 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.03 -40.9 99.12 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 120.48 1.491 . . . . 1.79 108.895 172.784 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -67.58 -63.04 1.14 Allowed 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.788 1.235 . . . . 2.6200000000000001 111.781 177.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 36.7 tptt -49.9 -28.97 7.35 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 121.022 1.737 . . . . 7.1799999999999997 114.104 169.472 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.41 -46.46 66.81 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 119.69 -1.881 . . . . 1.8 113.237 167.536 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 85.9 t -56.9 -33.95 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 CA-C-N 121.626 2.012 . . . . 2.0299999999999998 110.868 170.37 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 17.7 mt -59.01 -61.08 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-O 117.684 -1.151 . . . . 1.9299999999999999 110.91 166.111 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 10.6 t -55.75 -35.83 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 126.444 1.898 . . . . 2.1400000000000001 112.519 -176.088 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.2 mp -63.35 -36.71 84.59 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.441 -0.787 . . . . 2.1099999999999999 111.323 173.088 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.8 t -80.3 -37.95 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 125.344 1.458 . . . . 2.23 111.768 176.083 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -53.4 -45.85 69.47 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.104 1.32 . . . . 5.5599999999999996 110.399 169.634 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -72.36 -18.24 61.77 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.088 1.144 . . . . 2.0099999999999998 114.088 -178.624 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -80.71 -48.13 13.0 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 120.338 -1.476 . . . . 3.4900000000000002 111.146 167.26 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -71.34 -20.76 62.13 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.262 0.838 . . . . 3.8399999999999999 113.262 -167.497 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -46.73 -19.71 0.1 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.49 1.516 . . . . 4.96 114.504 164.169 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -107.52 5.73 27.39 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.384 1.874 . . . . 4.0199999999999996 115.429 -178.513 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.48 1.026 0 CA-C-N 119.972 1.26 . . . . 3.2200000000000002 111.291 179.287 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 9.7 pt . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 113.058 0.762 . . . . 4.0800000000000001 113.058 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 42.8 t -135.56 132.99 37.88 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.83 1.652 . . . . 3.3799999999999999 109.384 175.303 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -62.12 -18.38 60.67 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.217 1.007 . . . . 3.3799999999999999 112.999 177.352 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.4 m -70.69 -17.99 62.83 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.797 1.639 . . . . 2.8900000000000001 114.333 170.298 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 9.1 m -89.9 -19.51 24.48 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.957 1.095 . . . . 2.8599999999999999 113.957 177.556 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . 0.411 ' CZ ' HD13 ' B' ' 145' ' ' LEU . 59.5 t80 -53.89 -52.55 60.14 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 120.888 1.676 . . . . 3.7000000000000002 111.072 177.811 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 33.8 ptt180 -57.48 -24.65 57.05 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.722 1.609 . . . . 3.1400000000000001 114.468 174.283 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -100.95 -38.36 8.24 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.931 1.692 . . . . 3.5299999999999998 111.722 -168.813 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 6.3 tmm? -47.88 -43.93 29.04 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.393 -1.442 . . . . 1.75 110.969 152.726 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . 0.411 HD13 ' CZ ' ' B' ' 141' ' ' PHE . 93.9 mt -74.34 -24.75 59.24 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.769 1.396 . . . . 2.1600000000000001 114.769 178.095 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -83.64 -16.82 43.72 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.827 1.649 . . . . 2.7999999999999998 113.518 173.579 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -100.84 -63.61 1.12 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.928 1.691 . . . . 3.98 113.131 176.066 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -74.66 -17.08 60.74 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 119.434 1.015 . . . . 3.73 113.552 -173.252 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 46.0 mt -117.2 30.55 7.25 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.827 1.651 . . . . 3.1899999999999999 112.441 165.447 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -57.25 -28.72 63.19 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.231 -1.543 . . . . 1.6599999999999999 113.525 -176.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -76.95 -51.59 10.91 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.446 -0.784 . . . . 2.2200000000000002 109.374 -168.819 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 24.4 mtm -76.65 -17.32 59.22 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.943 1.09 . . . . 3.5099999999999998 113.943 174.391 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.3 mp -66.7 -51.14 59.43 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.172 1.351 . . . . 3.96 110.396 162.315 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 14.2 m 73.63 -48.92 0.68 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.754 2.022 . . . . 4.4000000000000004 113.733 171.436 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -145.01 162.75 36.16 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 123.884 1.802 . . . . 4.4299999999999997 113.409 175.69 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -32.79 -42.88 0.08 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 131.094 3.758 . . . . 3.7200000000000002 114.32 161.064 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -66.82 -34.1 86.19 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 124.399 1.0 . . . . 2.5600000000000001 113.336 -179.198 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -76.98 -41.83 41.38 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 117.818 0.809 . . . . 2.7599999999999998 111.068 172.708 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 10.2 ttt180 -51.15 -30.1 15.65 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 120.604 -1.31 . . . . 5.8899999999999997 114.017 174.156 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -50.86 -37.54 43.93 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.633 -1.292 . . . . 4.7599999999999998 112.5 173.014 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -71.78 -14.24 61.93 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 114.979 1.474 . . . . 2.0699999999999998 114.979 178.451 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.06 -52.73 6.06 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.374 0.988 . . . . 1.96 111.214 163.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -30.81 70.9 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.508 0.723 . . . . 1.96 111.858 -172.501 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -54.06 -33.01 56.34 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.297 -0.877 . . . . 3.4500000000000002 112.875 169.579 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 18.0 mt -77.21 -36.26 54.93 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 121.733 -0.604 . . . . 2.0899999999999999 111.339 -177.721 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 40.8 mm -55.51 -55.84 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 124.079 0.952 . . . . 2.1800000000000002 109.486 177.864 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -62.3 -34.99 77.66 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.183 0.808 . . . . 2.4900000000000002 113.183 -178.19 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -38.61 91.5 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.045 1.338 . . . . 3.6699999999999999 113.044 172.975 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.43 -35.89 18.02 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.431 1.093 . . . . 3.3100000000000001 110.674 -175.345 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -55.95 -40.75 73.65 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.85 1.26 . . . . 3.23 114.33 -175.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.61 -11.57 5.1 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 114.833 1.419 . . . . 2.9500000000000002 114.833 173.212 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -130.04 3.99 4.85 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.734 1.383 . . . . 3.0299999999999998 114.734 -168.91 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -152.14 102.52 2.8 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.216 -1.552 . . . . 4.2400000000000002 111.707 -167.882 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -78.8 69.59 5.0 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.707 2.003 . . . . 3.8100000000000001 112.952 -167.163 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 78.45 -11.43 24.97 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.946 1.736 . . . . 4.0700000000000003 114.588 175.066 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.51 162.84 3.51 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.231 1.812 . . . . 6.8899999999999997 111.297 176.631 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 17.8 mm -133.49 129.5 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.773 1.629 . . . . 4.1699999999999999 106.671 164.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.7 m -127.92 157.38 40.71 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.09 1.356 . . . . 4.0199999999999996 112.856 -170.033 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -68.35 -46.49 70.01 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.266 -0.897 . . . . 3.8700000000000001 113.176 -171.562 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -73.65 -35.18 65.23 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.59 2.356 . . . . 3.7999999999999998 111.739 178.087 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -55.55 -58.55 7.32 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.361 1.064 . . . . 3.0600000000000001 110.272 167.258 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -49.6 -51.03 40.26 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.569 -0.707 . . . . 3.6000000000000001 111.565 177.112 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 40.0 t-105 -66.88 -46.42 75.0 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.621 -0.674 . . . . 1.0 112.775 -177.767 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -69.04 -35.23 76.36 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.177 0.991 . . . . 2.6499999999999999 111.27 -176.267 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.1 mt -64.05 -37.87 89.0 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 118.152 -0.928 . . . . 2.0299999999999998 112.194 173.594 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 41.6 mm -57.08 -35.75 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 121.425 1.921 . . . . 1.9399999999999999 111.953 174.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -72.17 1.12 35.4 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 124.974 1.273 . . . . 1.1299999999999999 114.48 174.46 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -96.81 -30.27 7.65 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.289 1.424 . . . . 0.71999999999999997 114.654 173.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -87.51 -44.23 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 118.925 1.363 . . . . 2.0800000000000001 109.777 170.289 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.72 145.0 45.5 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.977 1.311 . . . . 2.1099999999999999 108.861 175.497 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . 122.55 -72.61 0.39 Allowed Glycine 0 CA--C 1.531 1.039 0 CA-C-O 117.791 -1.561 . . . . 2.2400000000000002 112.074 -176.395 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -62.19 -45.02 16.85 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.621 2.214 . . . . 1.2 111.524 179.935 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.5 pp -82.8 -5.83 9.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 113.397 0.888 . . . . 2.2200000000000002 113.397 174.257 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.16 -35.63 79.36 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.697 1.135 . . . . 2.1800000000000002 112.99 -175.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -65.19 -36.46 84.26 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 113.46 0.911 . . . . 4.7400000000000002 113.46 175.763 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.2 tt -61.8 -39.07 90.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.914 -1.041 . . . . 3.0699999999999998 110.408 177.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 32.6 mt -49.21 -65.54 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-O 121.632 0.729 . . . . 2.3599999999999999 111.231 171.56 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 64.9 t60 -63.13 -33.31 75.18 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.827 -0.545 . . . . 2.6400000000000001 111.467 -174.541 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.297 2.9 pt-20 -85.88 -10.04 55.98 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.523 0.564 . . . . 3.3500000000000001 112.523 -176.355 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . 0.451 ' C ' ' H ' ' B' ' 202' ' ' GLN . 0.1 OUTLIER -77.67 -36.37 51.41 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 126.197 1.799 . . . . 3.1899999999999999 113.278 164.408 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.09 7.6 1.19 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 126.673 1.989 . . . . 2.5899999999999999 112.064 174.215 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . 0.451 ' H ' ' C ' ' B' ' 200' ' ' GLN . 12.6 mm-40 -128.92 -66.94 0.8 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 127.005 2.122 . . . . 3.5899999999999999 109.319 176.209 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 . . . . . 0 N--CA 1.478 0.948 0 C-N-CA 130.572 3.549 . . . . 6.2199999999999998 115.379 177.862 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 112.902 0.705 . . . . 3.9399999999999999 112.902 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 56.3 p -76.11 167.43 21.87 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.767 0.827 . . . . 2.2000000000000002 111.759 -165.588 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -55.5 -49.82 71.56 Favored 'General case' 0 C--O 1.217 -0.651 0 CA-C-O 117.833 -1.08 . . . . 3.0 109.877 168.536 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.01 -48.74 61.37 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.44 1.018 . . . . 2.1899999999999999 110.538 178.494 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -68.39 -58.74 3.89 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 118.455 -0.784 . . . . 3.4199999999999999 111.252 -178.362 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -52.74 -27.49 17.93 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 120.194 1.361 . . . . 6.7599999999999998 112.751 173.333 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.29 -41.76 56.32 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 120.586 -1.321 . . . . 1.8200000000000001 112.702 172.949 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -56.08 -47.05 80.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 CA-C-N 120.503 1.502 . . . . 1.7 109.877 165.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.1 mt -53.08 -47.48 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.438 1.095 . . . . 1.8600000000000001 111.007 171.564 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.6 t -68.72 -33.73 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 120.099 1.318 . . . . 2.0299999999999998 113.055 178.329 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.84 -35.64 77.19 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.266 -1.521 . . . . 1.99 110.836 171.707 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 t -69.3 -39.44 79.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 125.517 1.527 . . . . 1.8100000000000001 110.999 174.138 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -62.2 -51.25 68.54 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.956 0.902 . . . . 3.1699999999999999 110.552 169.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.401 ' HA ' ' CD ' ' A' ' 21' ' ' LYS . 2.8 t30 -61.1 -18.37 57.59 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.104 1.15 . . . . 2.2000000000000002 114.104 -179.5 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -80.82 -68.47 0.68 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.402 0.681 . . . . 3.1699999999999999 111.974 162.949 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -64.23 -25.96 68.3 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.873 1.064 . . . . 2.98 113.873 -163.659 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.401 ' CD ' ' HA ' ' A' ' 18' ' ' ASN . 7.4 ptmt -51.54 -26.34 8.39 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 120.054 1.297 . . . . 2.7999999999999998 113.056 172.282 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -98.53 5.19 48.11 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.373 1.469 . . . . 3.3799999999999999 114.907 -175.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 18.0 m . . . . . 0 N--CA 1.48 1.057 0 C-N-CA 124.374 1.069 . . . . 3.04 110.217 172.131 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 18.5 pt . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 113.702 1.001 . . . . 4.3700000000000001 113.702 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.4 m -76.28 139.82 41.27 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.198 -0.939 . . . . 3.0699999999999998 110.109 162.909 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -50.71 -28.63 9.44 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.318 1.447 . . . . 4.0300000000000002 114.405 -178.033 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.1 p -60.17 -21.93 62.28 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.952 1.464 . . . . 2.5699999999999998 114.952 172.937 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 62.1 m -71.85 -49.62 36.7 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 118.539 -0.743 . . . . 1.6599999999999999 112.377 176.082 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -49.52 -52.48 29.34 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.611 1.165 . . . . 3.3599999999999999 112.107 -178.027 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -57.54 -12.43 2.72 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.007 1.114 . . . . 3.1400000000000001 114.007 178.708 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -116.9 -23.38 8.08 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 114.841 1.423 . . . . 4.8899999999999997 114.841 174.284 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -53.37 -39.23 64.04 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 120.197 1.362 . . . . 2.0600000000000001 110.47 158.723 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 mt -59.72 -22.89 62.66 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 114.317 1.229 . . . . 2.3300000000000001 114.317 169.426 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -98.26 -16.27 19.48 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.88 1.272 . . . . 3.3500000000000001 113.056 -179.231 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -97.66 -70.76 0.71 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.817 0.847 . . . . 2.8799999999999999 110.721 169.324 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -62.19 -34.38 76.33 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.815 1.189 . . . . 3.6499999999999999 113.347 -177.109 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.8 19.38 20.56 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 114.33 1.233 . . . . 2.7400000000000002 114.33 -178.939 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -51.46 -34.26 34.58 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 115.057 1.503 . . . . 1.45 115.057 -171.823 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.463 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 9.0 m-70 -57.68 -27.64 63.08 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.834 2.054 . . . . 2.2400000000000002 113.988 -175.879 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 28.2 tpp -107.93 1.35 22.57 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.578 1.551 . . . . 2.8399999999999999 113.433 -169.21 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.1 mp -70.38 168.23 16.49 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.96 1.304 . . . . 3.21 112.004 175.11 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -164.34 102.28 0.84 Allowed 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.02 -1.675 . . . . 4.0 108.96 -168.535 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.48 ' CG ' ' H ' ' A' ' 53' ' ' THR . 17.6 t70 53.84 -166.83 0.08 Allowed 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 122.285 1.04 . . . . 4.5 110.648 -160.587 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.48 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 82.6 p -71.91 -27.65 62.97 Favored 'General case' 0 CA--C 1.518 -0.269 0 O-C-N 120.381 -1.449 . . . . 3.73 112.653 154.226 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.02 -42.12 53.85 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 124.617 1.104 . . . . 2.1099999999999999 112.817 -175.289 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -55.25 -55.69 28.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.464 1.106 . . . . 3.2200000000000002 111.62 169.167 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -55.65 -47.72 76.2 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.522 1.055 . . . . 6.0300000000000002 112.391 178.34 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -63.39 -19.12 64.39 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 120.758 -1.214 . . . . 4.0599999999999996 113.66 -175.114 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.14 -38.87 74.14 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.17 0.896 . . . . 1.96 112.023 166.522 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.15 99.58 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.594 0.758 . . . . 1.8600000000000001 112.093 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.73 -30.72 70.15 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.742 1.217 . . . . 2.79 113.792 175.317 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.2 mtmt -61.96 -34.82 76.82 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.851 -1.156 . . . . 4.75 111.762 170.714 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.0 mt -70.93 -40.04 72.32 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.466 0.706 . . . . 2.0499999999999998 111.954 175.368 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.8 mm -52.16 -53.28 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.55 0.74 . . . . 2.2999999999999998 110.612 177.933 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -71.35 -38.32 71.63 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 124.65 1.219 . . . . 3.2400000000000002 112.679 -176.753 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.4 t30 -54.83 -35.88 64.42 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.533 0.682 . . . . 3.3900000000000001 111.629 168.402 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.4 tp -86.23 -19.82 29.42 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 120.826 -1.171 . . . . 3.5600000000000001 113.319 -178.287 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -62.18 -22.7 66.11 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.281 0.845 . . . . 3.04 113.281 173.508 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.18 -6.24 41.39 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 114.506 1.299 . . . . 3.23 114.506 168.285 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -139.99 14.63 2.46 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 125.152 1.381 . . . . 2.6899999999999999 114.416 -168.313 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -128.35 88.56 2.77 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.471 -1.393 . . . . 6.6200000000000001 113.13 -163.226 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -67.84 32.35 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 128.049 2.54 . . . . 5.8399999999999999 114.623 178.643 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.49 -8.44 9.99 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 126.085 1.802 . . . . 2.6600000000000001 115.6 175.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.0 mmt-85 -78.84 -170.59 2.22 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.898 1.349 . . . . 7.3799999999999999 111.085 168.359 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.8 mm -137.7 135.75 45.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 104.872 -2.269 . . . . 3.4900000000000002 104.872 164.597 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.2 m -96.94 167.12 11.27 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.927 0.891 . . . . 2.9300000000000002 110.403 165.62 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -66.08 -58.75 4.78 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 120.655 -1.278 . . . . 3.3199999999999998 111.74 -178.883 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -69.3 -14.62 63.04 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.682 1.593 . . . . 2.6400000000000001 112.848 -173.586 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -53.69 -54.12 42.33 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.59 1.556 . . . . 3.2200000000000002 111.028 171.147 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -65.09 -42.37 94.1 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.086 -1.634 . . . . 4.6500000000000004 112.819 175.316 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.6 t-105 -60.79 -43.67 97.8 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.756 -0.59 . . . . 0.66000000000000003 111.305 -179.021 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.5 t -73.57 -26.98 61.08 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 117.306 -1.331 . . . . 2.79 111.939 176.91 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 22.2 mt -65.69 -43.0 90.57 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 120.39 1.45 . . . . 1.9199999999999999 112.582 169.568 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 38.0 mm -52.48 -36.47 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-N 120.801 1.637 . . . . 1.6799999999999999 112.018 176.066 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.24 -29.51 68.85 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-O 119.07 -0.85 . . . . 0.68999999999999995 113.573 175.185 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.09 -26.84 65.49 Favored Glycine 0 CA--C 1.534 1.25 0 CA-C-N 119.182 1.491 . . . . 0.56999999999999995 114.427 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -92.85 -35.6 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 CA-C-N 119.351 1.576 . . . . 1.9199999999999999 111.162 169.737 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.4 m -72.08 -37.46 69.59 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.194 1.398 . . . . 2.77 112.652 -177.598 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.84 -47.09 66.56 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 125.412 1.482 . . . . 2.3500000000000001 114.877 -177.543 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.74 -42.5 6.62 Favored 'Trans proline' 0 C--N 1.352 0.757 0 CA-C-N 120.976 2.388 . . . . 1.46 112.898 174.307 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.5 pt -84.58 -31.3 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 115.193 1.553 . . . . 2.3100000000000001 115.193 -171.28 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.25 71.12 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 120.13 1.332 . . . . 2.1200000000000001 113.579 -168.43 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -62.59 -23.38 67.0 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.403 0.89 . . . . 7.3099999999999996 113.403 175.578 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.61 -30.75 24.7 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.919 1.288 . . . . 3.2000000000000002 111.073 174.033 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.5 mt -51.68 -55.53 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.328 0.967 . . . . 2.21 111.004 174.27 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -52.69 -41.43 63.88 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.664 1.12 . . . . 3.9100000000000001 113.495 178.1 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -72.64 -8.36 54.91 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.014 0.925 . . . . 4.7400000000000002 112.488 -179.13 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -97.71 -35.01 10.7 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.594 1.958 . . . . 3.79 112.941 165.195 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -62.37 -5.33 2.37 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 120.358 1.435 . . . . 2.4199999999999999 112.586 163.97 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 . . . . . 0 C--N 1.331 -0.232 0 C-N-CA 125.894 1.678 . . . . 2.5699999999999998 111.039 171.927 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 113.514 0.931 . . . . 3.6400000000000001 113.514 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 71.7 p -83.64 155.0 23.41 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.194 0.998 . . . . 2.5899999999999999 111.191 -177.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . 0.484 ' CD ' ' HZ3' ' B' ' 113' ' ' LYS . 3.0 tp10 -53.69 -33.17 54.57 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.712 1.005 . . . . 2.46 113.712 178.894 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.82 -47.41 69.13 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.005 0.522 . . . . 3.0499999999999998 111.083 177.427 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -72.02 -52.7 15.71 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.53 -0.544 . . . . 3.0099999999999998 109.53 -177.211 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . 0.484 ' HZ3' ' CD ' ' B' ' 110' ' ' GLU . 6.6 tmtt? -54.0 -29.62 44.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.193 0.997 . . . . 5.8200000000000003 111.899 174.465 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.01 -32.79 71.14 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 119.697 -1.877 . . . . 1.6100000000000001 113.687 171.489 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 48.8 t -55.01 -43.5 69.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 120.613 1.551 . . . . 2.1299999999999999 109.673 174.195 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 48.2 mt -51.24 -55.49 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.197 0.599 . . . . 2.3799999999999999 110.32 171.924 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.53 -40.13 88.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 123.908 0.883 . . . . 1.8799999999999999 113.084 -177.11 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.3 -31.12 70.34 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.077 -1.014 . . . . 2.5299999999999998 111.541 176.752 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 41.5 t -73.56 -42.68 55.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.928 1.691 . . . . 1.8999999999999999 111.241 172.544 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . 0.421 ' CD ' ' HZ3' ' B' ' 124' ' ' LYS . 14.5 tm-20 -57.07 -50.48 72.64 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.606 1.162 . . . . 3.5499999999999998 111.66 173.939 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -65.9 -10.77 41.61 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 114.162 1.171 . . . . 2.5099999999999998 114.162 -173.838 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -87.82 -63.91 1.23 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.386 1.474 . . . . 3.2599999999999998 112.146 164.418 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -61.23 -29.94 70.14 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.693 0.997 . . . . 2.9100000000000001 113.693 -165.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . 0.421 ' HZ3' ' CD ' ' B' ' 120' ' ' GLU . 8.4 ptmt -50.67 -26.9 6.0 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 119.43 1.013 . . . . 2.6299999999999999 113.508 173.697 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -93.35 5.57 51.11 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.23 1.812 . . . . 3.3100000000000001 114.726 -179.517 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 13.2 m . . . . . 0 N--CA 1.482 1.134 0 CA-C-N 119.97 1.259 . . . . 3.04 110.971 173.977 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 14.4 pt . . . . . 0 N--CA 1.483 1.177 0 N-CA-C 114.14 1.163 . . . . 4.5300000000000002 114.14 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 73.5 m -74.63 139.7 43.79 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.378 -0.826 . . . . 3.0299999999999998 110.934 163.831 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -51.79 -24.78 6.44 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.59 1.556 . . . . 4.0 114.736 -174.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 62.1 p -58.19 -23.65 56.32 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.735 1.383 . . . . 2.77 114.735 171.649 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 61.1 m -74.35 -46.15 42.54 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.256 0.935 . . . . 1.6899999999999999 113.002 -179.407 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -53.23 -52.47 58.83 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.784 1.175 . . . . 3.5 112.263 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -57.37 -10.65 1.45 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.714 1.005 . . . . 3.29 113.714 177.535 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -117.83 -27.6 6.17 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 120.182 1.355 . . . . 4.3099999999999996 114.387 177.584 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.7 tmm? -53.01 -35.83 59.83 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 119.704 1.138 . . . . 1.97 111.375 161.732 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.29 -26.59 68.49 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.053 1.131 . . . . 2.3399999999999999 114.053 170.307 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -92.14 -24.17 19.18 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 121.208 -0.932 . . . . 3.0 112.951 179.494 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.72 -67.37 0.83 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.17 0.895 . . . . 2.3500000000000001 111.573 172.261 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -69.06 -29.17 67.24 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.378 1.251 . . . . 3.5299999999999998 114.378 -175.551 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.59 19.36 19.32 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.064 1.346 . . . . 2.6499999999999999 113.762 -179.693 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -45.07 -38.31 4.89 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 117.647 2.462 . . . . 1.6499999999999999 117.647 -165.467 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . 0.457 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 0.0 OUTLIER -61.92 -28.57 69.62 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.118 2.167 . . . . 2.6499999999999999 113.342 -178.407 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 40.6 tpp -77.94 -4.75 48.46 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.119 1.768 . . . . 2.8999999999999999 113.776 -174.11 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.79 177.21 7.07 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.136 1.375 . . . . 3.2599999999999998 112.95 -175.385 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 6.4 m -176.76 110.47 0.08 Allowed 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.567 2.347 . . . . 4.1900000000000004 107.956 -176.668 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . 0.453 ' CB ' ' H ' ' B' ' 157' ' ' GLY . 21.1 t0 48.39 -175.57 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.299 0 CA-C-O 123.844 1.783 . . . . 4.96 109.992 -147.597 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 65.4 p -56.9 -14.88 3.9 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 120.097 -1.627 . . . . 4.6799999999999997 112.836 142.144 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . 0.453 ' H ' ' CB ' ' B' ' 155' ' ' ASP . . . -51.92 -38.43 46.35 Favored Glycine 0 N--CA 1.476 1.324 0 C-N-CA 126.906 2.193 . . . . 2.3599999999999999 113.547 -177.179 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -62.8 -58.85 5.98 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.89 1.276 . . . . 3.23 111.547 169.283 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -50.85 -43.79 59.37 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.698 1.599 . . . . 6.0700000000000003 114.561 174.597 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 34.1 mtmt -60.22 -19.01 52.56 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.681 1.992 . . . . 5.6200000000000001 115.281 178.745 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -66.33 -41.42 89.64 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.392 1.077 . . . . 2.0600000000000001 112.041 167.777 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -61.25 -40.56 94.5 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.106 0.962 . . . . 1.79 111.159 176.503 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -56.88 -39.71 74.87 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.73 1.212 . . . . 2.21 113.054 173.775 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -59.53 -34.25 72.4 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.332 -0.855 . . . . 4.9199999999999999 111.962 174.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 8.8 mt -69.8 -42.99 73.01 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 118.656 -0.688 . . . . 2.04 112.03 174.07 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 35.3 mm -50.04 -53.86 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.889 0.768 . . . . 2.21 110.391 177.47 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -71.1 -38.22 72.38 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.059 1.344 . . . . 2.9500000000000002 112.961 -176.313 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -54.02 -33.86 58.37 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.559 0.695 . . . . 3.4199999999999999 111.862 167.462 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 9.2 tp -93.59 -14.21 26.78 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 120.63 -1.294 . . . . 3.2000000000000002 113.964 -179.439 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -65.02 -16.59 63.62 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.573 0.749 . . . . 3.1000000000000001 112.978 171.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.23 -6.92 58.66 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.464 1.283 . . . . 3.0899999999999999 114.464 165.086 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -142.97 27.56 1.62 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.182 1.393 . . . . 2.6699999999999999 114.294 -164.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -143.56 93.81 2.52 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 120.049 -1.657 . . . . 6.5599999999999996 111.621 -170.406 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -68.68 31.23 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 128.258 2.623 . . . . 5.7599999999999998 114.009 179.041 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.63 -11.93 6.59 Favored Glycine 0 CA--C 1.534 1.223 0 O-C-N 119.802 -1.811 . . . . 2.5800000000000001 114.999 178.905 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 35.2 mmt-85 -83.75 144.81 29.09 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.539 1.67 . . . . 7.4699999999999998 109.745 163.247 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 7.4 mm -93.79 135.29 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 106.97 -1.493 . . . . 3.75 106.97 163.653 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 18.5 m -98.18 159.07 15.17 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.256 1.422 . . . . 3.0499999999999998 110.941 166.685 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -62.97 -54.38 39.28 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.33 -1.482 . . . . 3.0600000000000001 112.311 -174.651 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -68.63 -14.02 62.74 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.64 1.976 . . . . 2.9700000000000002 113.301 -176.215 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -56.69 -54.06 50.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.159 1.784 . . . . 3.2200000000000002 111.168 174.137 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -57.19 -44.7 83.85 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 120.624 -1.297 . . . . 3.6699999999999999 112.311 173.068 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -62.66 -43.25 99.28 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 121.985 -0.447 . . . . 0.65000000000000002 111.845 -178.028 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.9 t -75.3 -26.07 58.42 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 117.409 -1.281 . . . . 2.6899999999999999 112.496 175.927 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 54.0 mt -68.8 -41.12 79.14 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.677 1.58 . . . . 1.79 112.395 171.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 21.9 mm -51.58 -36.72 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 CA-C-N 120.509 1.504 . . . . 1.71 112.417 177.612 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -57.28 -32.3 63.56 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 118.505 0.593 . . . . 0.65000000000000002 113.688 173.77 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -73.13 -19.24 79.56 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-N 118.793 1.296 . . . . 0.63 114.903 -179.785 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -98.21 -35.62 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 CA-C-N 119.019 1.409 . . . . 1.76 111.147 167.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 68.6 m -75.1 -41.88 57.74 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.913 1.685 . . . . 2.7799999999999998 113.177 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -54.48 -42.58 76.01 Favored Glycine 0 CA--C 1.537 1.461 0 CA-C-O 118.086 -1.397 . . . . 2.3100000000000001 115.74 -174.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.09 -44.29 7.53 Favored 'Trans proline' 0 C--N 1.354 0.832 0 CA-C-N 121.0 2.4 . . . . 1.29 112.444 174.374 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 35.0 pt -90.38 -24.7 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 115.607 1.706 . . . . 2.3900000000000001 115.607 -168.271 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -56.35 -36.16 68.46 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.767 1.227 . . . . 1.9399999999999999 113.834 -171.072 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.0 ptpp? -57.62 -31.67 66.47 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.735 1.214 . . . . 6.6799999999999997 113.107 173.175 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.66 -30.11 25.12 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.454 1.502 . . . . 3.1499999999999999 110.947 179.115 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 65.0 mt -52.36 -52.81 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.183 0.993 . . . . 2.02 110.508 172.207 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -46.79 -50.26 18.57 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 118.761 0.709 . . . . 4.0 112.786 173.132 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -68.32 -12.99 61.94 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.813 1.245 . . . . 4.5499999999999998 113.657 -177.018 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -98.57 -30.34 12.55 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.461 1.504 . . . . 3.1400000000000001 113.58 170.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -68.18 -17.44 64.33 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 120.552 1.524 . . . . 2.3199999999999998 111.555 165.901 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -93.87 -54.87 3.44 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.18 -0.95 . . . . 2.3900000000000001 111.787 174.084 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 . . . . . 0 N--CA 1.477 0.895 0 C-N-CA 129.115 2.966 . . . . 7.0800000000000001 116.043 176.583 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 . . . . . 0 N--CA 1.474 0.766 0 N-CA-C 108.586 -0.894 . . . . 3.3700000000000001 108.586 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 31.5 p -76.23 154.68 35.06 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.566 0.747 . . . . 1.71 110.15 174.194 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -62.33 -31.76 72.42 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-O 118.818 -0.61 . . . . 2.46 111.897 178.14 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.68 -42.52 88.69 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 120.065 1.302 . . . . 1.9099999999999999 110.224 176.508 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -62.91 1.25 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.822 1.249 . . . . 2.8399999999999999 110.443 179.295 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -52.39 -33.87 45.44 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 114.404 1.261 . . . . 6.8099999999999996 114.404 172.971 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.24 -49.01 66.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 119.938 1.245 . . . . 1.5600000000000001 111.808 173.008 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 52.8 t -57.22 -35.08 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 120.017 1.28 . . . . 1.96 110.439 173.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.6 mt -59.65 -47.64 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 O-C-N 121.483 -0.761 . . . . 2.1600000000000001 112.305 168.209 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.3 t -64.61 -34.65 71.17 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 CA-C-N 120.279 1.399 . . . . 1.95 113.414 175.006 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -63.23 -41.81 99.15 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 120.636 -1.29 . . . . 2.0 111.04 171.643 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.2 t -62.56 -40.19 87.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 123.774 0.83 . . . . 1.76 110.881 173.689 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -66.04 -36.64 83.8 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.644 1.111 . . . . 3.1299999999999999 113.129 173.609 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -62.11 -23.07 66.32 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.756 1.162 . . . . 2.0600000000000001 113.556 -177.883 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -81.91 -50.19 9.46 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.037 1.335 . . . . 3.1299999999999999 112.797 171.213 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -75.74 -16.44 60.14 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.667 1.358 . . . . 3.71 114.667 -174.019 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -66.87 -25.66 66.51 Favored 'General case' 0 CA--C 1.553 1.059 0 O-C-N 120.218 -1.552 . . . . 3.6200000000000001 112.116 161.075 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -97.89 -36.25 10.23 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 115.277 1.584 . . . . 4.29 115.277 -178.018 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.486 1.331 0 CA-C-N 120.509 1.504 . . . . 4.9500000000000002 112.238 172.23 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.0 tt . . . . . 0 CA--C 1.541 0.629 0 N-CA-C 109.296 -0.631 . . . . 4.5300000000000002 109.296 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.2 m -143.04 168.6 19.34 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.507 -1.371 . . . . 3.5299999999999998 109.245 159.08 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -59.26 -34.95 72.86 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.274 -1.516 . . . . 3.4900000000000002 112.048 -173.237 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 p -57.21 -21.28 32.42 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.358 1.863 . . . . 2.29 114.57 171.823 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 m -74.65 -39.8 61.84 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.19 -0.944 . . . . 1.8799999999999999 112.395 171.275 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -58.27 -49.72 76.12 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.742 1.155 . . . . 3.5 113.066 -175.36 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -53.18 -23.02 7.43 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.001 0.92 . . . . 3.3599999999999999 112.874 172.918 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -99.68 -45.82 5.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.931 1.693 . . . . 3.54 113.244 -170.271 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 16.7 ptm -52.53 -37.16 56.99 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.979 0.809 . . . . 4.2400000000000002 110.444 161.154 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.8 mt -58.72 -64.17 1.03 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.954 0.902 . . . . 2.0600000000000001 111.865 167.306 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -70.0 -12.17 61.42 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.585 1.538 . . . . 3.0499999999999998 115.12 -173.458 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.1 -49.21 6.32 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.506 1.048 . . . . 2.5800000000000001 112.419 170.616 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -80.97 -36.48 30.78 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 120.06 1.3 . . . . 2.7200000000000002 112.529 -175.091 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.8 mt -103.81 27.32 7.65 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.957 1.303 . . . . 3.21 112.666 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -58.5 -16.77 16.76 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 115.766 1.765 . . . . 1.54 115.766 -169.407 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.12 -36.15 15.0 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 119.517 1.053 . . . . 2.21 113.089 174.858 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.8 ttm -71.31 -22.27 61.95 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.909 1.284 . . . . 3.3799999999999999 112.292 176.316 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.9 mp -61.9 90.35 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 123.528 1.632 . . . . 3.48 111.046 171.114 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.6 m -74.39 75.77 1.9 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 113.535 -1.666 . . . . 4.6699999999999999 109.701 173.818 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.9 t70 71.77 169.89 0.32 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 128.312 2.645 . . . . 4.04 112.999 -176.064 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m -30.77 -45.86 0.07 Allowed 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 127.376 2.27 . . . . 3.1000000000000001 111.989 150.062 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.56 -50.17 54.43 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.433 1.492 . . . . 1.8700000000000001 113.654 177.223 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -62.65 -41.67 99.18 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.794 1.297 . . . . 3.98 112.001 172.208 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 44.2 ttt-85 -57.01 -40.49 76.74 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.735 0.698 . . . . 6.5700000000000003 112.521 173.729 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.29 -19.06 64.25 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 120.443 1.474 . . . . 4.2800000000000002 113.609 176.164 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.09 -17.61 54.84 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.127 1.158 . . . . 1.96 114.127 170.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.29 -53.11 9.31 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.481 1.112 . . . . 1.9299999999999999 110.525 160.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -57.01 -35.77 69.63 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.086 0.954 . . . . 2.2999999999999998 112.923 -176.451 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.9 ptmm? -57.59 -23.83 52.98 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 120.377 -1.452 . . . . 4.8799999999999999 114.763 171.654 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.2 mt -82.84 -37.05 24.92 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.465 -0.772 . . . . 2.7799999999999998 112.308 174.676 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.2 mm -52.53 -51.56 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.766 1.226 . . . . 1.95 110.823 -178.326 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -55.14 -48.93 73.0 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 122.176 0.988 . . . . 3.8799999999999999 112.359 177.426 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 -66.01 -21.19 66.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.744 1.218 . . . . 3.8999999999999999 113.316 -178.691 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.47 -34.9 14.63 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.849 0.75 . . . . 3.25 112.533 178.428 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -61.88 -25.36 67.5 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.3 -0.875 . . . . 3.23 112.511 164.695 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.67 -14.01 62.3 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 114.484 1.29 . . . . 2.5499999999999998 114.484 167.251 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -123.91 -19.47 5.68 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 116.119 1.896 . . . . 2.6200000000000001 116.119 -173.411 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.93 127.02 22.49 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.08 1.763 . . . . 4.3499999999999996 112.435 -171.488 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -85.91 -7.66 58.54 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.804 1.409 . . . . 4.6600000000000001 114.804 -169.353 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 130.8 -13.65 5.55 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 124.762 1.172 . . . . 2.77 113.628 -163.116 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.5 mmt-85 -76.61 147.03 37.86 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.244 1.522 . . . . 5.6399999999999997 109.467 153.273 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 37.4 mm -133.22 146.2 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 127.458 2.303 . . . . 3.4700000000000002 107.317 -178.307 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 10.6 m -109.44 151.52 26.58 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 118.977 0.808 . . . . 2.3900000000000001 110.289 173.809 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -55.72 -40.46 72.46 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-O 122.658 1.218 . . . . 3.4700000000000002 111.137 172.918 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.8 -32.2 65.45 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 129.772 3.229 . . . . 3.0499999999999998 112.782 178.688 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -54.76 9.76 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.395 1.478 . . . . 3.25 110.0 -170.4 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -52.77 -43.46 65.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.092 0.557 . . . . 2.98 112.028 174.169 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.7 t-105 -63.26 -48.14 79.44 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.709 -0.62 . . . . 0.87 111.375 177.532 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 88.5 m -58.37 -37.45 75.24 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.501 1.921 . . . . 3.2400000000000002 111.694 176.453 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 75.2 mt -62.14 -50.5 71.64 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 118.25 -0.881 . . . . 2.27 111.955 174.114 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.0 mm -52.62 -41.84 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 CA-C-N 120.215 1.37 . . . . 2.1000000000000001 113.441 -173.591 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.28 -19.46 59.66 Favored Glycine 0 N--CA 1.475 1.282 0 C-N-CA 123.637 0.637 . . . . 0.97999999999999998 113.499 177.993 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.0 -11.63 85.4 Favored Glycine 0 CA--C 1.534 1.252 0 CA-C-O 117.85 -1.528 . . . . 1.1399999999999999 114.993 173.979 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.3 -45.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 119.796 1.798 . . . . 2.73 111.036 175.939 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 40.6 m -76.28 87.19 3.09 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 105.997 -1.853 . . . . 1.9299999999999999 105.997 172.688 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -160.4 -77.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.916 0 CA-C-O 118.038 -1.423 . . . . 1.1599999999999999 112.549 -167.762 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -61.57 -33.37 87.27 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 122.856 2.371 . . . . 1.1499999999999999 112.311 175.263 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.3 pt -75.85 -16.9 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 114.047 1.128 . . . . 2.1800000000000002 114.047 173.885 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.12 -65.05 0.63 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.997 1.271 . . . . 3.0099999999999998 112.958 -169.47 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp -55.2 -40.75 71.13 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.349 -0.845 . . . . 4.8099999999999996 113.185 178.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.69 -38.27 74.89 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.648 0.779 . . . . 2.6400000000000001 111.216 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 51.2 mt -54.93 -62.43 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 118.973 0.806 . . . . 2.3700000000000001 111.111 171.117 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -57.11 -27.98 62.26 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.299 0.852 . . . . 1.73 113.299 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -81.36 -25.89 35.98 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.048 -1.033 . . . . 3.4399999999999999 112.261 177.605 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.421 ' C ' ' H ' ' A' ' 99' ' ' GLN . 19.8 mm100 -74.96 -33.49 61.92 Favored 'General case' 0 C--O 1.227 -0.086 0 N-CA-C 113.776 1.028 . . . . 2.2599999999999998 113.776 178.783 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -70.47 6.69 1.29 Allowed 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 123.305 1.526 . . . . 2.3399999999999999 112.031 172.151 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.421 ' H ' ' C ' ' A' ' 97' ' ' GLN . 2.1 mm-40 . . . . . 0 N--CA 1.466 0.365 0 C-N-CA 126.416 1.887 . . . . 2.73 110.306 170.599 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 . . . . . 0 CA--C 1.55 0.976 0 N-CA-C 114.238 1.199 . . . . 3.4900000000000002 114.238 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.4 p -85.27 159.79 19.99 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.575 -0.703 . . . . 1.9099999999999999 109.311 160.42 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -59.61 -45.06 93.05 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.599 -0.715 . . . . 2.79 111.657 174.505 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.59 -43.04 75.63 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.581 1.082 . . . . 2.0899999999999999 111.211 -174.46 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -56.75 7.6 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.993 0.517 . . . . 2.77 110.239 -177.381 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -50.2 -37.61 36.05 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.755 1.222 . . . . 5.9000000000000004 112.268 172.103 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.35 -44.67 74.76 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 120.37 -1.456 . . . . 1.54 113.51 172.588 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 79.6 t -61.72 -34.53 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 CA-C-N 121.009 1.731 . . . . 1.99 111.017 172.399 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 44.4 mt -56.03 -52.48 49.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.681 1.128 . . . . 1.76 110.913 165.154 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 9.3 t -58.03 -41.37 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 119.407 1.003 . . . . 1.6200000000000001 112.657 178.569 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.37 -39.36 94.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.02 0.928 . . . . 2.04 112.298 175.007 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 99.2 t -70.93 -44.86 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-O 118.455 -0.783 . . . . 1.75 110.895 177.873 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -61.24 -39.2 89.44 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.552 1.069 . . . . 4.2000000000000002 112.042 178.625 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . 0.525 HD22 ' HG3' ' B' ' 148' ' ' GLU . 6.9 t30 -67.51 -14.85 63.3 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.523 1.305 . . . . 2.3500000000000001 114.523 -177.469 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -102.11 -40.18 6.94 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.55 1.54 . . . . 3.6499999999999999 113.155 174.881 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -68.69 -26.08 65.11 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 120.862 -1.149 . . . . 3.54 112.827 175.874 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 42.2 pttt -59.23 -34.78 72.61 Favored 'General case' 0 CA--C 1.551 0.994 0 O-C-N 119.444 -2.035 . . . . 3.5800000000000001 112.248 164.298 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -81.86 -33.46 30.6 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 116.993 -1.479 . . . . 3.8300000000000001 114.876 178.95 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 9.6 p . . . . . 0 N--CA 1.483 1.191 0 CA-C-N 120.573 1.533 . . . . 4.8300000000000001 113.162 176.576 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 5.3 tt . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 109.334 -0.617 . . . . 4.29 109.334 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 74.2 m -142.55 163.53 32.59 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.049 1.74 . . . . 3.5800000000000001 108.722 155.992 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 38.4 mmtm -56.15 -32.6 64.44 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.523 -1.36 . . . . 3.9100000000000001 112.699 -174.219 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 9.1 p -56.7 -23.0 39.14 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.032 1.733 . . . . 2.2200000000000002 113.854 174.497 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 6.0 m -76.56 -26.61 55.29 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.882 -1.137 . . . . 1.5800000000000001 113.159 173.518 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -65.17 -53.51 43.82 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.73 1.605 . . . . 3.1699999999999999 111.656 -179.212 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 6.3 ptt180 -52.14 -25.26 8.51 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.581 1.152 . . . . 3.0800000000000001 112.622 176.128 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.27 -45.08 7.31 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.269 1.827 . . . . 3.48 112.077 -173.115 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.3 tmm? -49.95 -44.08 50.41 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.13 0.972 . . . . 2.3300000000000001 110.232 162.283 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.9 mt -55.01 -63.62 1.1 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.666 1.587 . . . . 1.9099999999999999 111.967 166.945 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -68.56 -15.16 63.44 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 115.338 1.607 . . . . 2.96 115.338 -174.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.92 -48.12 7.43 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.462 1.028 . . . . 2.3599999999999999 112.331 172.362 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.525 ' HG3' HD22 ' B' ' 121' ' ' ASN . 50.6 mm-40 -87.36 -33.88 19.0 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.68 1.127 . . . . 2.79 113.043 -172.861 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.5 mt -101.62 27.38 6.42 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.899 1.28 . . . . 3.3300000000000001 112.317 176.22 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -60.76 -12.59 11.1 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 116.166 1.913 . . . . 1.4399999999999999 116.166 -169.662 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -92.1 -59.77 2.02 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.606 1.162 . . . . 1.95 111.587 -175.281 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 27.7 ttp -61.44 -13.58 21.56 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 114.917 1.451 . . . . 2.7999999999999998 114.917 169.315 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.9 tp -58.39 91.44 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.726 1.61 . . . . 3.2799999999999998 110.185 176.306 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 63.7 m -82.92 70.22 9.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.489 1.116 . . . . 4.8300000000000001 110.879 -167.571 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 25.9 t70 74.62 167.22 0.29 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 128.316 2.646 . . . . 4.1500000000000004 112.695 -175.159 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -27.6 -47.34 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.4 0 C-N-CA 127.792 2.437 . . . . 3.3599999999999999 112.697 151.549 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.06 -52.42 52.94 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-N 120.232 1.378 . . . . 2.1200000000000001 113.756 -178.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.19 -38.8 80.74 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.913 0.885 . . . . 3.6099999999999999 111.325 173.818 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.2 ttt-85 -62.06 -45.87 91.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.719 0.808 . . . . 5.5199999999999996 113.099 172.444 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -21.72 66.05 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 120.024 -1.672 . . . . 4.5 113.182 -177.709 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -61.3 -28.79 69.45 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 117.325 -1.322 . . . . 2.0 113.476 167.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.27 73.18 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.199 1.0 . . . . 2.3100000000000001 111.484 167.089 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -62.88 -32.78 74.1 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.656 0.783 . . . . 2.1200000000000001 111.944 -175.057 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt -47.17 -42.25 19.34 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 122.402 1.096 . . . . 3.2799999999999998 113.663 166.845 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 5.5 mt -78.67 -42.2 29.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 113.973 -1.467 . . . . 2.0899999999999999 110.551 -174.41 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.9 mm -46.48 -56.85 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.302 1.441 . . . . 1.8999999999999999 111.67 175.08 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -58.76 -40.73 84.74 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.592 1.187 . . . . 3.71 112.47 -177.145 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -77.24 -18.46 57.62 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.131 1.372 . . . . 4.2999999999999998 112.455 -175.776 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.57 -36.24 15.43 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.781 0.833 . . . . 3.4399999999999999 112.329 173.288 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -58.88 -35.99 73.91 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.3 0.955 . . . . 3.77 111.946 166.761 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -60.1 -15.97 27.95 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.846 1.424 . . . . 2.7000000000000002 114.846 169.906 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -120.5 -14.53 8.66 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 115.573 1.694 . . . . 2.7400000000000002 115.573 -176.254 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -138.89 108.13 6.09 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.777 1.626 . . . . 4.6299999999999999 112.407 -166.73 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . 0.431 ' C ' ' H ' ' B' ' 176' ' ' ARG . 27.1 t0 -76.77 56.15 1.14 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 128.357 2.663 . . . . 4.29 112.484 -169.501 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 67.87 -14.14 0.61 Allowed Glycine 0 N--CA 1.479 1.563 0 O-C-N 119.854 -1.779 . . . . 2.5600000000000001 114.145 -171.388 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . 0.431 ' H ' ' C ' ' B' ' 174' ' ' ASP . 8.9 mmt-85 -73.1 141.89 47.54 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.83 1.652 . . . . 6.0099999999999998 107.726 164.797 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 40.6 mm -126.32 141.81 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.078 1.351 . . . . 3.2999999999999998 108.812 -168.879 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 70.8 m -99.74 155.13 17.79 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 117.891 0.314 . . . . 2.6000000000000001 111.68 173.839 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -63.32 -50.47 69.9 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.943 -1.098 . . . . 3.8199999999999998 110.509 172.585 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -70.19 -6.45 34.56 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.668 1.187 . . . . 4.46 113.203 -178.066 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -59.3 -57.78 11.53 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.196 0.998 . . . . 3.1499999999999999 109.937 171.551 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -52.11 -48.79 64.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.545 0.738 . . . . 3.3300000000000001 112.035 176.378 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 21.0 t-105 -59.0 -49.82 76.45 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 119.244 -0.407 . . . . 0.88 111.729 178.979 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.5 m -55.32 -43.61 75.06 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.75 1.62 . . . . 2.71 111.865 174.611 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 48.9 mt -69.36 -38.37 78.06 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 118.177 -0.915 . . . . 2.1400000000000001 113.271 179.745 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 30.2 mm -56.79 -41.34 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 120.542 1.519 . . . . 1.8899999999999999 111.662 178.26 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.74 -18.8 57.43 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-O 119.365 -0.686 . . . . 0.72999999999999998 114.174 -179.258 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.8 -11.7 83.6 Favored Glycine 0 CA--C 1.535 1.334 0 CA-C-N 118.866 1.333 . . . . 0.69999999999999996 114.076 175.133 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.7 mp -108.54 -45.04 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.657 1.183 . . . . 2.0699999999999998 110.325 171.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 23.6 m -80.57 77.51 7.37 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 125.17 1.388 . . . . 1.97 107.982 176.292 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -158.44 -74.39 0.02 OUTLIER Glycine 0 CA--C 1.53 1.03 0 C-N-CA 125.502 1.525 . . . . 1.1599999999999999 112.019 -172.084 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -63.11 -34.81 68.03 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.004 2.469 . . . . 1.0800000000000001 113.418 177.851 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.9 pt -83.67 -6.92 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 114.035 1.124 . . . . 1.8999999999999999 114.035 174.722 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -50.07 -55.26 15.58 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.093 1.357 . . . . 2.8500000000000001 113.919 -172.758 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 mtpp -66.51 -39.63 88.77 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-O 116.987 -1.483 . . . . 6.3499999999999996 112.86 174.336 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.5 tt -50.29 -41.81 51.39 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 120.783 1.629 . . . . 2.7999999999999998 111.675 177.896 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 85.1 mt -52.15 -54.99 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.351 1.06 . . . . 2.23 112.432 169.028 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 57.8 t60 -73.33 -20.15 60.86 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.454 0.909 . . . . 2.5299999999999998 113.454 -178.067 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.07 -44.29 69.41 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.923 0.889 . . . . 3.7400000000000002 109.487 168.09 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -60.64 -44.07 96.81 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.755 1.222 . . . . 2.46 113.387 -176.277 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -70.69 1.46 5.3 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 122.529 1.157 . . . . 2.5600000000000001 112.825 -179.235 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -116.21 -53.5 2.54 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 120.725 -1.234 . . . . 3.1499999999999999 109.755 175.38 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.683 0 CA-C-N 114.598 -1.183 . . . . 4.2400000000000002 114.167 178.604 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 . . . . . 0 N--CA 1.472 0.657 0 CA-C-O 118.893 -0.575 . . . . 3.6000000000000001 109.605 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.6 p -62.37 151.82 35.79 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.511 1.05 . . . . 1.76 109.521 174.73 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -58.87 -49.61 77.13 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.876 0.735 . . . . 2.4900000000000002 109.169 177.717 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -43.92 -49.47 8.42 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.381 1.873 . . . . 2.3799999999999999 111.499 176.331 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -56.53 4.93 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.875 -0.516 . . . . 3.0299999999999998 111.807 -171.089 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.8 mmtt -59.15 -22.16 60.49 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.856 -1.153 . . . . 7.6900000000000004 113.455 170.163 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.06 -46.35 68.06 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 120.566 -1.334 . . . . 1.5900000000000001 112.181 168.105 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 96.5 t -59.58 -39.85 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 121.081 1.764 . . . . 2.3300000000000001 110.318 170.596 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 mt -55.47 -47.07 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 118.558 -0.734 . . . . 2.5299999999999998 111.344 169.358 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.55 -37.64 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.137 1.375 . . . . 1.95 112.753 175.978 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.43 -37.29 86.73 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.8 1.182 . . . . 1.9099999999999999 111.009 172.67 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 74.2 t -72.04 -40.9 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.833 0.853 . . . . 1.99 110.697 174.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -55.51 -60.1 3.89 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.72 1.146 . . . . 3.04 110.709 172.325 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.47 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -63.85 -30.6 71.67 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.151 0.797 . . . . 2.9100000000000001 113.151 -170.101 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -67.98 -60.64 2.35 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.589 0.755 . . . . 3.23 110.951 169.815 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -60.97 -26.12 67.33 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 118.146 -0.93 . . . . 3.5499999999999998 112.388 -176.158 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.47 ' HE2' ' HA ' ' A' ' 18' ' ' ASN . 10.7 ttmm -43.88 -42.17 5.59 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.805 2.042 . . . . 3.5699999999999998 112.81 167.596 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -82.69 -19.0 38.92 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.014 1.116 . . . . 4.2300000000000004 114.014 178.315 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.7 t . . . . . 0 N--CA 1.481 1.106 0 C-N-CA 126.57 1.948 . . . . 3.2799999999999998 110.387 -179.101 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.8 tt . . . . . 0 N--CA 1.472 0.64 0 N-CA-C 107.578 -1.267 . . . . 3.5299999999999998 107.578 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 t -147.84 -175.63 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 122.036 0.922 . . . . 4.7699999999999996 110.84 167.897 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -29.36 24.4 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.651 2.38 . . . . 3.2200000000000002 114.498 -176.188 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.5 p -61.18 -26.27 67.6 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.157 1.383 . . . . 2.7400000000000002 114.349 172.515 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.4 m -91.3 -40.9 11.23 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.316 1.228 . . . . 1.51 114.316 -175.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -54.82 -52.22 63.38 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.217 0.917 . . . . 3.5499999999999998 113.226 -167.06 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -54.37 -30.74 52.84 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.594 1.558 . . . . 3.8599999999999999 113.862 173.529 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -87.76 -50.83 6.21 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.574 1.149 . . . . 3.1099999999999999 109.782 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -47.49 -45.16 26.03 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.627 1.171 . . . . 2.0899999999999999 111.915 167.437 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 mt -54.85 -31.2 59.23 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.497 1.295 . . . . 1.99 114.497 177.383 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.97 -4.11 58.84 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 120.168 1.349 . . . . 2.3300000000000001 113.651 178.133 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.14 -43.68 7.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.004 1.321 . . . . 2.6499999999999999 111.373 168.243 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.458 ' OE2' ' HE3' ' A' ' 21' ' ' LYS . 7.4 mm-40 -97.71 -25.79 14.97 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.487 0.921 . . . . 2.9399999999999999 113.487 -166.231 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.63 34.71 5.08 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.211 1.404 . . . . 2.9700000000000002 110.621 -176.984 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -83.66 -5.95 59.32 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 117.243 2.312 . . . . 1.4199999999999999 117.243 -149.052 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -94.16 -50.27 5.36 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 120.223 1.374 . . . . 2.3100000000000001 109.93 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.9 tpp -46.46 -40.57 12.54 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.58 1.952 . . . . 3.0800000000000001 112.527 164.751 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -84.59 91.29 7.86 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-O 122.834 1.302 . . . . 4.3399999999999999 110.159 177.297 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.9 t -91.04 -90.69 0.15 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.445 -1.252 . . . . 4.1500000000000004 109.926 -176.137 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -72.65 156.51 38.9 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.604 1.161 . . . . 3.8999999999999999 113.682 -178.452 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.7 m -63.87 -30.0 71.13 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.322 1.449 . . . . 3.1699999999999999 111.667 171.494 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.11 -37.7 92.03 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.296 1.427 . . . . 2.52 112.525 168.066 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.34 -36.19 74.08 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.044 0.922 . . . . 3.5699999999999998 111.601 171.241 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 48.1 mtt85 -65.73 -24.26 66.93 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.509 0.929 . . . . 8.3100000000000005 113.509 176.169 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt -59.07 -17.21 23.82 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.868 -1.145 . . . . 5.1900000000000004 113.725 166.121 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.47 -19.2 53.61 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.267 1.58 . . . . 2.04 115.267 169.2 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.17 -55.29 4.84 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.739 1.216 . . . . 1.9199999999999999 110.422 163.565 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -64.08 -28.89 70.09 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 113.996 1.109 . . . . 2.77 113.996 -176.962 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.3 ptmm? -53.02 -33.58 52.39 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 120.074 1.306 . . . . 4.5499999999999998 112.596 167.688 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.5 mt -77.16 -41.43 41.74 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 122.138 -0.351 . . . . 2.0499999999999998 111.459 -179.839 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.3 mm -53.3 -56.12 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 C-N-CA 124.102 0.961 . . . . 2.3799999999999999 110.191 -179.827 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -57.44 -40.43 78.42 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.7 0.8 . . . . 2.3599999999999999 112.906 -179.018 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -64.34 -38.92 92.75 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 112.935 0.717 . . . . 5.04 112.935 175.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.42 -38.92 16.87 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.412 0.685 . . . . 3.3300000000000001 111.962 -173.074 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.5 -22.52 66.18 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.829 0.851 . . . . 2.9199999999999999 112.826 177.137 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.37 -17.31 61.83 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.314 1.227 . . . . 3.7000000000000002 114.314 168.503 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -128.63 -8.93 5.08 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 115.158 1.54 . . . . 3.3500000000000001 115.158 -166.545 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -137.87 107.68 6.28 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.489 1.495 . . . . 5.3200000000000003 111.929 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.0 p-10 -78.6 77.23 5.09 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.482 1.513 . . . . 4.0899999999999999 112.423 -174.714 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.86 10.7 77.52 Favored Glycine 0 N--CA 1.476 1.332 0 C-N-CA 124.117 0.865 . . . . 2.9199999999999999 114.587 175.197 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -64.87 153.64 39.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.557 1.543 . . . . 6.5300000000000002 111.921 179.132 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -140.65 86.57 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 124.819 1.247 . . . . 5.3899999999999997 107.883 175.573 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.7 t -89.66 149.63 22.71 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 125.296 1.438 . . . . 1.9299999999999999 112.085 169.6 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -58.27 -41.51 84.48 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.756 -0.59 . . . . 4.2199999999999998 111.907 169.536 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -79.04 -23.2 44.43 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.084 0.772 . . . . 4.0999999999999996 113.084 -174.269 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -54.83 -59.04 5.26 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.262 -1.014 . . . . 3.4199999999999999 108.262 167.08 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -55.45 -43.78 75.75 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.234 -0.916 . . . . 4.6500000000000004 113.006 179.57 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -65.76 -49.26 69.02 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.304 -0.873 . . . . 1.1299999999999999 112.957 -178.861 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 4.6 t -67.97 -25.65 65.54 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.114 0.87 . . . . 3.02 112.498 178.379 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.51 -49.61 68.32 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.277 -0.868 . . . . 1.8100000000000001 111.362 171.541 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 34.4 mm -54.85 -40.34 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 CA-C-N 120.561 1.528 . . . . 1.7 113.538 -177.553 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.69 -28.24 71.23 Favored Glycine 0 CA--C 1.529 0.939 0 CA-C-O 119.477 -0.624 . . . . 0.65000000000000002 112.751 175.048 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.05 -14.66 74.36 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-O 117.63 -1.65 . . . . 0.83999999999999997 116.535 -174.683 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.4 mp -87.33 -31.36 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-N 119.637 1.719 . . . . 2.1099999999999999 110.795 163.193 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.1 m -71.55 168.92 16.56 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.195 1.798 . . . . 3.3399999999999999 108.712 176.342 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.69 -73.07 0.3 Allowed Glycine 0 CA--C 1.531 1.078 0 CA-C-O 117.821 -1.544 . . . . 2.0299999999999998 113.03 179.763 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -63.72 -43.64 16.05 Favored 'Trans proline' 0 C--N 1.351 0.666 0 CA-C-N 120.539 2.169 . . . . 1.5900000000000001 110.138 174.584 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.1 pt -67.43 -22.55 28.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 113.62 0.97 . . . . 2.8100000000000001 113.62 170.875 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.73 -55.7 31.53 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.976 1.262 . . . . 2.4199999999999999 112.7 -171.79 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -29.3 70.23 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.831 -1.168 . . . . 4.5899999999999999 112.389 176.712 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.44 -41.45 72.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.343 1.457 . . . . 2.52 110.572 -177.195 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 62.9 mt -48.98 -60.17 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 2.1299999999999999 109.585 165.256 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -55.9 -44.66 78.45 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-O 118.38 -0.819 . . . . 1.98 111.7 -177.978 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -55.36 -43.08 74.74 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.137 1.335 . . . . 4.1299999999999999 112.805 173.483 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 24.2 mm100 -79.26 -30.54 43.11 Favored 'General case' 0 CA--C 1.527 0.079 0 N-CA-C 113.95 1.092 . . . . 2.7000000000000002 113.95 -172.553 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -71.89 -32.92 67.91 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.873 1.215 . . . . 2.4300000000000002 111.15 170.317 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.482 1.13 0 O-C-N 121.132 -0.98 . . . . 2.8900000000000001 110.674 173.778 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 . . . . . 0 CA--C 1.537 0.474 0 CA-C-O 118.722 -0.656 . . . . 3.7400000000000002 109.505 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 26.9 p -61.8 147.65 45.7 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.234 0.925 . . . . 1.72 109.703 171.641 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.44 -48.09 72.11 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.772 -0.633 . . . . 2.8799999999999999 110.348 173.612 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -47.92 -49.91 28.58 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.797 1.639 . . . . 1.8999999999999999 111.976 177.183 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.42 -54.23 8.8 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.422 -0.799 . . . . 2.98 111.091 -171.727 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 28.0 mmtt -56.36 -24.79 46.47 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.883 -1.135 . . . . 8.3100000000000005 113.48 169.064 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.86 -45.27 75.05 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.652 -1.28 . . . . 1.6499999999999999 112.62 168.027 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 93.7 t -57.66 -38.08 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 CA-C-N 120.834 1.652 . . . . 2.1699999999999999 110.468 169.117 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 2.3 mt -59.71 -49.49 83.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 121.481 -0.762 . . . . 2.3999999999999999 112.23 170.031 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.9 t -60.81 -38.8 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.777 1.631 . . . . 1.8899999999999999 112.256 178.472 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.79 -40.47 97.42 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.401 1.0 . . . . 2.0699999999999998 111.048 172.438 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 66.8 t -66.67 -41.35 88.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-O 117.467 -1.254 . . . . 1.95 110.957 177.156 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -67.56 -39.41 84.93 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 121.185 1.811 . . . . 4.4400000000000004 113.982 169.399 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -61.55 -24.39 66.6 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.35 -1.469 . . . . 3.4900000000000002 113.162 177.216 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -81.01 -66.19 0.92 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.736 1.214 . . . . 3.1800000000000002 112.559 164.345 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -60.29 -31.39 70.21 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 118.195 -0.907 . . . . 3.5899999999999999 112.774 -167.862 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -52.24 -31.72 33.63 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.278 1.399 . . . . 3.3700000000000001 113.4 175.034 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -82.66 -16.56 47.8 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.803 -1.185 . . . . 3.4399999999999999 113.605 177.213 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 25.6 t . . . . . 0 N--CA 1.475 0.801 0 C-N-CA 127.105 2.162 . . . . 3.6000000000000001 108.976 -176.981 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 10.2 tt . . . . . 0 N--CA 1.467 0.38 0 N-CA-C 107.316 -1.365 . . . . 3.4300000000000002 107.316 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 9.1 t -148.43 -175.19 4.82 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 122.759 1.266 . . . . 4.7199999999999998 111.157 171.229 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.17 -35.69 27.26 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.981 2.912 . . . . 3.1800000000000002 114.349 -177.824 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 26.8 p -58.83 -26.47 64.19 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.089 1.356 . . . . 2.5499999999999998 114.409 173.821 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 19.3 m -91.53 -40.33 11.42 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.394 1.078 . . . . 1.5800000000000001 113.756 -178.848 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -55.45 -51.59 66.41 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.789 1.177 . . . . 3.6499999999999999 113.473 -166.476 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.35 -32.29 48.47 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.202 1.401 . . . . 3.6899999999999999 114.024 171.28 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -84.06 -52.49 6.26 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.021 1.328 . . . . 3.02 109.459 -173.183 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 13.9 tmm? -44.96 -45.08 10.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.138 1.775 . . . . 2.1699999999999999 112.395 165.501 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.2 mt -58.86 -27.91 65.59 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.614 1.166 . . . . 2.0800000000000001 114.112 179.622 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -92.53 3.84 54.73 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.894 1.225 . . . . 2.3999999999999999 113.862 173.191 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -44.44 5.84 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.044 0.938 . . . . 2.5299999999999998 111.614 165.605 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.01 -18.59 19.32 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 113.735 1.013 . . . . 2.8799999999999999 113.735 -170.935 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.85 26.77 8.03 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.311 1.845 . . . . 2.9700000000000002 111.574 -179.365 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -71.93 1.93 6.38 Favored 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 117.832 2.531 . . . . 1.4399999999999999 117.832 -157.94 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -99.64 -57.82 2.06 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.701 1.201 . . . . 2.4100000000000001 110.007 178.025 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.1 ttp -65.36 -27.65 68.73 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.28 1.032 . . . . 3.0 113.058 168.223 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 6.1 mp -98.53 82.04 2.8 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.799 1.182 . . . . 5.0 110.871 157.445 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 6.3 t -104.52 -64.06 1.15 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.892 2.077 . . . . 5.4199999999999999 110.785 178.345 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -72.57 140.93 48.38 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.15 0.98 . . . . 4.25 112.433 176.58 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 77.0 m -71.91 -26.09 62.17 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.572 1.949 . . . . 3.4700000000000002 112.72 175.98 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -61.61 -45.69 95.8 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-N 119.222 0.919 . . . . 2.3799999999999999 111.064 165.927 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.14 -37.41 82.74 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.796 0.839 . . . . 3.5499999999999998 111.739 169.598 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 -64.81 -25.56 67.96 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.779 1.172 . . . . 8.3599999999999994 113.642 177.881 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.7 mtmt -58.63 -17.78 25.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.141 1.337 . . . . 5.3700000000000001 113.465 167.739 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.6 -19.13 56.07 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 115.315 1.598 . . . . 2.1200000000000001 115.315 168.511 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.82 -55.71 4.79 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.207 1.003 . . . . 2.0600000000000001 110.382 163.136 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -64.6 -28.96 69.98 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.734 1.013 . . . . 2.98 113.734 -175.425 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 5.5 ptmm? -52.53 -32.97 43.26 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 119.654 1.115 . . . . 4.71 112.412 168.722 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 48.8 mt -76.96 -42.44 39.08 Favored 'General case' 0 C--O 1.224 -0.265 0 O-C-N 121.704 -0.622 . . . . 2.0800000000000001 111.675 -179.653 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 35.6 mm -52.01 -53.68 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 125.099 1.36 . . . . 2.6000000000000001 110.485 -179.179 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -59.53 -42.51 92.48 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.214 0.82 . . . . 2.3799999999999999 113.214 -179.949 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -64.62 -30.0 71.02 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.293 0.637 . . . . 5.0300000000000002 112.709 175.682 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -85.8 -47.24 9.91 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.17 0.988 . . . . 3.8399999999999999 112.026 -176.8 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -63.78 -23.3 67.31 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.197 0.908 . . . . 3.0800000000000001 112.692 178.358 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -67.71 -15.01 63.43 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.63 1.344 . . . . 3.6000000000000001 114.63 170.656 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -136.53 -20.43 1.36 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.619 1.711 . . . . 3.4500000000000002 115.619 -169.009 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -122.46 99.75 6.58 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.716 -1.24 . . . . 6.0700000000000003 111.666 -167.758 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -77.6 76.95 4.13 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.818 1.247 . . . . 3.9199999999999999 113.687 -169.996 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 72.2 11.51 75.38 Favored Glycine 0 N--CA 1.477 1.37 0 O-C-N 120.943 -1.098 . . . . 2.96 114.345 176.75 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -65.93 152.16 45.13 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.772 1.629 . . . . 6.4000000000000004 111.935 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 2.5 mp -140.23 78.64 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.779 1.232 . . . . 5.2800000000000002 108.353 174.605 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 27.7 t -82.61 151.67 26.24 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.5 1.12 . . . . 1.8700000000000001 112.171 169.261 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -57.84 -42.11 83.74 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.621 -0.674 . . . . 4.2199999999999998 111.545 170.04 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.95 -22.71 39.38 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.031 0.752 . . . . 3.8199999999999998 113.031 -173.061 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -56.59 -53.11 61.42 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.714 -0.847 . . . . 3.7200000000000002 108.714 166.276 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -58.16 -46.87 84.96 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.274 -0.891 . . . . 4.54 112.484 176.505 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 49.7 t-105 -65.4 -47.78 75.11 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 120.924 -1.11 . . . . 1.04 113.369 -176.373 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.6 t -63.44 -32.86 74.41 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.481 1.037 . . . . 2.6000000000000001 111.914 176.321 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 67.6 mt -61.54 -49.47 76.55 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.263 -0.898 . . . . 2.0299999999999998 112.249 173.711 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.2 mm -57.14 -40.12 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 CA-C-N 120.418 1.463 . . . . 1.97 113.023 -176.712 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.02 -29.74 75.3 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 119.206 -0.774 . . . . 0.81999999999999995 112.735 174.803 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.84 -16.16 75.81 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.404 1.478 . . . . 0.83999999999999997 116.297 -173.807 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.1 mp -86.68 -31.41 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 CA-C-N 119.249 1.524 . . . . 2.2400000000000002 110.82 164.297 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.5 m -74.01 171.13 14.03 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.988 1.715 . . . . 3.0499999999999998 108.546 178.209 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . 115.43 -73.86 0.25 Allowed Glycine 0 N--CA 1.473 1.153 0 CA-C-O 117.752 -1.582 . . . . 2.2000000000000002 113.399 179.532 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.27 -41.0 22.98 Favored 'Trans proline' 0 C--N 1.351 0.687 0 CA-C-N 121.276 2.538 . . . . 1.4399999999999999 110.348 175.616 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 12.4 pt -69.26 -21.2 24.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 113.577 0.955 . . . . 2.75 113.577 170.727 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.26 -45.73 92.27 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.185 1.357 . . . . 2.1499999999999999 112.628 -178.448 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -65.68 -35.52 81.01 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 120.68 -1.262 . . . . 4.29 112.89 170.521 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.4 mt -64.35 -41.79 96.57 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.696 -1.145 . . . . 3.0499999999999998 111.172 179.317 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 75.1 mt -49.57 -58.1 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 119.625 1.102 . . . . 2.5 110.1 164.569 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -58.44 -36.23 73.33 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 118.433 -0.794 . . . . 2.0499999999999998 112.611 -172.372 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -68.57 -49.78 56.8 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.669 1.988 . . . . 4.0099999999999998 112.693 171.84 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -70.47 -32.17 69.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.368 1.067 . . . . 2.5899999999999999 113.466 -172.124 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -66.55 -35.71 80.9 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 119.951 1.251 . . . . 2.5 111.207 170.952 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -65.95 -42.38 90.07 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 120.643 -1.285 . . . . 2.6899999999999999 110.588 178.146 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 . . . . . 0 CA--C 1.541 0.602 0 C-N-CA 126.417 1.887 . . . . 4.8899999999999997 112.754 177.735 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 108.376 -0.972 . . . . 3.3199999999999998 108.376 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.47 153.25 35.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.458 -1.401 . . . . 2.2000000000000002 110.425 178.385 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -63.96 -34.13 77.28 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 119.648 1.113 . . . . 2.0600000000000001 111.437 174.443 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.01 -45.81 87.29 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 120.108 1.322 . . . . 2.2000000000000002 109.375 177.049 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -66.13 -55.74 14.91 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.94 1.296 . . . . 3.02 112.057 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -58.64 -29.72 66.76 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 120.868 -1.145 . . . . 6.0800000000000001 112.099 172.284 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.38 -41.37 76.57 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 119.649 -1.907 . . . . 1.8300000000000001 112.488 169.078 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.409 ' HA ' ' HG ' ' A' ' 15' ' ' LEU . 85.9 t -56.66 -37.54 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 CA-C-N 119.733 1.151 . . . . 1.8600000000000001 110.773 167.887 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.1 mt -55.92 -56.75 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 CA-C-N 120.924 1.693 . . . . 2.3999999999999999 111.852 166.073 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.1 t -52.85 -43.75 46.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 119.382 0.992 . . . . 1.8500000000000001 112.218 -177.773 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.409 ' HG ' ' HA ' ' A' ' 12' ' ' VAL . 1.8 pp -71.44 -18.94 62.29 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.161 1.171 . . . . 5.2300000000000004 114.161 177.956 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.2 t -81.95 -43.52 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.291 0.95 . . . . 2.0600000000000001 110.261 179.177 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -56.68 -41.45 77.33 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.227 0.467 . . . . 3.3799999999999999 110.593 171.988 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -66.75 -23.8 66.13 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 115.397 1.629 . . . . 2.6299999999999999 115.397 -178.243 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -79.61 -52.91 7.39 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.567 -0.708 . . . . 3.1400000000000001 111.852 170.97 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -68.22 -30.75 69.9 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 117.995 -1.002 . . . . 3.0 113.668 -172.065 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.39 -26.31 66.56 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.492 1.293 . . . . 4.79 114.492 172.638 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -93.1 -31.14 14.93 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.76 1.022 . . . . 3.48 113.76 177.847 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 18.9 m . . . . . 0 N--CA 1.474 0.756 0 O-C-N 121.605 -0.684 . . . . 3.52 110.736 174.68 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 7.2 pt . . . . . 0 N--CA 1.475 0.824 0 CA-C-O 122.459 1.123 . . . . 4.0 112.872 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.3 t -78.93 150.52 32.08 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.169 -0.923 . . . . 3.6699999999999999 110.576 154.762 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -43.55 -32.3 0.9 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.745 1.618 . . . . 3.1600000000000001 113.075 171.659 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 82.4 p -67.92 -18.09 64.67 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 115.68 1.733 . . . . 2.3900000000000001 115.68 -178.952 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.7 m -65.61 -43.49 89.46 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 121.114 1.779 . . . . 1.73 112.128 177.986 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -50.4 -53.02 32.45 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.29 1.036 . . . . 3.2599999999999998 112.866 -178.327 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -61.52 -17.93 56.91 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.318 0.858 . . . . 3.0800000000000001 113.318 179.481 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -95.66 -42.3 8.46 Favored 'General case' 0 C--O 1.225 -0.184 0 C-N-CA 124.699 1.2 . . . . 3.4399999999999999 112.329 178.438 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -44.39 -53.39 6.89 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.26 1.024 . . . . 2.1000000000000001 109.544 162.363 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.8 mt -52.84 -15.88 0.86 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.12 2.168 . . . . 2.04 116.568 174.071 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.21 1.09 10.78 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.667 1.576 . . . . 3.29 114.187 174.746 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.92 -43.99 6.51 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.985 0.914 . . . . 2.8900000000000001 111.766 164.643 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -88.03 -40.36 13.91 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.977 1.711 . . . . 3.2400000000000002 112.496 -179.08 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.84 25.19 10.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.592 1.557 . . . . 3.02 112.253 -175.68 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -67.5 -23.84 65.51 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 120.917 -1.114 . . . . 1.74 113.708 -174.23 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -86.13 -20.55 28.49 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.245 0.93 . . . . 2.3799999999999999 112.128 -169.026 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.7 mtm -98.23 -8.24 27.72 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 114.954 1.464 . . . . 3.8100000000000001 114.954 168.275 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tp -77.72 71.47 4.2 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 120.445 1.475 . . . . 3.3100000000000001 111.821 -176.43 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.0 m -70.69 3.56 3.08 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 117.416 2.376 . . . . 4.2300000000000004 117.416 -166.587 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -177.32 158.39 1.44 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 127.333 2.253 . . . . 5.5899999999999999 110.502 -179.418 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 53.8 m -58.24 -30.47 66.56 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.783 2.033 . . . . 4.1299999999999999 112.405 171.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.8 -33.41 68.0 Favored Glycine 0 N--CA 1.472 1.085 0 CA-C-N 120.48 1.491 . . . . 2.6200000000000001 113.605 175.938 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -64.63 -45.69 85.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.327 0.651 . . . . 3.8999999999999999 110.938 171.684 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.1 mmm-85 -61.94 -43.87 97.95 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 120.662 -1.274 . . . . 6.0599999999999996 113.638 169.082 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -53.35 -34.96 59.61 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 121.554 1.979 . . . . 4.3399999999999999 111.916 173.879 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.44 -17.55 60.77 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 115.013 1.486 . . . . 2.4100000000000001 115.013 174.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -80.22 -48.7 12.7 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.374 0.988 . . . . 1.79 110.822 163.794 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -63.06 -39.6 95.2 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.352 1.061 . . . . 2.5899999999999999 111.943 -174.826 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.401 ' HZ1' ' CD2' ' A' ' 62' ' ' LEU . 5.4 ptmm? -52.43 -29.12 22.88 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 113.841 1.052 . . . . 4.5899999999999999 113.841 172.588 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.401 ' CD2' ' HZ1' ' A' ' 61' ' ' LYS . 17.1 mt -78.85 -36.45 42.32 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 124.045 0.938 . . . . 2.0099999999999998 111.986 -177.704 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.0 mm -57.69 -51.07 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.608 1.163 . . . . 1.99 109.835 -178.199 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -70.55 -31.62 68.73 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.882 1.273 . . . . 2.6000000000000001 112.959 -179.708 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -65.47 -35.39 80.76 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.626 0.77 . . . . 3.98 112.158 167.568 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.7 tp -75.11 -20.48 59.42 Favored 'General case' 0 C--O 1.221 -0.421 0 O-C-N 120.9 -1.125 . . . . 3.9500000000000002 111.562 174.216 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -70.43 -5.14 26.31 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 115.585 1.698 . . . . 2.7200000000000002 115.585 170.275 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.77 -2.83 31.65 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 113.444 0.905 . . . . 3.9900000000000002 113.444 157.321 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -143.02 179.61 6.94 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 127.264 2.225 . . . . 3.25 110.815 -169.662 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 26.9 t60 101.03 71.64 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 128.231 2.613 . . . . 6.5599999999999996 112.31 159.149 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.86 46.7 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 130.325 3.45 . . . . 6.4400000000000004 114.692 -169.534 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.28 -14.75 2.21 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 126.262 1.886 . . . . 3.8999999999999999 114.275 -176.074 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.2 mmt85 -90.37 -167.53 1.86 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.662 1.985 . . . . 8.3800000000000008 112.059 -177.538 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.7 mm -139.65 132.06 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 127.637 2.375 . . . . 4.2599999999999998 106.542 175.434 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 71.0 m -113.26 146.83 38.7 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.833 0.853 . . . . 2.9700000000000002 110.727 162.584 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -60.65 -38.02 83.48 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.348 0.87 . . . . 3.3999999999999999 113.348 -174.935 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -71.97 -8.83 56.77 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.317 1.047 . . . . 4.4800000000000004 112.883 -176.443 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.82 -56.33 18.42 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.119 0.872 . . . . 3.9900000000000002 111.095 175.526 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -58.58 -33.2 69.69 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.207 -1.558 . . . . 3.8100000000000001 112.212 176.007 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 23.5 t-105 -67.72 -59.49 3.28 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.951 0.723 . . . . 1.45 112.951 178.108 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.9 t -60.28 -23.9 64.52 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.023 1.329 . . . . 2.73 112.147 178.181 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 65.0 mt -73.97 -46.67 42.46 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 117.807 -1.092 . . . . 1.72 113.44 169.355 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 8.2 mm -55.05 -40.8 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 CA-C-N 121.732 2.06 . . . . 2.2000000000000002 112.423 -178.298 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.74 -21.79 63.46 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-N 118.251 0.478 . . . . 0.59999999999999998 113.39 177.135 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.8 -19.45 76.79 Favored Glycine 0 CA--C 1.532 1.143 0 O-C-N 121.236 -1.155 . . . . 0.67000000000000004 114.068 177.963 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -110.2 -34.19 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.904 1.281 . . . . 2.29 111.502 170.495 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.5 m -77.4 85.18 3.8 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.285 1.434 . . . . 1.6399999999999999 108.226 177.667 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -170.33 -68.4 0.04 OUTLIER Glycine 0 CA--C 1.532 1.134 0 C-N-CA 126.077 1.799 . . . . 1.27 111.846 -172.753 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -59.28 -67.83 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.654 2.903 . . . . 1.3 110.877 168.563 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.8 pt -65.84 -20.78 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 117.717 -1.135 . . . . 2.3300000000000001 113.614 177.677 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.54 71.19 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.632 1.56 . . . . 1.97 112.32 173.677 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -63.67 -41.23 98.21 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.848 -1.157 . . . . 5.21 112.585 173.9 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.81 -35.17 75.81 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.219 1.008 . . . . 2.3900000000000001 112.722 178.945 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.2 mt -55.45 -52.71 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 120.854 -1.154 . . . . 2.23 110.161 171.173 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -67.27 -35.71 80.08 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.683 0.623 . . . . 1.8100000000000001 112.683 -176.237 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.263 4.6 pt-20 -75.41 -19.67 59.37 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 119.582 1.083 . . . . 3.0499999999999998 112.514 174.748 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.49 -43.64 22.79 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 117.56 -1.209 . . . . 2.3399999999999999 114.212 172.72 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -61.65 -17.85 57.09 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 119.785 1.175 . . . . 2.3700000000000001 111.762 177.286 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.566 0 C-N-CA 125.325 1.45 . . . . 2.8199999999999998 110.058 176.175 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 . . . . . 0 N--CA 1.477 0.886 0 N-CA-C 109.59 -0.522 . . . . 3.6400000000000001 109.59 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 22.3 p -70.48 152.55 43.9 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 119.81 1.186 . . . . 1.9099999999999999 111.339 -172.931 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -59.31 -36.08 74.98 Favored 'General case' 0 C--O 1.221 -0.443 0 O-C-N 121.526 -0.734 . . . . 2.1299999999999999 111.851 -177.42 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -44.72 89.19 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.497 1.044 . . . . 2.4500000000000002 111.149 175.261 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -65.68 -56.46 12.0 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.077 0.951 . . . . 2.8399999999999999 111.004 -179.569 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.0 tmtt? -58.33 -27.72 64.41 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 120.941 -1.099 . . . . 5.2699999999999996 112.611 172.137 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.98 -42.14 76.96 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 119.344 -2.097 . . . . 1.6399999999999999 113.08 167.842 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 22.1 t -59.81 -31.08 46.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 CA-C-N 120.299 1.409 . . . . 2.0800000000000001 111.663 168.746 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 69.9 mt -58.57 -60.68 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 O-C-N 120.354 -1.467 . . . . 2.2000000000000002 111.217 163.097 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 32.9 t -52.94 -44.28 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 124.41 1.084 . . . . 1.9399999999999999 112.652 -175.601 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 2.6 pp -70.65 -25.11 62.85 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.32 -0.863 . . . . 5.25 112.777 -179.007 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 42.4 t -78.0 -31.66 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 124.199 1.0 . . . . 1.96 110.57 178.045 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -54.14 -49.86 68.25 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.719 0.808 . . . . 2.8399999999999999 110.284 164.801 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -63.82 -19.26 64.88 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 115.165 1.543 . . . . 2.2799999999999998 115.165 -178.804 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -80.97 -62.11 1.76 Allowed 'General case' 0 C--O 1.237 0.434 0 O-C-N 121.308 -0.87 . . . . 3.5699999999999998 112.266 173.471 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -69.61 -21.22 63.59 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 113.598 0.962 . . . . 2.9700000000000002 113.598 -171.393 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.42 -20.8 66.53 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.429 1.27 . . . . 4.0800000000000001 114.429 168.497 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 14.3 m-30 -106.3 -36.68 6.78 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.707 1.203 . . . . 3.2999999999999998 114.055 177.785 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.478 0.969 0 CA-C-N 119.168 0.894 . . . . 3.8500000000000001 111.449 172.309 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 7.8 pt . . . . . 0 N--CA 1.473 0.707 0 CA-C-O 122.248 1.023 . . . . 3.98 112.041 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 36.0 t -82.48 154.11 25.28 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.189 -0.914 . . . . 3.5099999999999998 109.907 157.601 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -49.49 -34.42 16.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.211 1.004 . . . . 3.21 112.027 170.679 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 99.7 p -61.73 -15.75 43.4 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.194 1.183 . . . . 2.21 114.194 177.669 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 69.7 m -65.89 -37.2 85.5 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.931 1.242 . . . . 1.73 112.208 169.442 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -58.42 -49.23 78.03 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.184 1.357 . . . . 3.98 113.295 -173.793 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 16.2 ptt85 -57.54 -12.44 2.73 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.286 1.034 . . . . 4.5700000000000003 113.215 174.243 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -109.82 -42.79 4.16 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 125.93 1.692 . . . . 3.3100000000000001 114.303 179.374 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -40.95 -49.88 3.26 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.885 1.674 . . . . 2.3300000000000001 110.217 163.135 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.6 mt -61.63 -24.64 66.85 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 114.633 1.346 . . . . 2.2400000000000002 114.633 177.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -103.83 2.78 33.13 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.411 1.46 . . . . 2.9900000000000002 114.124 175.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.09 -44.17 4.44 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.448 1.099 . . . . 2.4500000000000002 113.22 167.246 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -96.9 -15.58 21.12 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.803 1.241 . . . . 3.6400000000000001 114.222 -178.777 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.91 26.17 8.28 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.286 1.834 . . . . 2.5899999999999999 112.271 176.265 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -68.76 -16.12 63.71 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 116.046 1.869 . . . . 1.3200000000000001 116.046 -167.868 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -93.54 -38.23 11.49 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 119.644 1.111 . . . . 2.3799999999999999 110.509 -175.141 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 36.5 mtm -77.64 -10.19 59.38 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 113.914 1.079 . . . . 3.8100000000000001 113.914 167.808 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.49 44.04 0.07 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.692 1.997 . . . . 2.9300000000000002 111.946 167.413 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.78 29.72 0.26 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.84 1.656 . . . . 4.7400000000000002 113.598 -167.801 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -174.41 163.89 3.75 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.308 2.643 . . . . 6.6200000000000001 108.886 -161.991 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 47.2 m -107.43 -17.94 13.99 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 125.384 1.474 . . . . 3.7200000000000002 112.816 178.054 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -65.77 -41.69 95.57 Favored Glycine 0 CA--C 1.528 0.878 0 CA-C-N 119.234 0.924 . . . . 2.6600000000000001 112.036 175.44 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -57.53 -43.25 84.18 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 117.816 0.808 . . . . 4.0800000000000001 112.643 174.066 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.39 -50.27 72.08 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 124.133 0.973 . . . . 5.7999999999999998 112.957 171.395 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -61.57 -33.01 73.14 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.835 0.743 . . . . 3.73 112.02 177.838 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . 0.406 ' HA ' ' HG2' ' B' ' 164' ' ' LYS . . . -68.07 -15.74 63.72 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.395 1.257 . . . . 2.27 114.395 173.722 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.44 -44.97 23.38 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.957 0.799 . . . . 1.8500000000000001 110.955 164.301 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -61.91 -40.23 94.74 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.978 0.911 . . . . 2.7200000000000002 112.375 -175.722 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . 0.406 ' HG2' ' HA ' ' B' ' 161' ' ' ALA . 2.9 ptmm? -52.95 -26.31 14.71 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.133 1.16 . . . . 5.0199999999999996 114.133 170.053 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 44.5 mt -83.08 -29.96 28.37 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 118.08 -0.962 . . . . 2.6899999999999999 112.797 176.886 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 41.0 mm -58.33 -55.01 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 118.922 0.783 . . . . 2.29 108.933 177.868 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -61.53 -34.14 75.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.777 1.029 . . . . 3.1400000000000001 113.777 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -70.24 -33.7 71.96 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.598 1.159 . . . . 3.9100000000000001 111.979 175.147 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 24.3 tp -78.5 -21.96 48.16 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 123.87 0.868 . . . . 3.8100000000000001 111.205 172.275 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.52 -8.85 50.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.939 1.696 . . . . 2.96 115.455 174.48 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -73.31 -3.45 27.11 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 113.84 1.052 . . . . 3.9500000000000002 113.84 158.874 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -142.87 179.72 6.85 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 127.187 2.195 . . . . 3.21 111.402 -169.447 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 27.1 t60 100.71 80.42 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 128.461 2.704 . . . . 6.3399999999999999 112.027 160.364 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -72.57 42.57 0.1 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 129.036 2.935 . . . . 6.5 114.404 -167.773 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 75.93 -17.73 3.58 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 126.127 1.822 . . . . 3.71 114.671 -179.499 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -87.57 -155.89 0.32 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.8 1.64 . . . . 8.4900000000000002 111.727 177.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.4 mm -145.98 136.09 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 128.213 2.605 . . . . 4.2300000000000004 106.134 178.406 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.5 m -113.88 153.14 29.71 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.606 0.762 . . . . 2.96 111.257 159.894 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -65.17 -42.43 93.68 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 112.743 0.646 . . . . 3.0800000000000001 112.743 -176.268 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -68.97 -14.27 62.94 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.877 1.271 . . . . 4.3300000000000001 113.087 -173.986 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -56.59 -57.98 10.02 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.8 0.84 . . . . 4.1100000000000003 109.822 174.157 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -54.12 -39.71 66.67 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.026 -1.047 . . . . 3.96 112.611 178.354 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -70.68 -53.9 13.93 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.749 0.648 . . . . 1.8100000000000001 112.749 -179.259 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -62.75 -20.42 64.93 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.701 1.2 . . . . 2.6400000000000001 113.117 -178.24 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 95.9 mt -76.38 -41.11 49.08 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.83 -1.169 . . . . 1.76 113.933 168.143 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 13.8 mm -58.39 -46.26 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 CA-C-N 120.935 1.698 . . . . 1.9299999999999999 112.278 -173.976 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.65 -21.72 60.9 Favored Glycine 0 CA--C 1.533 1.2 0 CA-C-N 118.441 0.564 . . . . 0.69999999999999996 113.4 177.33 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.05 -8.78 65.45 Favored Glycine 0 CA--C 1.535 1.287 0 O-C-N 121.078 -1.248 . . . . 0.89000000000000001 114.183 175.845 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.2 mp -120.39 -37.76 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 126.035 1.734 . . . . 2.5800000000000001 111.544 166.222 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 8.0 m -78.87 78.76 5.3 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.223 1.809 . . . . 1.6499999999999999 108.088 177.974 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -169.06 -65.78 0.03 OUTLIER Glycine 0 CA--C 1.524 0.627 0 CA-C-O 118.282 -1.288 . . . . 1.26 111.127 -174.644 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -57.74 -62.89 0.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.906 2.404 . . . . 1.0900000000000001 110.817 166.05 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.1 pp -74.96 -14.66 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.903 1.229 . . . . 2.0800000000000001 113.142 -177.535 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.28 -36.41 84.02 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.599 0.592 . . . . 2.1899999999999999 112.599 176.514 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -62.93 -41.4 99.47 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 120.624 -1.298 . . . . 5.1900000000000004 111.454 171.417 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.97 -37.09 73.56 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.261 1.424 . . . . 2.6499999999999999 113.019 174.14 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 84.9 mt -54.35 -54.15 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 O-C-N 121.094 -1.004 . . . . 2.1000000000000001 110.755 169.032 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -67.71 -34.62 77.24 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.478 0.918 . . . . 1.72 113.478 -175.495 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -74.14 -20.24 60.3 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 118.521 -0.752 . . . . 3.6600000000000001 112.268 173.758 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -78.61 -40.85 33.28 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 114.996 1.48 . . . . 2.21 114.996 172.924 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -62.98 -13.65 37.79 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 120.72 1.6 . . . . 2.3599999999999999 112.144 174.133 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.08 -71.5 0.71 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.308 1.443 . . . . 3.21 109.616 175.974 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 . . . . . 0 N--CA 1.484 1.229 1 C-N-CA 134.251 5.02 . . . . 5.25 116.092 172.814 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 109.808 -0.441 . . . . 3.6000000000000001 109.808 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -88.16 146.01 25.62 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.893 -0.78 . . . . 1.8400000000000001 108.893 159.01 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -67.26 -23.9 65.74 Favored 'General case' 0 C--O 1.212 -0.899 0 CA-C-O 117.325 -1.322 . . . . 2.9300000000000002 112.172 177.978 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -49.82 72.96 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 121.828 2.104 . . . . 2.27 109.5 173.487 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -66.52 -55.13 16.95 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 119.294 -0.384 . . . . 2.8599999999999999 111.752 -176.45 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.2 tptt -63.33 -25.51 68.34 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.868 -1.145 . . . . 7.4000000000000004 113.823 175.121 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.7 -43.94 78.9 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.082 -1.637 . . . . 1.8100000000000001 112.571 166.072 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 19.0 t -56.89 -39.93 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.317 1.417 . . . . 1.71 110.262 170.212 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.6 mt -58.61 -52.39 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-O 118.052 -0.975 . . . . 2.1400000000000001 111.281 169.623 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.3 t -57.39 -36.34 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 125.248 1.419 . . . . 1.6200000000000001 112.585 178.868 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.25 -41.01 74.07 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 121.268 -0.895 . . . . 2.02 111.877 174.128 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.16 -44.82 95.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.077 0.551 . . . . 1.6799999999999999 111.041 176.076 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -62.72 -41.6 99.23 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 119.074 -0.488 . . . . 3.54 110.719 173.707 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -62.4 -23.91 67.1 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.408 1.262 . . . . 2.1499999999999999 114.408 -174.585 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -78.02 -59.13 2.91 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.206 1.002 . . . . 3.02 111.063 169.666 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -62.31 -31.88 72.55 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.543 0.942 . . . . 3.54 113.543 -174.967 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.2 ptmt -56.4 -22.14 29.62 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 120.241 1.382 . . . . 3.6099999999999999 114.148 176.746 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -88.72 -12.69 41.57 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.137 1.162 . . . . 4.0199999999999996 114.137 175.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 28.8 m . . . . . 0 N--CA 1.482 1.166 0 CA-C-N 120.094 1.316 . . . . 3.5699999999999998 111.78 -179.004 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 31.6 pt . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 110.147 -0.316 . . . . 4.04 110.147 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.5 m -88.07 159.14 18.38 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.055 -1.028 . . . . 3.1000000000000001 111.347 171.611 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -43.2 -35.07 1.27 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.365 1.866 . . . . 3.46 115.574 -179.451 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.5 m -56.42 -29.98 62.23 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.897 1.443 . . . . 2.4900000000000002 114.897 174.153 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.1 m -81.33 -18.88 44.16 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.754 1.02 . . . . 1.49 113.754 -173.362 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -64.85 -51.7 60.62 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.421 1.01 . . . . 3.4900000000000002 110.932 174.164 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.4 ptt180 -65.23 -31.77 73.09 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.319 0.647 . . . . 2.8300000000000001 112.458 179.673 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -70.45 -52.28 23.27 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.494 1.118 . . . . 3.8999999999999999 110.057 174.741 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -50.25 -43.23 52.98 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 121.179 -0.951 . . . . 2.1600000000000001 111.88 172.072 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.6 mt -62.28 -15.31 46.7 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 115.921 1.823 . . . . 2.1000000000000001 115.921 174.617 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -106.66 -7.75 17.21 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.314 1.416 . . . . 2.7599999999999998 114.144 169.705 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -56.26 4.33 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.647 1.112 . . . . 4.0800000000000001 110.97 160.809 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -85.64 -48.42 8.89 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.26 0.624 . . . . 2.6299999999999999 111.624 -167.868 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 tt -106.14 50.24 0.78 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.14 1.376 . . . . 3.25 110.841 -168.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -94.5 -20.96 19.2 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 117.267 2.321 . . . . 1.3500000000000001 117.267 -170.758 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.15 -26.8 39.18 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 121.786 2.085 . . . . 2.2000000000000002 112.962 -177.071 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.1 tpp -65.94 24.84 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 128.965 2.906 . . . . 2.71 115.66 175.949 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.2 mp -109.62 128.3 55.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 128.108 2.563 . . . . 3.6200000000000001 110.874 -173.611 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.415 ' H ' ' ND2' ' A' ' 55' ' ' ASN . 4.7 m -106.22 -17.68 14.23 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.741 1.216 . . . . 4.3200000000000003 112.789 172.765 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -177.15 166.58 2.39 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 129.24 3.016 . . . . 4.2999999999999998 108.289 -173.389 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -27.59 -50.32 0.06 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 128.787 2.835 . . . . 2.8100000000000001 112.754 156.415 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.31 -38.48 49.76 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.725 1.631 . . . . 1.73 114.484 -176.943 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.415 ' ND2' ' H ' ' A' ' 51' ' ' SER . 2.8 m120 -60.78 -33.01 72.32 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.317 1.058 . . . . 3.8799999999999999 112.003 178.55 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.72 -39.7 18.2 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.754 1.222 . . . . 9.5199999999999996 112.876 171.016 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.3 mmmt -61.38 -30.41 70.52 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.902 1.228 . . . . 4.1299999999999999 112.814 179.862 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -48.78 -47.49 41.85 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.954 0.902 . . . . 2.3799999999999999 112.789 165.73 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.41 -41.66 98.72 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.077 1.351 . . . . 1.75 112.241 174.692 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -61.41 -36.68 80.99 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.348 0.659 . . . . 2.27 112.566 178.077 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.9 mtmt -52.3 -37.77 56.65 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.437 1.017 . . . . 4.2800000000000002 112.499 174.378 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.5 mt -72.27 -31.53 65.85 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.551 1.54 . . . . 1.73 112.992 -179.024 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.46 -36.26 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 118.555 0.616 . . . . 2.0899999999999999 111.125 175.476 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -64.76 -50.25 67.56 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.29 1.436 . . . . 3.73 111.047 173.596 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -56.05 -29.95 61.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.99 0.916 . . . . 4.2199999999999998 112.301 178.147 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.5 mt -89.25 -18.2 27.51 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 114.763 1.394 . . . . 4.0 114.763 177.189 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.36 -22.18 66.87 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.382 0.992 . . . . 3.8500000000000001 112.665 169.999 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.9 -18.74 46.17 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.363 1.616 . . . . 3.2400000000000002 115.363 168.892 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -129.95 -19.1 3.29 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 116.179 1.918 . . . . 3.1800000000000002 116.179 -166.008 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -144.28 154.44 43.07 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.6 1.091 . . . . 5.2999999999999998 113.267 -155.037 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.7 t0 99.38 158.38 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 129.848 3.259 . . . . 8.3800000000000008 108.903 -176.404 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 74.1 -54.68 2.26 Favored Glycine 0 CA--C 1.533 1.186 0 O-C-N 120.561 -1.337 . . . . 4.2000000000000002 110.999 -160.417 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -105.32 142.82 34.42 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.429 1.492 . . . . 7.3700000000000001 110.541 158.311 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.6 mm -104.67 149.05 8.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 N-CA-C 107.769 -1.197 . . . . 3.2000000000000002 107.769 163.229 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.4 t -125.41 145.55 50.01 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.28 1.032 . . . . 1.97 108.563 174.064 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -72.63 -51.72 18.4 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 122.418 1.104 . . . . 3.4199999999999999 111.475 -170.51 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -42.66 -38.01 1.9 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 129.866 3.266 . . . . 3.2400000000000002 114.416 170.799 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -67.53 -37.82 83.32 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.658 0.984 . . . . 4.9299999999999997 113.658 -177.288 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -60.83 -47.92 84.15 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 120.54 1.518 . . . . 2.8500000000000001 111.248 172.437 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -63.44 -39.59 94.89 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 119.102 -0.475 . . . . 0.58999999999999997 110.817 -179.509 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 95.2 m -57.22 -52.74 64.12 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.425 1.49 . . . . 2.9900000000000002 110.296 171.15 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 27.8 mt -52.5 -44.33 65.61 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 118.247 -0.882 . . . . 2.1000000000000001 113.293 178.378 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 30.3 mm -55.49 -37.0 43.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 120.072 1.305 . . . . 1.75 111.955 -175.585 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.09 -15.68 58.8 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.031 0.824 . . . . 0.59999999999999998 114.447 176.773 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.73 -16.2 77.88 Favored Glycine 0 CA--C 1.534 1.236 0 CA-C-N 118.699 1.25 . . . . 0.85999999999999999 113.682 172.006 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 mp -103.42 -53.31 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-N 118.638 1.219 . . . . 1.98 109.368 167.669 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.1 m -73.92 61.75 0.81 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 128.002 2.521 . . . . 2.1299999999999999 109.326 171.25 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -139.14 -78.3 0.06 OUTLIER Glycine 0 CA--C 1.527 0.812 0 C-N-CA 125.87 1.7 . . . . 1.0900000000000001 110.017 174.066 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -58.8 -49.19 12.16 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.122 2.548 . . . . 1.0800000000000001 111.669 179.034 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -75.95 -10.98 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 114.105 1.15 . . . . 1.99 114.105 176.32 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.59 -38.12 74.01 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.213 -0.929 . . . . 2.3399999999999999 112.641 -176.155 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -59.94 -39.73 86.54 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 120.432 1.469 . . . . 3.4100000000000001 111.165 165.309 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.78 -38.13 74.92 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 124.301 1.041 . . . . 2.3300000000000001 111.374 -178.667 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.5 mt -50.17 -57.77 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.623 1.101 . . . . 2.0499999999999998 111.076 169.963 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 79.1 t60 -75.68 -5.15 44.17 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 114.148 1.166 . . . . 1.76 114.148 -176.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.265 1.9 pt-20 -107.52 -11.43 15.49 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 119.841 -1.787 . . . . 3.2000000000000002 114.014 167.461 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.443 ' C ' ' H ' ' A' ' 99' ' ' GLN . 8.0 tp60 -83.63 -45.45 13.45 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.877 1.671 . . . . 2.9100000000000001 110.13 171.144 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -73.71 11.49 0.83 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 123.879 1.799 . . . . 2.8799999999999999 111.524 176.185 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.443 ' H ' ' C ' ' A' ' 97' ' ' GLN . 16.0 mm-40 . . . . . 0 C--N 1.327 -0.405 0 C-N-CA 126.862 2.065 . . . . 2.2200000000000002 110.411 165.878 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 . . . . . 0 N--CA 1.486 1.366 0 N-CA-C 108.806 -0.813 . . . . 3.8599999999999999 108.806 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.3 p -99.63 150.37 22.33 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.068 0.849 . . . . 1.9099999999999999 109.477 162.343 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -69.57 -22.6 63.52 Favored 'General case' 0 C--O 1.212 -0.88 0 CA-C-O 117.545 -1.217 . . . . 2.96 112.643 178.232 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -53.79 53.38 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 121.954 2.161 . . . . 2.1899999999999999 109.084 171.915 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -53.45 52.4 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 122.763 0.425 . . . . 2.5600000000000001 110.897 -177.367 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -65.35 -27.37 68.53 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 120.969 -1.082 . . . . 8.2899999999999991 113.858 177.045 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.19 -39.89 90.01 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.042 -1.661 . . . . 1.71 113.156 165.217 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 34.8 t -57.54 -39.79 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 120.718 1.599 . . . . 1.71 110.126 169.354 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 2.9 mt -58.38 -54.05 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-O 118.332 -0.842 . . . . 2.4199999999999999 112.254 169.041 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 20.4 t -56.47 -44.04 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 125.903 1.681 . . . . 1.78 112.922 179.467 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.2 mp -64.46 -44.73 90.16 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.492 1.117 . . . . 2.04 110.967 178.244 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 55.8 t -65.73 -40.97 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 118.692 -0.67 . . . . 1.8500000000000001 111.157 179.409 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.64 -42.76 84.07 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.773 0.715 . . . . 3.3799999999999999 111.608 168.292 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.35 -23.98 67.09 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.016 1.487 . . . . 2.1499999999999999 115.016 -175.344 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -79.36 -59.4 2.77 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.4 0.68 . . . . 3.3500000000000001 111.065 168.71 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -61.98 -31.71 72.1 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.563 0.949 . . . . 3.52 113.563 -173.69 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -55.68 -21.25 17.33 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.318 1.447 . . . . 3.2599999999999998 114.159 176.708 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -89.06 -15.38 34.16 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.096 1.147 . . . . 3.8300000000000001 114.096 175.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.48 1.057 0 CA-C-N 119.723 1.147 . . . . 3.5899999999999999 111.919 -178.12 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 30.8 pt . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 109.468 -0.567 . . . . 4.1500000000000004 109.468 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 47.0 m -92.85 163.63 13.64 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.939 -1.101 . . . . 3.0600000000000001 111.704 172.161 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -39.28 -41.05 0.84 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.691 1.996 . . . . 3.6800000000000002 115.338 178.393 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.1 m -57.92 -29.56 65.21 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.349 1.24 . . . . 2.5 114.349 179.154 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 36.8 m -79.58 -21.13 45.43 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.777 1.029 . . . . 1.52 113.777 -173.866 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -64.7 -52.42 57.26 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.187 0.903 . . . . 3.0099999999999998 110.829 174.517 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -65.87 -31.72 72.83 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 122.974 0.51 . . . . 3.25 112.296 179.487 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -69.05 -51.22 41.18 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.888 0.875 . . . . 3.9700000000000002 110.409 174.163 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -51.8 -42.82 62.77 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.552 1.141 . . . . 2.1699999999999999 112.434 173.107 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 15.2 mt -60.12 -13.59 12.77 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.87 1.668 . . . . 2.2000000000000002 115.492 173.415 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.26 -2.85 15.56 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.367 1.439 . . . . 2.7200000000000002 114.061 170.488 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.52 -56.38 3.77 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.381 0.991 . . . . 4.1200000000000001 110.756 159.653 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -88.38 -43.41 11.52 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 122.011 -0.43 . . . . 2.6299999999999999 111.358 -166.578 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 tt -111.33 46.95 1.05 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.067 1.747 . . . . 3.2599999999999998 110.643 -169.795 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -93.7 -14.21 26.6 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 116.303 1.964 . . . . 1.3799999999999999 116.303 -170.872 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.57 -19.06 26.81 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 121.082 1.765 . . . . 2.2599999999999998 112.311 -178.67 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.7 tpp -72.48 24.38 0.05 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 127.405 2.282 . . . . 2.8199999999999998 114.158 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 9.6 mp -110.51 128.42 55.62 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.681 2.392 . . . . 3.4500000000000002 110.761 -169.809 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 4.2 m -103.33 -21.58 13.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.665 1.186 . . . . 4.4199999999999999 112.327 171.737 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -173.66 167.94 4.45 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.126 2.971 . . . . 4.5700000000000003 107.978 -173.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -27.7 -49.64 0.05 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 128.491 2.716 . . . . 3.0699999999999998 112.546 156.265 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.59 -38.83 36.5 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 126.017 1.77 . . . . 1.8700000000000001 114.825 -177.63 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -62.1 -35.42 78.63 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.517 1.158 . . . . 3.8700000000000001 111.855 179.567 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.01 -36.43 23.14 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.623 1.169 . . . . 9.9900000000000002 112.544 172.37 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -61.06 -30.35 70.28 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.725 1.148 . . . . 4.2400000000000002 113.171 175.566 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -52.7 -44.07 66.07 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.193 0.997 . . . . 2.2200000000000002 112.816 167.577 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -65.01 -42.84 94.1 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.161 1.384 . . . . 1.7 111.446 173.323 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -61.29 -35.95 78.73 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.582 0.956 . . . . 2.0499999999999998 113.582 178.314 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -51.95 -37.98 54.87 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.411 1.005 . . . . 4.2300000000000004 112.192 172.786 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 17.9 mt -72.03 -39.21 69.29 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 125.28 1.432 . . . . 1.72 113.015 -178.14 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 30.7 mm -52.27 -34.68 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 125.101 1.361 . . . . 1.96 111.98 175.825 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -61.94 -52.24 64.85 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.715 1.206 . . . . 3.8799999999999999 111.617 173.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -63.2 -32.44 73.84 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.608 1.163 . . . . 4.5999999999999996 112.478 177.649 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.09 -26.0 64.71 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.661 1.984 . . . . 4.4900000000000002 111.947 172.43 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.06 -25.35 64.41 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.866 1.061 . . . . 3.6899999999999999 113.866 172.242 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.65 -24.1 39.22 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.076 1.139 . . . . 3.2000000000000002 114.076 174.23 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -121.92 -19.36 6.72 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 116.248 1.944 . . . . 3.1099999999999999 116.248 -167.138 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -138.49 158.41 44.31 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.08 1.309 . . . . 5.3099999999999996 114.147 -157.276 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.5 t0 98.35 157.9 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 129.698 3.199 . . . . 8.2699999999999996 108.633 -179.231 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.65 -58.23 2.1 Favored Glycine 0 CA--C 1.532 1.113 0 O-C-N 120.635 -1.291 . . . . 4.2199999999999998 110.716 -159.493 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 -101.06 139.14 37.16 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.639 1.176 . . . . 7.3200000000000003 110.662 157.886 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 42.0 mm -102.17 144.74 12.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 107.623 -1.251 . . . . 3.4500000000000002 107.623 164.599 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.1 t -117.53 144.07 45.46 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.321 -0.992 . . . . 2.02 108.321 172.192 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -74.31 -52.84 11.05 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 122.891 1.329 . . . . 3.4900000000000002 111.163 -171.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -42.89 -35.34 1.17 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 129.979 3.312 . . . . 3.1899999999999999 114.927 168.056 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -67.31 -38.5 85.05 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.904 0.705 . . . . 4.6600000000000001 112.904 -178.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -58.81 -48.34 81.63 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.122 -1.612 . . . . 3.0600000000000001 111.168 172.202 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 27.7 t-105 -63.38 -41.29 98.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.85 0.46 . . . . 0.63 110.898 -178.706 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 90.1 m -56.06 -52.44 64.27 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.391 1.477 . . . . 2.98 110.354 172.102 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 25.8 mt -56.6 -43.37 80.07 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 113.684 0.994 . . . . 2.0 113.684 179.635 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 28.5 mm -53.33 -38.85 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-N 120.22 1.373 . . . . 1.77 111.685 -178.254 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.61 -16.89 59.43 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.17 0.891 . . . . 0.56000000000000005 114.295 177.89 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.72 -13.88 80.71 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 118.682 1.241 . . . . 0.89000000000000001 113.713 172.685 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -102.57 -54.85 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-N 118.758 1.279 . . . . 1.9199999999999999 109.007 165.16 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 24.7 m -73.71 64.52 0.93 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 127.316 2.246 . . . . 2.1899999999999999 108.935 171.582 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -143.64 -79.78 0.05 OUTLIER Glycine 0 CA--C 1.524 0.6 0 C-N-CA 125.601 1.572 . . . . 1.1200000000000001 109.892 177.396 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -60.33 -46.72 16.9 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.027 2.485 . . . . 1.27 111.894 178.57 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.9 pt -77.42 -10.29 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 N-CA-C 114.023 1.12 . . . . 2.1899999999999999 114.023 176.764 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.45 -39.21 81.54 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 120.791 -1.193 . . . . 2.25 113.022 -176.804 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -59.4 -46.15 89.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.911 -1.118 . . . . 3.4500000000000002 111.289 167.291 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 9.3 tt -53.07 -41.81 65.24 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 124.013 0.925 . . . . 3.0 111.487 179.199 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 88.9 mt -49.76 -59.39 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-N 119.521 1.055 . . . . 2.04 111.544 171.2 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -70.94 -15.92 62.62 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.809 -1.182 . . . . 1.8300000000000001 113.429 -178.361 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -78.97 -12.67 60.04 Favored 'General case' 0 CA--C 1.551 0.984 0 O-C-N 120.468 -1.395 . . . . 3.6899999999999999 112.187 167.534 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -111.72 -31.75 6.87 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.954 1.702 . . . . 4.3399999999999999 114.439 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -63.77 -6.65 6.02 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 121.241 1.837 . . . . 2.6200000000000001 111.922 164.37 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -108.12 -80.16 0.57 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.356 1.462 . . . . 2.4700000000000002 111.272 168.206 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 . . . . . 0 N--CA 1.477 0.895 0 C-N-CA 130.783 3.633 . . . . 4.5499999999999998 115.433 -178.028 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.142 0 N-CA-C 117.13 2.271 . . . . 3.5299999999999998 117.13 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.3 p 53.19 -172.4 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.33 2.652 . . . . 2.3900000000000001 111.21 -162.465 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -94.04 -40.63 9.98 Favored 'General case' 0 C--O 1.222 -0.388 0 O-C-N 120.902 -1.124 . . . . 2.77 110.865 158.044 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.12 -38.83 74.02 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.763 0.825 . . . . 2.1000000000000001 111.02 -171.087 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -69.53 -62.92 1.19 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 118.631 -0.7 . . . . 2.5299999999999998 111.105 -178.66 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -54.43 -29.76 50.38 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 120.429 1.468 . . . . 6.8899999999999997 113.743 172.495 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.36 -43.78 69.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 120.186 1.357 . . . . 1.71 111.254 173.341 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.0 t -57.24 -42.61 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 121.008 1.731 . . . . 1.8999999999999999 110.429 168.089 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.7 mt -55.32 -46.87 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-N 119.712 1.142 . . . . 2.1000000000000001 111.55 171.344 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.0 t -64.41 -41.34 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 120.234 1.379 . . . . 1.95 112.57 178.541 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.7 mp -64.21 -35.84 82.13 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.384 0.673 . . . . 1.9099999999999999 111.308 175.01 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.1 t -73.66 -35.72 44.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.707 1.603 . . . . 1.96 112.176 175.018 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -61.04 -58.02 10.17 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.309 1.044 . . . . 3.73 109.987 176.435 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -55.77 -14.96 2.62 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.17 1.544 . . . . 2.29 115.17 179.764 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -80.03 -66.07 0.92 Allowed 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.367 -1.458 . . . . 3.27 111.613 162.592 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -62.41 -26.95 68.76 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.174 1.176 . . . . 3.9700000000000002 114.174 -172.724 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HE3' ' CE1' ' A' ' 22' ' ' TYR . 5.7 ttpp -50.47 -19.94 1.0 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.802 2.041 . . . . 6.1399999999999997 115.108 174.793 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.548 ' CE1' ' HE3' ' A' ' 21' ' ' LYS . 91.5 m-85 -103.7 -11.73 17.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.103 1.361 . . . . 4.0499999999999998 114.103 177.15 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.471 0.616 0 CA-C-N 118.927 0.785 . . . . 4.0099999999999998 110.877 176.036 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.8 tt . . . . . 0 N--CA 1.471 0.608 0 CA-C-O 123.207 1.48 . . . . 3.4399999999999999 108.961 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -64.44 165.64 9.52 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 114.803 -1.089 . . . . 3.0499999999999998 109.06 169.42 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -45.37 -33.75 2.68 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.941 1.089 . . . . 3.6099999999999999 113.941 173.486 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 6.9 m -58.44 -33.76 70.07 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.893 1.442 . . . . 2.7799999999999998 114.893 174.707 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.0 m -85.62 -37.64 19.29 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.087 0.858 . . . . 1.53 111.72 -177.859 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -58.57 -49.52 77.12 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.295 -0.878 . . . . 3.8500000000000001 111.818 179.177 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -59.78 -29.65 68.35 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.107 1.151 . . . . 4.4400000000000004 114.107 177.771 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -86.29 -51.1 6.46 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.746 1.618 . . . . 3.3900000000000001 110.312 -176.242 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 15.4 tmm? -51.25 -37.27 46.16 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.751 1.22 . . . . 1.73 112.439 170.411 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.8 mt -70.29 -4.44 22.0 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 116.282 1.956 . . . . 2.4100000000000001 116.282 174.618 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -103.7 -4.29 23.92 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.489 1.495 . . . . 2.73 114.009 163.11 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -54.11 3.53 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.19 0.996 . . . . 2.8599999999999999 113.027 168.776 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -84.91 -22.45 29.28 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.199 1.555 . . . . 3.1400000000000001 115.199 -166.205 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 mt -126.73 50.55 1.93 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.889 2.076 . . . . 3.02 108.504 -177.488 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -91.13 -23.14 20.37 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.519 1.303 . . . . 1.6000000000000001 114.519 -166.323 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -90.91 -33.93 15.41 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.285 1.034 . . . . 1.95 112.464 -170.785 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.7 ptp -66.91 -4.51 9.61 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.343 1.457 . . . . 3.21 114.275 173.756 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.3 tp -76.11 117.57 17.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 125.961 1.704 . . . . 3.9300000000000002 111.837 -161.163 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.1 m -75.61 56.62 0.91 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.89 -1.131 . . . . 5.1900000000000004 111.348 161.19 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.613 ' CG ' ' H ' ' A' ' 53' ' ' THR . 33.4 t70 52.32 -150.52 0.32 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 127.806 2.443 . . . . 4.6600000000000001 113.913 175.467 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.613 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 52.7 p -54.82 -32.46 60.47 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 127.953 2.501 . . . . 3.4199999999999999 112.092 170.192 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.91 -50.89 52.9 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 124.431 1.015 . . . . 1.78 111.583 174.949 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.23 -36.95 82.75 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 117.492 0.646 . . . . 4.2000000000000002 112.603 173.481 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -56.01 -34.15 65.54 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.417 -1.427 . . . . 7.0300000000000002 113.089 -178.369 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -64.37 -22.25 66.89 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.858 1.429 . . . . 5.1299999999999999 114.858 173.165 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.83 -17.93 59.65 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.589 1.156 . . . . 1.8300000000000001 114.081 169.143 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -79.41 -51.04 9.91 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.257 0.935 . . . . 1.8600000000000001 110.804 163.971 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -70.49 -23.31 62.65 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.757 1.021 . . . . 2.3199999999999998 113.757 -174.918 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -56.43 -30.06 62.37 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.524 1.511 . . . . 4.0199999999999996 112.464 167.091 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 15.7 mt -81.01 -32.65 34.12 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.663 0.785 . . . . 2.1800000000000002 112.109 -179.039 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 27.0 mm -60.36 -49.68 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.115 1.366 . . . . 2.27 111.489 174.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -64.05 -38.01 89.5 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.347 0.659 . . . . 2.8999999999999999 112.074 175.794 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -61.97 -30.95 71.27 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.95 0.9 . . . . 4.0999999999999996 112.876 175.221 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.7 mt -88.51 -19.4 26.47 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 114.847 1.425 . . . . 3.6400000000000001 114.847 169.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -20.26 64.13 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.884 1.674 . . . . 3.6400000000000001 112.122 170.481 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.37 -17.68 51.23 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.556 1.687 . . . . 2.75 115.556 166.61 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -118.22 -21.83 7.99 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.673 1.578 . . . . 3.0899999999999999 114.476 -174.272 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.05 160.61 42.98 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.503 1.047 . . . . 4.5499999999999998 112.115 -162.674 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.461 ' CG ' ' H ' ' A' ' 72' ' ' GLY . 12.0 p-10 -98.27 -116.05 0.14 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.432 1.893 . . . . 6.1200000000000001 111.829 -175.108 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.461 ' H ' ' CG ' ' A' ' 71' ' ' ASP . . . -90.24 -3.33 72.73 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 125.425 1.488 . . . . 5.1200000000000001 113.471 159.07 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.4 mmt-85 -84.48 165.44 18.1 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.314 1.557 . . . . 8.9600000000000009 112.304 164.538 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.3 pp -149.56 156.06 7.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 130.264 3.426 . . . . 4.4699999999999998 107.787 174.109 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.4 t -97.77 175.32 6.21 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.588 1.155 . . . . 2.1200000000000001 112.27 167.047 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -66.51 -54.61 21.97 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.366 1.066 . . . . 3.9300000000000002 112.643 178.295 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.52 -30.42 70.62 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 126.232 1.813 . . . . 2.98 111.655 -175.936 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -64.3 -54.38 34.09 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 117.79 -1.1 . . . . 3.9399999999999999 111.014 175.415 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -50.9 -48.14 60.53 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 120.642 1.564 . . . . 3.9199999999999999 111.955 177.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.8 t-105 -60.94 -43.13 99.08 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 119.292 -0.385 . . . . 0.76000000000000001 111.54 179.659 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 87.2 m -60.87 -39.5 89.4 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.398 1.479 . . . . 2.8399999999999999 111.966 173.17 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 94.1 mt -60.68 -55.39 33.81 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-O 118.121 -0.942 . . . . 2.04 110.35 177.013 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.4 mm -47.52 -42.36 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 CA-C-N 119.583 1.083 . . . . 2.0299999999999998 112.919 -176.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.15 -30.06 69.77 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-O 118.943 -0.92 . . . . 0.71999999999999997 113.292 177.479 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.14 -21.64 64.81 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 118.259 -1.301 . . . . 0.57999999999999996 115.423 -177.366 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.0 mp -86.14 -39.67 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 CA-C-N 119.231 1.515 . . . . 2.3599999999999999 110.587 168.537 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 33.8 m -69.73 -39.91 76.53 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.979 1.711 . . . . 3.2599999999999998 111.549 -174.671 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -27.49 -67.02 0.07 OUTLIER Glycine 0 CA--C 1.535 1.332 0 C-N-CA 128.241 2.829 . . . . 2.27 116.391 -175.396 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.8 -33.56 2.18 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.147 2.565 . . . . 1.04 113.41 -173.626 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.4 pt -82.72 -20.97 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 118.981 0.81 . . . . 2.6099999999999999 113.177 -175.987 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -52.68 -50.29 63.58 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.072 2.149 . . . . 1.77 113.107 -178.175 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -48.11 -53.7 15.73 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.744 0.783 . . . . 4.7000000000000002 110.981 172.888 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.95 -38.35 76.1 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 118.211 -0.9 . . . . 3.27 111.549 -172.925 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 25.7 mt -47.6 -62.87 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.458 1.103 . . . . 2.8100000000000001 111.4 165.996 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -59.8 -42.37 93.28 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.959 0.8 . . . . 1.98 111.245 -177.164 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.394 3.3 pt-20 -77.32 -9.01 58.57 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 121.226 -0.921 . . . . 2.8700000000000001 112.534 -178.505 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -88.17 -26.59 22.34 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 116.589 2.07 . . . . 2.3399999999999999 116.589 165.096 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -68.74 0.25 4.51 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 120.62 1.554 . . . . 2.9399999999999999 111.576 169.866 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 . . . . . 0 CA--C 1.532 0.285 0 C-N-CA 127.682 2.393 . . . . 3.7999999999999998 110.84 -176.213 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.556 1.206 0 N-CA-C 115.446 1.647 . . . . 3.4199999999999999 115.446 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 14.2 p 47.41 -161.0 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 127.974 2.509 . . . . 2.3900000000000001 111.081 -153.93 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -102.28 -33.99 9.39 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 120.082 1.31 . . . . 2.6200000000000001 111.487 149.071 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.11 -42.17 72.61 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.337 0.655 . . . . 1.9299999999999999 109.763 -169.727 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -64.43 -64.11 0.96 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.499 -1.238 . . . . 2.5499999999999998 111.485 176.464 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -51.84 -31.79 29.18 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 121.762 2.074 . . . . 7.5999999999999996 114.095 177.155 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.55 -41.34 60.75 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.789 1.177 . . . . 1.71 112.501 174.983 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 39.5 t -60.0 -42.91 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-N 120.55 1.523 . . . . 2.1699999999999999 110.107 166.71 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 6.3 mt -54.36 -48.79 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-O 117.812 -1.089 . . . . 2.3500000000000001 109.919 171.061 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.6 t -60.59 -43.06 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 120.643 1.565 . . . . 2.2000000000000002 112.859 177.677 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 3.6 mp -60.44 -41.99 95.19 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.958 0.799 . . . . 2.1099999999999999 111.997 173.939 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 40.2 t -69.39 -41.23 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 125.477 1.511 . . . . 2.23 111.985 177.659 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.91 -57.07 14.18 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 124.401 1.081 . . . . 4.1100000000000003 108.326 179.235 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -52.43 -24.75 8.41 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.461 1.282 . . . . 2.29 114.461 -178.775 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -74.08 -62.96 1.33 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.453 1.024 . . . . 3.5099999999999998 112.079 168.672 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -62.49 -25.77 68.18 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.298 0.851 . . . . 4.0199999999999996 113.298 -176.294 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -43.56 -30.27 0.57 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.345 2.658 . . . . 4.2400000000000002 115.338 172.062 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -96.21 -13.3 23.58 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.999 1.111 . . . . 3.9399999999999999 113.999 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . 0.256 4.4 m . . . . . 0 CA--C 1.543 0.695 0 CA-C-O 121.893 0.854 . . . . 4.0 111.898 -174.179 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 4.4 tt . . . . . 0 N--CA 1.471 0.583 0 CA-C-O 122.922 1.344 . . . . 3.3300000000000001 110.12 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 10.5 m -61.79 160.63 11.55 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.188 -0.914 . . . . 3.1699999999999999 109.406 165.192 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -43.71 -31.83 0.88 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 115.461 1.652 . . . . 3.5899999999999999 115.461 177.103 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.7 m -55.07 -34.88 63.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.628 1.571 . . . . 2.7400000000000002 115.067 173.836 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.5 m -78.55 -41.54 31.8 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.726 1.148 . . . . 1.45 111.947 -179.936 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -57.74 -45.84 85.28 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 120.997 -1.064 . . . . 3.6499999999999999 112.401 -177.191 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -63.24 -27.84 69.63 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.929 1.085 . . . . 4.6900000000000004 113.929 177.675 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -87.19 -49.67 7.13 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 124.445 1.098 . . . . 3.3799999999999999 109.629 -177.681 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 14.4 tmm? -50.21 -37.65 36.38 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.741 2.017 . . . . 1.6299999999999999 113.127 171.63 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 17.5 mt -68.7 -0.6 5.48 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 116.799 2.148 . . . . 2.4399999999999999 116.799 174.037 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -114.94 11.2 16.5 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.087 1.143 . . . . 2.4100000000000001 114.087 161.221 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.44 -56.8 2.21 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.816 1.246 . . . . 2.8700000000000001 112.993 166.806 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -75.97 -27.21 57.42 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.009 -1.057 . . . . 2.6299999999999999 113.704 -173.014 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 2.2 mt -128.3 56.1 1.64 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 127.023 2.129 . . . . 3.02 107.929 -172.307 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -102.58 -15.76 16.29 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.481 1.512 . . . . 1.46 115.022 -166.398 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -94.96 -34.9 12.2 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 120.96 -1.087 . . . . 1.98 110.957 179.394 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 9.6 ptp -68.0 -3.06 8.85 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.533 0.938 . . . . 3.1299999999999999 113.533 166.129 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 28.5 tp -71.72 105.5 3.75 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.124 -0.985 . . . . 3.9300000000000002 111.049 -170.116 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 5.4 m -79.78 54.25 1.8 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.157 0.98 . . . . 5.0 111.323 169.556 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . 0.618 ' CG ' ' H ' ' B' ' 156' ' ' THR . 27.4 t70 53.23 -153.75 0.25 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 128.551 2.74 . . . . 4.7800000000000002 115.018 171.786 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 156' ' ' THR . . . . . 0.618 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 41.4 p -54.9 -36.36 65.09 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 128.671 2.789 . . . . 3.3999999999999999 112.176 175.61 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.8 -46.73 89.65 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 123.811 0.719 . . . . 1.96 111.604 175.75 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -72.26 -34.36 68.18 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.042 0.937 . . . . 3.9199999999999999 113.188 174.059 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -58.49 -35.02 71.57 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.252 -1.53 . . . . 7.1500000000000004 112.596 177.182 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -63.34 -25.65 68.4 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.23 1.567 . . . . 5.2999999999999998 115.23 171.5 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -76.37 -18.38 58.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.134 1.161 . . . . 1.76 114.134 170.787 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.33 -52.75 7.7 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.179 0.9 . . . . 1.98 110.708 163.043 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -68.39 -25.05 64.86 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.335 0.865 . . . . 2.0899999999999999 113.335 -174.091 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -57.87 -30.39 65.78 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.327 -1.483 . . . . 3.9199999999999999 112.615 168.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 15.9 mt -80.79 -29.87 36.03 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.314 0.646 . . . . 2.0899999999999999 112.104 -177.879 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 36.2 mm -61.13 -51.06 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.172 1.389 . . . . 2.27 111.049 174.77 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -66.01 -35.81 81.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.76 0.824 . . . . 2.7400000000000002 112.604 176.348 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -62.4 -35.91 80.67 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.81 0.844 . . . . 4.0 112.03 173.763 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.6 tp -86.71 -21.39 26.65 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.593 0.96 . . . . 4.1900000000000004 113.593 178.211 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -63.05 -23.65 67.55 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.894 0.877 . . . . 3.6699999999999999 112.376 173.458 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.13 -11.24 60.75 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.761 1.393 . . . . 3.0 114.761 169.623 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -125.46 -23.39 4.11 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.274 1.213 . . . . 3.2200000000000002 114.274 -172.417 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.26 158.16 43.5 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.433 -0.792 . . . . 4.5800000000000001 112.743 -160.229 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . 0.458 ' CG ' ' H ' ' B' ' 175' ' ' GLY . 12.8 p-10 -103.19 -118.13 0.2 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 127.392 2.277 . . . . 6.0199999999999996 111.737 -172.392 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . 0.458 ' H ' ' CG ' ' B' ' 174' ' ' ASP . . . -87.41 -4.88 80.03 Favored Glycine 0 CA--C 1.534 1.279 0 CA-C-O 118.265 -1.297 . . . . 4.9400000000000004 113.703 159.869 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.6 mmt-85 -83.17 164.82 19.95 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 119.783 1.791 . . . . 9.0500000000000007 112.282 162.62 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 1.6 pp -146.67 153.89 12.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 129.628 3.171 . . . . 4.6900000000000004 107.099 173.02 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 8.4 t -97.98 176.51 5.75 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.974 0.909 . . . . 2.1000000000000001 111.43 166.246 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -74.35 -52.29 12.63 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.428 0.899 . . . . 3.8500000000000001 113.428 -176.39 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -58.6 -29.28 66.33 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.453 1.901 . . . . 3.1699999999999999 111.548 -179.485 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -64.5 -55.93 17.42 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-O 118.027 -0.987 . . . . 4.0 110.811 175.345 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -50.24 -49.01 54.29 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.422 1.464 . . . . 3.8599999999999999 112.497 178.949 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -62.52 -40.66 97.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.926 0.49 . . . . 0.73999999999999999 111.708 179.958 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 97.9 m -64.09 -37.6 88.03 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.434 1.494 . . . . 2.9700000000000002 111.706 173.298 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.5 mt -60.13 -51.22 70.52 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.21 0.914 . . . . 2.0099999999999998 110.523 175.624 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 47.4 mm -46.3 -42.26 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-N 119.631 1.105 . . . . 1.8600000000000001 113.078 -177.589 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.14 -31.65 79.65 Favored Glycine 0 CA--C 1.533 1.212 0 CA-C-O 119.193 -0.781 . . . . 0.81999999999999995 113.467 178.732 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.38 -24.75 69.93 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-N 118.826 1.313 . . . . 0.68999999999999995 114.528 -177.011 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -87.8 -37.51 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 CA-C-N 118.682 1.241 . . . . 2.6099999999999999 111.471 169.03 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 22.8 m -80.81 -40.0 25.7 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.482 1.113 . . . . 3.3100000000000001 112.612 -169.325 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -45.08 -48.18 9.92 Favored Glycine 0 CA--C 1.538 1.526 0 CA-C-O 117.416 -1.769 . . . . 2.1099999999999999 116.249 -172.926 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.52 -32.88 7.4 Favored 'Trans proline' 0 C--N 1.353 0.809 0 CA-C-N 121.05 2.425 . . . . 1.1100000000000001 113.05 -179.738 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 41.2 pt -85.14 -20.44 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 113.218 0.822 . . . . 2.4100000000000001 113.218 179.979 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -51.89 -45.78 64.29 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 127.399 2.28 . . . . 1.6499999999999999 111.967 -178.033 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -55.27 -49.18 72.73 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.11 0.564 . . . . 4.7000000000000002 111.222 175.399 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.09 -35.49 61.78 Favored 'General case' 0 C--O 1.222 -0.373 0 O-C-N 121.228 -0.92 . . . . 3.21 111.675 -175.469 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 27.2 mt -48.75 -62.43 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.82 1.248 . . . . 2.6699999999999999 110.421 166.457 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -60.25 -45.04 94.63 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.931 -0.481 . . . . 1.98 111.041 -176.242 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.383 3.1 pt-20 -78.39 -8.06 58.04 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.406 0.521 . . . . 2.7799999999999998 112.406 -174.401 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.88 -27.8 44.04 Favored 'General case' 0 C--N 1.346 0.452 0 C-N-CA 126.551 1.941 . . . . 2.3300000000000001 115.324 162.905 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -74.19 5.52 4.36 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 121.055 1.752 . . . . 2.4300000000000002 111.159 172.57 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -127.94 -67.85 0.8 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.435 2.294 . . . . 2.8799999999999999 110.144 -176.991 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 . . . . . 0 N--CA 1.478 0.928 0 C-N-CA 129.806 3.242 . . . . 5.1699999999999999 115.803 167.441 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 . . . . . 0 CA--C 1.556 1.184 0 N-CA-C 113.45 0.908 . . . . 3.54 113.45 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.4 p -70.81 159.37 34.7 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 125.275 1.43 . . . . 2.3799999999999999 111.928 -174.692 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -61.76 -39.5 91.82 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 120.469 1.486 . . . . 2.3700000000000001 112.904 -178.425 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.19 -47.25 81.73 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.671 0.748 . . . . 1.8 110.469 175.082 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.66 -52.4 31.6 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.835 0.854 . . . . 2.8999999999999999 111.726 -177.044 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -56.73 -32.09 65.19 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 119.842 -1.786 . . . . 6.0700000000000003 113.765 169.731 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.63 -39.88 91.96 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 120.745 -1.222 . . . . 1.54 111.634 172.693 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 95.4 t -59.0 -33.67 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-N 119.401 1.001 . . . . 1.77 111.074 166.063 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.7 mt -58.54 -59.08 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 CA-C-N 120.469 1.486 . . . . 2.0299999999999998 111.558 164.139 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 23.1 t -55.02 -38.6 46.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.149 1.38 . . . . 1.8400000000000001 112.926 -176.945 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -65.7 -27.61 68.46 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.465 -1.397 . . . . 1.96 112.563 174.36 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.0 t -94.87 -19.72 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.137 1.375 . . . . 2.2000000000000002 111.343 -179.552 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -59.8 -54.24 48.52 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 120.342 1.428 . . . . 4.0099999999999998 110.083 153.573 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.8 t30 -54.18 -34.29 60.15 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 118.921 0.782 . . . . 2.3599999999999999 112.948 -178.344 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -80.32 -48.51 12.88 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.243 0.831 . . . . 3.6200000000000001 113.243 174.144 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -73.5 -22.29 60.18 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 114.23 1.196 . . . . 4.0700000000000003 114.23 -173.039 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.3 ptmt -48.86 -34.98 13.64 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 120.872 1.669 . . . . 3.6000000000000001 113.064 176.134 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -74.4 -40.27 62.14 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 114.03 1.122 . . . . 3.8100000000000001 114.03 178.529 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.476 0.832 0 CA-C-N 118.921 0.782 . . . . 4.0700000000000003 112.244 177.025 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.7 pt . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 115.123 1.527 . . . . 3.0699999999999998 115.123 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 97.6 p -101.02 140.75 34.89 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 120.692 -1.255 . . . . 3.9199999999999999 108.375 152.879 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -71.44 -18.95 62.29 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.19 -0.944 . . . . 3.8799999999999999 112.582 -171.846 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.9 m -48.43 -30.34 4.97 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.264 1.026 . . . . 2.73 113.621 159.323 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 t -65.28 -35.16 80.17 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 117.477 -1.249 . . . . 2.6000000000000001 111.761 176.443 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -59.3 -48.89 79.94 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 120.929 1.695 . . . . 3.0299999999999998 111.844 174.881 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.0 ptt85 -62.97 -29.74 71.04 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.346 0.976 . . . . 5.6200000000000001 111.463 176.606 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -83.96 -39.84 19.25 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 114.008 1.114 . . . . 3.1099999999999999 114.008 -175.874 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.7 tmm? -51.67 -47.8 63.68 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 126.331 1.853 . . . . 2.1600000000000001 110.67 162.379 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -55.47 -50.82 68.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.487 0.585 . . . . 2.2200000000000002 112.393 169.227 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -79.14 -9.17 59.48 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 115.758 1.762 . . . . 3.0299999999999998 115.758 -175.786 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -98.16 -51.68 3.93 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.256 1.423 . . . . 2.1299999999999999 114.078 167.724 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -89.67 -43.21 10.89 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.093 0.957 . . . . 2.8999999999999999 111.966 -168.9 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.58 38.55 2.13 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.049 1.34 . . . . 2.96 110.742 -168.526 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -96.55 -17.78 20.24 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 116.085 1.883 . . . . 2.3599999999999999 116.085 -149.257 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 -92.17 -38.9 11.87 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.446 1.498 . . . . 2.4300000000000002 113.142 -162.939 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 68.4 mtm -77.0 -18.9 57.89 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.021 -1.049 . . . . 4.0 113.367 170.479 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.1 tt -56.52 -31.24 63.93 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.128 0.971 . . . . 5.7999999999999998 112.68 -155.401 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.1 m 83.5 109.66 0.06 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.349 2.26 . . . . 5.2999999999999998 111.494 169.477 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.478 ' CG ' ' H ' ' A' ' 53' ' ' THR . 9.2 t70 66.42 -163.14 0.24 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.904 1.682 . . . . 4.4400000000000004 113.669 168.169 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.478 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 24.4 m -87.14 -31.56 20.34 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.274 1.429 . . . . 3.3100000000000001 109.913 157.03 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.2 -42.21 72.22 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.793 1.187 . . . . 2.2000000000000002 114.154 -174.773 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -76.38 -20.62 56.98 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.902 1.351 . . . . 4.7300000000000004 112.955 177.983 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.6 mtt85 -69.72 -37.92 76.72 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.0 -1.688 . . . . 8.3200000000000003 112.43 164.279 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 mmmt -59.07 -40.35 84.94 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.417 1.008 . . . . 5.0700000000000003 111.373 170.411 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.448 ' HA ' ' HE3' ' A' ' 61' ' ' LYS . . . -59.14 -40.44 85.48 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 117.833 -1.08 . . . . 2.6400000000000001 113.739 173.143 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.04 -46.88 84.64 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.663 1.185 . . . . 1.8999999999999999 112.368 167.32 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -62.79 -34.06 76.49 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.036 0.934 . . . . 2.4300000000000002 112.891 -175.681 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.448 ' HE3' ' HA ' ' A' ' 58' ' ' ALA . 8.0 mtmp? -47.69 -44.0 27.1 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 122.979 1.371 . . . . 3.96 113.102 169.488 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.1 mt -69.36 -43.05 74.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 113.615 -1.629 . . . . 2.1000000000000001 110.491 -174.708 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.1 mm -53.8 -54.57 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.669 1.588 . . . . 2.0099999999999998 110.56 178.806 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -64.13 -37.75 88.58 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 123.699 0.799 . . . . 3.7599999999999998 112.377 -178.001 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -44.34 82.46 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 121.512 0.672 . . . . 4.8499999999999996 112.232 168.355 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.21 -34.06 68.08 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.012 0.925 . . . . 3.6499999999999999 110.922 -174.429 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -77.78 -30.92 51.64 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.829 1.048 . . . . 3.5699999999999998 113.829 171.26 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.27 -31.63 58.38 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.852 1.056 . . . . 3.8100000000000001 113.852 176.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.51 57.94 1.19 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.484 1.113 . . . . 4.5599999999999996 113.084 -173.49 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.77 5.05 0.06 Allowed 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 116.594 2.072 . . . . 5.1900000000000004 116.594 167.301 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 72' ' ' GLY . 17.0 t70 59.65 -150.36 0.43 Allowed 'General case' 0 CA--C 1.557 1.216 0 CA-C-N 120.004 1.274 . . . . 4.0 110.102 -175.959 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.407 ' H ' ' CG ' ' A' ' 71' ' ' ASP . . . -93.91 11.63 70.6 Favored Glycine 0 CA--C 1.533 1.183 0 O-C-N 119.962 -1.711 . . . . 2.8199999999999998 112.603 158.231 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.2 mmt-85 -80.28 70.71 6.98 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.524 1.662 . . . . 5.6100000000000003 111.452 -176.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.8 mt -63.33 139.47 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 124.766 1.226 . . . . 3.2000000000000002 109.814 174.614 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.5 m -117.23 158.74 23.79 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.321 1.048 . . . . 2.5099999999999998 109.817 168.351 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -46.23 -47.73 17.91 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 123.151 1.453 . . . . 3.0699999999999998 112.247 172.689 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.21 -16.99 63.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 129.4 3.08 . . . . 3.1499999999999999 112.74 -175.303 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -58.47 -59.27 5.63 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.466 1.106 . . . . 4.2800000000000002 110.812 175.335 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -55.33 -47.67 75.32 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.567 -0.708 . . . . 2.9399999999999999 111.152 -178.473 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -62.56 -47.01 85.72 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.485 0.55 . . . . 0.58999999999999997 112.485 -178.365 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.3 t -69.78 -39.61 76.55 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.503 0.721 . . . . 2.6400000000000001 111.758 -179.538 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 44.2 mt -58.1 -46.13 86.05 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 118.001 -0.999 . . . . 1.8400000000000001 111.85 175.442 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 20.9 mm -50.56 -37.26 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 CA-C-N 119.549 1.068 . . . . 2.1299999999999999 112.775 -178.007 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.01 -20.07 47.74 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 119.686 1.13 . . . . 0.95999999999999996 114.189 176.258 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.99 0.78 82.12 Favored Glycine 0 CA--C 1.532 1.124 0 O-C-N 120.743 -1.445 . . . . 0.96999999999999997 114.48 175.32 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -134.72 -45.44 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 126.193 1.797 . . . . 2.3399999999999999 110.668 174.752 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 95.5 m -76.18 71.3 2.9 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.677 1.991 . . . . 2.0 107.131 163.024 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -149.77 -77.98 0.02 OUTLIER Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.212 1.387 . . . . 1.0600000000000001 111.077 -179.711 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -62.23 -34.14 79.21 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 123.227 2.618 . . . . 1.46 113.617 -176.634 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -82.95 0.06 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 114.549 1.314 . . . . 2.4700000000000002 114.549 179.839 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -35.88 -61.06 0.5 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.329 2.651 . . . . 3.2400000000000002 115.756 -176.158 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.51 -40.33 65.33 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.024 -1.047 . . . . 5.2599999999999998 111.719 176.296 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.3 tt -66.73 -42.29 86.52 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.432 0.693 . . . . 2.98 109.898 -176.704 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.7 mt -51.29 -54.5 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.0 0.92 . . . . 3.7599999999999998 110.2 169.788 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -41.08 96.21 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.614 -0.679 . . . . 2.9900000000000002 112.733 -179.606 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -93.63 0.66 56.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.951 0.901 . . . . 3.4199999999999999 112.666 -169.051 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -29.82 70.3 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 125.821 1.649 . . . . 5.7199999999999998 112.501 163.856 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.09 8.09 2.3 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.415 1.086 . . . . 3.8399999999999999 111.957 171.529 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.466 0.336 0 C-N-CA 124.947 1.299 . . . . 4.21 109.644 174.754 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 121.386 0.612 . . . . 3.52 110.28 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 20.8 p -71.11 163.38 27.72 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.468 1.507 . . . . 2.2200000000000002 111.458 -173.892 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.51 -34.73 78.95 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 117.875 -1.059 . . . . 2.98 112.621 178.857 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.09 -50.2 64.89 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.971 1.26 . . . . 2.0099999999999998 109.119 172.621 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -67.51 -54.02 23.63 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.158 0.799 . . . . 2.54 113.158 -176.194 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -57.42 -30.55 65.07 Favored 'General case' 0 C--O 1.225 -0.187 0 O-C-N 120.759 -1.213 . . . . 5.2999999999999998 113.215 172.313 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.36 -43.09 78.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 118.211 -0.899 . . . . 1.6200000000000001 112.326 169.134 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 77.2 t -54.95 -36.12 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 120.353 1.433 . . . . 1.8899999999999999 110.452 167.267 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . 0.265 34.7 mt -60.9 -60.27 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 117.085 -1.436 . . . . 2.1200000000000001 112.129 166.972 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 21.9 t -51.74 -38.56 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 121.124 1.784 . . . . 1.6799999999999999 112.576 -179.685 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 9.8 mp -63.62 -36.74 84.8 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.096 -1.002 . . . . 1.97 111.895 173.424 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 72.3 t -90.22 -29.55 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 117.4 -1.286 . . . . 2.2000000000000002 112.456 -177.708 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -53.01 -50.44 64.21 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 121.359 1.89 . . . . 3.29 108.724 157.684 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -65.22 -25.16 67.57 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.837 1.051 . . . . 2.1600000000000001 113.837 -173.447 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -77.48 -50.13 13.29 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 120.963 -1.086 . . . . 3.8300000000000001 112.242 165.369 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -64.87 -27.13 68.66 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 117.134 -1.413 . . . . 4.0899999999999999 113.788 -170.148 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 2.6 ptmt -52.63 -32.83 43.8 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 121.841 2.11 . . . . 2.6699999999999999 112.911 174.792 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -73.32 -23.87 60.31 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.43 1.27 . . . . 3.5299999999999998 114.43 179.252 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 31.3 m . . . . . 0 N--CA 1.483 1.2 0 CA-C-N 119.067 0.849 . . . . 3.7000000000000002 112.99 170.46 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 34.8 pt . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 113.731 1.012 . . . . 3.8900000000000001 113.731 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 90.3 p -108.4 142.57 38.57 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 119.446 -2.034 . . . . 3.48 107.74 153.212 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . 0.4 ' CD ' ' HB3' ' B' ' 169' ' ' LEU . 20.8 mttp -67.53 -21.96 65.45 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.054 -1.029 . . . . 3.9399999999999999 110.99 179.895 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 2.9 m -50.2 -23.07 1.99 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.324 1.602 . . . . 2.8599999999999999 115.324 162.1 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 21.7 t -70.35 -34.58 72.81 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 120.309 -1.495 . . . . 2.2799999999999998 112.761 169.92 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -64.52 -44.52 90.62 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 118.299 -0.858 . . . . 3.4300000000000002 112.334 178.805 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 16.4 ptt85 -57.88 -34.04 69.35 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.681 1.128 . . . . 5.2199999999999998 110.821 172.014 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -86.75 -38.55 16.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 113.977 1.103 . . . . 2.9900000000000002 113.977 -169.144 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.6 tmm? -62.31 -37.58 86.1 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.856 -0.528 . . . . 2.0099999999999998 110.941 165.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 12.6 mt -64.81 -41.67 95.6 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 120.658 -1.276 . . . . 2.27 113.844 169.778 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 146' ' ' GLN . . . . . 0.447 ' HB2' ' HE ' ' B' ' 159' ' ' ARG . 14.3 pt20 -73.71 -19.91 60.68 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 114.05 1.13 . . . . 3.1800000000000002 114.05 -175.665 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -91.29 -68.54 0.79 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.826 2.05 . . . . 2.4500000000000002 113.005 168.954 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -65.96 -27.22 68.0 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.655 1.57 . . . . 3.6400000000000001 113.792 -167.233 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.25 6.1 42.79 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.245 1.018 . . . . 3.3399999999999999 112.87 -179.817 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -52.09 -36.68 51.57 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.773 1.768 . . . . 2.4700000000000002 115.773 -160.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -67.25 -53.02 33.83 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.11 0.868 . . . . 2.3999999999999999 112.699 -168.318 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 38.0 mtm -73.2 -23.81 60.45 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.414 1.264 . . . . 4.1100000000000003 114.414 173.565 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 8.8 tt -50.76 -38.09 45.92 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-O 118.141 -0.933 . . . . 5.6500000000000004 112.823 -160.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 50.2 m 81.58 102.81 0.06 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.235 1.814 . . . . 5.3300000000000001 112.28 172.237 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 155' ' ' ASP . . . . . 0.521 ' CG ' ' H ' ' B' ' 156' ' ' THR . 14.1 t70 69.8 -173.43 0.18 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.541 1.536 . . . . 4.6200000000000001 114.5 165.32 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 156' ' ' THR . . . . . 0.521 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 62.2 m -73.23 -38.61 65.97 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.939 1.696 . . . . 3.52 110.0 162.579 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.49 -45.71 89.12 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.407 1.003 . . . . 2.29 113.742 -172.692 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -72.66 -20.01 61.33 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 118.813 1.306 . . . . 4.6399999999999997 112.71 178.909 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 159' ' ' ARG . . . . . 0.447 ' HE ' ' HB2' ' B' ' 146' ' ' GLN . 38.7 mtt85 -70.4 -38.06 74.58 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 120.057 -1.652 . . . . 8.6199999999999992 112.83 167.652 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -61.97 -37.64 85.56 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.174 -0.954 . . . . 5.2000000000000002 111.26 169.596 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 161' ' ' ALA . . . . . 0.458 ' HA ' ' HE3' ' B' ' 164' ' ' LYS . . . -60.5 -38.49 84.48 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 117.668 -1.158 . . . . 2.4500000000000002 113.602 170.428 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -58.12 -48.05 81.41 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.454 1.025 . . . . 1.8400000000000001 111.84 168.6 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -61.67 -32.87 73.07 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.062 1.134 . . . . 2.2999999999999998 114.062 -177.681 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 164' ' ' LYS . . . . . 0.458 ' HE3' ' HA ' ' B' ' 161' ' ' ALA . 8.2 mtmp? -46.64 -44.63 18.57 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-O 123.131 1.443 . . . . 4.0800000000000001 113.206 171.777 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 5.6 mt -72.8 -39.7 66.47 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.199 -1.819 . . . . 1.76 111.274 -170.386 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 26.1 mm -53.66 -55.16 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 126.096 1.758 . . . . 2.1099999999999999 109.651 178.437 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -66.48 -38.4 87.22 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.254 1.022 . . . . 3.7599999999999998 112.832 -179.262 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -57.57 -15.05 6.23 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.625 1.17 . . . . 4.4699999999999998 113.939 169.19 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 169' ' ' LEU . . . . . 0.4 ' HB3' ' CD ' ' B' ' 138' ' ' LYS . 3.4 mm? -108.63 -38.93 5.53 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.686 1.194 . . . . 3.04 113.346 170.046 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -77.82 -25.57 48.92 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 119.443 -2.036 . . . . 3.9300000000000002 113.787 -177.674 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.32 -20.13 44.99 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.723 1.147 . . . . 4.5 113.782 176.09 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -159.82 20.79 0.17 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.083 1.512 . . . . 5.6100000000000003 115.083 -161.407 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.44 15.35 4.51 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 120.597 -1.314 . . . . 6.1699999999999999 113.915 171.922 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 14.3 t70 60.56 -155.05 0.36 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.701 1.6 . . . . 3.8999999999999999 110.649 177.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -94.09 15.95 62.03 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 120.278 -1.513 . . . . 2.8399999999999999 112.857 165.609 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 53.6 mmt-85 -78.02 51.41 0.97 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.099 1.45 . . . . 5.8200000000000003 112.39 -177.696 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 39.7 mt -58.04 127.71 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.212 1.005 . . . . 3.6800000000000002 110.316 -175.394 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.3 m -113.23 168.57 9.61 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.141 1.163 . . . . 3.3999999999999999 114.141 -173.21 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -63.38 -58.49 6.93 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.01 1.324 . . . . 3.1200000000000001 111.13 170.695 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -67.92 -22.45 65.06 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.246 2.219 . . . . 3.5299999999999998 111.482 -172.134 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -57.6 -58.72 7.09 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 125.56 1.544 . . . . 3.27 110.882 169.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -50.46 -50.44 52.35 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.971 -0.456 . . . . 3.6499999999999999 110.824 179.418 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.3 t-105 -62.82 -46.39 88.15 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.396 0.679 . . . . 0.63 112.762 -179.672 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.1 t -68.77 -33.89 74.64 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 118.638 0.654 . . . . 2.5099999999999998 111.387 -178.68 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 75.9 mt -61.69 -43.07 99.57 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 117.449 -1.262 . . . . 1.8799999999999999 112.143 172.065 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 46.8 mm -48.39 -43.19 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 CA-C-N 121.077 1.762 . . . . 1.8899999999999999 112.122 -179.253 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.89 -19.06 58.3 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.179 0.895 . . . . 0.66000000000000003 114.311 -179.981 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -76.78 -4.85 82.9 Favored Glycine 0 CA--C 1.534 1.241 0 O-C-N 120.776 -1.426 . . . . 0.93999999999999995 114.274 174.775 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -123.17 -45.28 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.851 1.66 . . . . 2.0699999999999998 110.188 170.686 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 92.6 m -74.64 71.91 1.93 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.983 1.713 . . . . 2.1200000000000001 107.739 165.574 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -144.43 -78.35 0.04 OUTLIER Glycine 0 CA--C 1.529 0.926 0 C-N-CA 125.535 1.54 . . . . 1.1100000000000001 111.14 178.668 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -63.77 -32.29 67.71 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.344 2.696 . . . . 1.1000000000000001 113.684 -176.894 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.4 pt -78.38 -3.13 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 114.306 1.224 . . . . 2.27 114.306 178.846 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -35.61 -64.83 0.27 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 127.704 2.402 . . . . 3.1299999999999999 115.516 -176.889 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -57.64 -33.41 68.25 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.616 -1.303 . . . . 6.0899999999999999 113.202 177.101 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 10.4 tt -70.15 -41.36 73.94 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 117.991 -1.004 . . . . 3.52 110.468 177.487 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 83.9 mt -52.58 -50.27 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 119.15 0.887 . . . . 3.5299999999999998 110.71 172.181 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -61.28 -47.1 87.55 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.964 0.906 . . . . 2.96 113.301 175.019 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -92.44 2.44 56.66 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 120.713 -1.242 . . . . 3.4900000000000002 113.257 -169.074 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -22.37 61.06 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.636 1.574 . . . . 5.1200000000000001 113.301 161.571 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -87.88 15.31 7.29 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 123.784 1.754 . . . . 3.2799999999999998 111.152 172.891 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -121.75 -67.99 0.93 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.04 1.336 . . . . 4.0499999999999998 109.062 168.118 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.18 0 C-N-CA 129.243 3.017 . . . . 8.0299999999999994 116.873 165.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 CA--C 1.502 -0.879 0 N-CA-C 108.776 -0.824 . . . . 11.359999999999999 108.776 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -132.37 -21.77 2.27 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.762 1.289 . . . . 7.5599999999999996 112.096 -133.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 67.7 m 69.05 -23.38 0.14 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 129.323 3.049 . . . . 4.5 115.464 170.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.478 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 0.2 OUTLIER 65.17 102.07 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 127.431 2.293 . . . . 3.54 110.489 -167.681 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.17 150.27 4.66 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 118.914 0.779 . . . . 2.3799999999999999 111.165 -173.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -59.26 -48.59 81.06 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 118.914 0.779 . . . . 2.5800000000000001 110.301 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.67 -47.69 14.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.594 1.558 . . . . 2.2200000000000002 110.941 172.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -74.26 -50.59 18.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 118.005 -0.997 . . . . 2.79 113.235 -173.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 mtmm -50.4 -37.89 39.96 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 120.931 1.696 . . . . 6.8300000000000001 113.48 164.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.39 -44.95 85.89 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.206 -1.378 . . . . 1.76 111.928 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.14 -36.14 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 CA-C-N 121.339 1.882 . . . . 1.77 110.59 172.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 52.6 mt -58.49 -51.99 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 O-C-N 121.179 -0.95 . . . . 1.8300000000000001 111.766 167.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.2 t -61.97 -39.58 84.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.486 1.515 . . . . 1.76 112.019 -177.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.3 mp -63.59 -43.12 97.87 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.798 0.839 . . . . 1.99 111.187 172.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 89.0 t -62.34 -41.94 93.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 118.126 -0.94 . . . . 1.8400000000000001 109.864 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -65.88 -41.68 91.28 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.111 1.323 . . . . 4.4900000000000002 114.111 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -16.52 20.28 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 120.336 -1.478 . . . . 3.5800000000000001 113.48 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -98.8 -61.59 1.35 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.767 1.627 . . . . 3.0800000000000001 113.189 166.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -60.46 -24.4 65.21 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.462 1.483 . . . . 3.0800000000000001 114.365 -171.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -46.32 -26.63 0.85 Allowed 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.094 1.316 . . . . 3.6400000000000001 113.815 167.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -91.18 7.12 42.24 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.808 2.043 . . . . 3.6699999999999999 115.99 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.1 m -136.09 164.33 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 119.711 1.141 . . . . 3.52 109.587 170.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.9 m -93.52 70.82 4.28 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 120.945 -1.097 . . . . 4.21 111.222 169.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp 71.91 -52.1 0.69 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.242 1.817 . . . . 7.4500000000000002 115.086 159.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -110.4 -13.58 14.26 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.763 1.625 . . . . 7.1799999999999997 112.929 174.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 99.9 p -84.12 18.17 2.21 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 117.419 2.377 . . . . 5.1900000000000004 117.419 -143.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 61.7 mt -39.65 -7.43 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 131.627 3.971 . . . . 8.1199999999999992 119.776 -170.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.3 p -130.37 -44.96 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.845 2.058 . . . . 4.9500000000000002 112.572 172.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.42 -22.86 43.7 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.311 1.597 . . . . 8.8399999999999999 115.311 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -147.47 119.23 8.06 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.435 1.094 . . . . 8.2300000000000004 108.688 167.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 10.0 pttm -160.65 160.77 32.01 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.569 1.548 . . . . 7.9199999999999999 111.741 -166.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 22.9 pt -83.7 172.66 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 121.812 0.815 . . . . 3.9199999999999999 111.441 178.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.6 t -78.74 134.7 37.04 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.571 -0.9 . . . . 3.1899999999999999 108.571 159.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -55.25 -25.11 31.45 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.154 -0.966 . . . . 3.3100000000000001 112.346 172.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.6 m -61.97 -12.98 21.17 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.013 1.486 . . . . 3.4900000000000002 115.013 169.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.6 m -82.96 -23.95 33.2 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.59 1.541 . . . . 2.2999999999999998 114.273 168.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -52.76 -53.96 40.63 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.298 1.863 . . . . 3.5699999999999998 111.9 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 27.0 ptt180 -61.66 -17.17 54.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.767 2.027 . . . . 3.3199999999999998 114.874 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -101.64 -52.42 3.22 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 126.969 2.108 . . . . 3.1800000000000002 109.179 -175.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 17.1 tmm? -53.75 -36.4 62.28 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.174 1.39 . . . . 2.1499999999999999 112.535 170.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 mt -54.12 -30.06 47.36 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.027 1.331 . . . . 1.8700000000000001 113.983 169.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.79 -3.69 58.05 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.416 1.007 . . . . 3.0899999999999999 112.869 176.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -56.5 2.19 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.691 1.596 . . . . 2.2000000000000002 112.346 170.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -90.46 -14.8 32.08 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.215 1.191 . . . . 3.0899999999999999 114.215 -167.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 mt -123.22 45.27 2.46 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.008 2.123 . . . . 2.5800000000000001 109.852 174.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -78.8 -21.01 48.4 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 115.343 1.608 . . . . 1.4199999999999999 115.343 -170.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.492 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 59.9 m-70 -83.43 -22.54 32.63 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 121.211 1.823 . . . . 2.25 114.364 -168.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 73.6 mtm -91.6 -12.92 32.93 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.88 1.672 . . . . 3.29 113.028 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.2 tp -99.06 117.87 34.54 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.768 1.227 . . . . 4.3700000000000001 111.016 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.7 m -159.19 -47.21 0.06 Allowed 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.569 -1.332 . . . . 5.3700000000000001 110.337 171.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -37.72 -26.78 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.631 2.772 . . . . 5.9400000000000004 115.471 160.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.7 m 71.79 -25.01 0.18 Allowed 'General case' 0 C--N 1.342 0.257 0 C-N-CA 128.758 2.823 . . . . 3.2400000000000002 112.73 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.26 -44.16 75.24 Favored Glycine 0 N--CA 1.473 1.103 0 C-N-CA 127.043 2.259 . . . . 2.1400000000000001 113.604 172.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -55.03 -42.74 73.0 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.498 1.119 . . . . 3.4199999999999999 111.774 171.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.7 ttt-85 -68.29 -40.07 81.91 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.534 -1.354 . . . . 6.21 113.249 170.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.1 mtmt -55.32 -29.94 59.26 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 122.16 2.255 . . . . 5.9299999999999997 112.58 173.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.42 -10.22 59.26 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.984 1.476 . . . . 2.2200000000000002 114.984 173.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -82.43 -52.89 6.45 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.796 1.238 . . . . 1.96 111.233 162.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.89 -33.47 74.27 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.316 0.647 . . . . 2.2400000000000002 112.655 -173.271 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -54.66 -32.0 58.5 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.719 1.007 . . . . 3.8399999999999999 113.719 169.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.0 mt -81.16 -40.19 24.34 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.618 1.167 . . . . 1.9299999999999999 110.735 -177.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.1 mm -48.7 -55.42 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.644 1.177 . . . . 2.23 110.66 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -66.01 -38.81 89.38 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.417 1.087 . . . . 2.5 113.174 -177.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -32.82 70.61 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.873 1.269 . . . . 4.1600000000000001 112.699 170.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.77 -41.57 14.0 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.142 0.977 . . . . 3.3900000000000001 110.593 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -47.95 -48.4 32.14 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.263 1.425 . . . . 2.73 112.111 172.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -53.51 -22.19 7.69 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.873 1.434 . . . . 2.7000000000000002 114.873 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.1 m-80 -113.81 5.62 16.39 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.066 1.346 . . . . 2.6800000000000002 113.539 -175.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 20.0 t60 -149.16 101.68 3.17 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 117.216 2.302 . . . . 4.1900000000000004 117.216 -153.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -20.75 3.24 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 128.239 2.616 . . . . 4.6200000000000001 115.341 170.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 95.87 22.9 19.39 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 118.84 -0.978 . . . . 3.5600000000000001 113.015 -166.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 58.9 mmt-85 -75.45 88.18 2.63 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.608 1.704 . . . . 5.1699999999999999 106.61 153.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.94 143.41 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 108.875 -0.787 . . . . 4.0899999999999999 108.875 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.87 149.2 39.04 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.526 1.131 . . . . 2.3599999999999999 108.538 174.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.36 -38.18 88.56 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 120.1 1.318 . . . . 3.1899999999999999 110.896 176.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.31 -22.83 63.64 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.924 2.09 . . . . 2.9399999999999999 113.905 175.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.96 -61.2 2.75 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.795 1.238 . . . . 3.6099999999999999 110.969 -178.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -56.0 -44.87 79.04 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.392 -0.818 . . . . 3.5499999999999998 112.789 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -61.72 -44.39 97.0 Favored 'General case' 0 C--O 1.239 0.552 0 O-C-N 121.844 -0.535 . . . . 0.68000000000000005 111.247 -178.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.59 -21.35 59.53 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 117.421 -1.276 . . . . 2.6499999999999999 112.804 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.8 mt -70.59 -44.22 67.78 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 120.176 1.353 . . . . 1.8999999999999999 112.662 165.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.8 mm -56.21 -37.3 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 CA-C-N 120.869 1.668 . . . . 1.76 112.452 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.28 -14.33 63.93 Favored Glycine 0 CA--C 1.533 1.208 0 CA-C-O 118.935 -0.925 . . . . 0.83999999999999997 114.502 178.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.02 -19.7 58.83 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-N 119.085 1.442 . . . . 0.81000000000000005 113.901 175.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.4 mp -90.76 -44.97 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 118.524 1.162 . . . . 2.2200000000000002 109.509 167.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.2 m -76.4 85.78 3.15 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 107.595 -1.261 . . . . 1.6599999999999999 107.595 -178.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -167.79 -75.82 0.04 OUTLIER Glycine 0 CA--C 1.532 1.098 0 CA-C-O 117.918 -1.49 . . . . 1.3500000000000001 113.993 -170.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -59.91 -44.48 30.05 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 123.134 2.556 . . . . 1.02 111.496 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.8 pt -76.27 -12.73 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 114.487 1.292 . . . . 2.6699999999999999 114.487 169.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.84 -49.09 77.86 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.788 1.631 . . . . 2.3300000000000001 112.599 -175.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.445 ' HZ2' ' CD ' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -55.03 -50.49 68.95 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.078 0.854 . . . . 4.1100000000000003 112.051 170.296 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.9 tt -53.75 -39.05 65.02 Favored 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 125.273 1.429 . . . . 2.54 112.399 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 80.4 mt -55.82 -63.22 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 119.623 1.101 . . . . 2.0099999999999998 111.068 171.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -53.49 -30.48 41.34 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 118.596 0.635 . . . . 1.8 112.63 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.445 ' CD ' ' HZ2' ' A' ' 92' ' ' LYS . 52.9 mt-10 -83.8 -21.03 32.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.45 1.1 . . . . 3.7999999999999998 112.54 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 -73.03 -38.15 66.63 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 120.938 -1.101 . . . . 2.29 112.13 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -69.34 0.85 4.44 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.303 1.441 . . . . 2.4500000000000002 112.798 175.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -120.93 -60.84 1.62 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 126.229 1.811 . . . . 2.5299999999999998 111.32 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . 0.276 6.8 pt20 54.99 1.06 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 130.664 3.586 . . . . 6.4199999999999999 115.23 175.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.9 m -111.73 10.25 20.93 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.173 1.789 . . . . 7.0899999999999999 112.971 -168.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 58.3 m -158.8 38.4 0.22 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.99 1.716 . . . . 8.8200000000000003 110.578 -177.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 53.9 p . . . . . 0 C--O 1.25 1.11 0 C-N-CA 128.841 2.856 . . . . 10.48 113.976 -175.054 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 CA--C 1.502 -0.873 0 N-CA-C 108.875 -0.787 . . . . 11.4 108.875 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -132.26 -21.25 2.34 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.757 1.285 . . . . 7.3799999999999999 112.158 -134.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 67.6 m 69.91 -23.43 0.16 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 129.478 3.111 . . . . 4.5 115.263 169.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.492 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 0.2 OUTLIER 65.35 102.03 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.292 2.237 . . . . 3.6699999999999999 110.522 -166.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.53 150.18 7.13 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-N 118.958 0.799 . . . . 2.3399999999999999 111.371 -173.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -58.56 -49.21 78.27 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.458 1.026 . . . . 2.7599999999999998 110.238 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.38 -47.23 13.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.383 1.473 . . . . 2.1200000000000001 111.129 172.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -74.71 -50.83 16.07 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 117.928 -1.034 . . . . 2.7000000000000002 113.071 -172.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -50.11 -37.0 31.91 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 120.965 1.712 . . . . 6.3499999999999996 113.245 164.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.91 -41.63 82.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 117.438 -1.268 . . . . 1.79 112.777 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 75.2 t -62.36 -37.63 79.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-N 121.122 1.783 . . . . 1.8400000000000001 110.396 170.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 55.8 mt -56.29 -53.42 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 119.398 0.999 . . . . 1.8300000000000001 111.197 167.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 7.5 t -61.19 -39.66 83.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 125.206 1.402 . . . . 1.73 112.1 -176.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.5 mp -63.32 -44.49 94.81 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.128 0.876 . . . . 1.98 111.431 172.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 91.0 t -62.85 -40.54 89.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 118.056 -0.974 . . . . 1.8999999999999999 109.852 178.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -67.52 -42.95 81.93 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.676 1.125 . . . . 4.0999999999999996 113.286 172.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.61 -18.99 23.02 Favored 'General case' 0 CA--C 1.552 1.027 0 O-C-N 120.447 -1.408 . . . . 3.6099999999999999 113.561 176.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -95.17 -63.75 1.13 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.629 1.172 . . . . 3.25 113.083 166.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -59.06 -23.82 62.35 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.656 1.571 . . . . 3.0699999999999998 114.833 -170.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -46.89 -25.04 0.69 Allowed 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 120.259 1.391 . . . . 3.4300000000000002 113.884 167.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -93.23 8.78 38.85 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.298 2.239 . . . . 3.5899999999999999 116.153 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.1 m -137.02 154.19 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 120.141 1.337 . . . . 3.3700000000000001 110.146 168.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 10.5 m -79.7 60.13 3.27 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.307 -0.87 . . . . 4.0599999999999996 111.998 169.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp 77.19 -52.6 0.55 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.332 1.453 . . . . 7.0099999999999998 114.132 156.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -107.58 -11.82 15.39 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.029 1.732 . . . . 7.0599999999999996 113.211 172.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 85.6 p -87.92 7.66 29.9 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 117.928 2.566 . . . . 5.2400000000000002 117.928 -142.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 68.1 mt -20.99 -13.39 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 1 C-N-CA 134.356 5.062 . . . . 8.1400000000000006 121.667 -175.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 4.3 p -132.59 -47.32 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 127.25 2.22 . . . . 4.8300000000000001 112.437 176.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -21.25 46.48 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 114.532 1.308 . . . . 8.7699999999999996 114.532 -177.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -146.54 120.64 9.45 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.176 0.991 . . . . 8.2799999999999994 108.776 161.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 11.0 pttm -159.86 162.34 34.61 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.549 1.54 . . . . 7.9199999999999999 111.829 -167.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 9.0 pt -80.95 175.68 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-O 121.816 0.817 . . . . 3.8799999999999999 111.475 175.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 32.5 t -84.99 138.35 32.52 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.7 -0.852 . . . . 2.8500000000000001 108.7 163.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -58.78 -20.01 45.88 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 120.56 -1.337 . . . . 3.2000000000000002 112.522 172.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 50.8 m -66.01 -16.76 64.18 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.237 1.415 . . . . 3.1200000000000001 114.586 167.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 61.6 m -80.41 -29.97 37.7 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.887 1.221 . . . . 1.5800000000000001 113.098 176.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -50.91 -57.37 8.68 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.651 1.114 . . . . 3.1699999999999999 112.146 176.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -61.86 -17.79 57.74 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.57 1.948 . . . . 3.6499999999999999 114.606 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -97.52 -54.76 3.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.962 2.105 . . . . 3.3300000000000001 109.07 -177.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -53.31 -35.67 60.4 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.803 1.641 . . . . 1.97 112.701 172.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.0 mt -54.31 -30.0 49.56 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.004 1.322 . . . . 1.8899999999999999 113.898 169.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.84 -3.43 56.78 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.611 1.096 . . . . 3.29 112.891 176.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.64 -57.27 2.05 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.874 1.67 . . . . 2.1600000000000001 112.341 171.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -89.67 -15.78 31.89 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.682 0.993 . . . . 3.0600000000000001 113.682 -167.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.3 mt -121.97 44.98 2.44 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.334 1.854 . . . . 2.5600000000000001 110.088 174.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -79.04 -23.67 44.13 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.344 1.609 . . . . 1.4099999999999999 115.344 -169.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . 0.478 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 64.6 m-70 -81.3 -22.36 38.63 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 121.115 1.78 . . . . 2.27 114.343 -167.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 73.2 mtm -91.19 -11.44 38.32 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.677 1.591 . . . . 3.3700000000000001 113.102 171.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 40.0 tp -100.74 120.15 39.66 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.15 1.38 . . . . 4.3300000000000001 111.091 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 23.0 m -160.94 -47.29 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 O-C-N 120.524 -1.36 . . . . 5.1399999999999997 110.019 170.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -37.72 -27.69 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 128.995 2.918 . . . . 5.9100000000000001 115.527 161.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 100.0 m 71.71 -22.17 0.2 Allowed 'General case' 0 C--N 1.342 0.245 0 C-N-CA 128.471 2.708 . . . . 3.3999999999999999 112.969 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.84 -44.89 92.01 Favored Glycine 0 N--CA 1.471 1.008 0 C-N-CA 126.181 1.848 . . . . 2.21 113.038 171.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -54.97 -41.34 71.05 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.823 1.249 . . . . 3.4300000000000002 111.731 172.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.6 ttt-85 -68.9 -41.36 78.36 Favored 'General case' 0 C--N 1.345 0.374 0 O-C-N 120.482 -1.387 . . . . 5.8300000000000001 113.121 170.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 19.5 mtmt -57.37 -26.49 61.1 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 121.65 2.023 . . . . 5.0700000000000003 112.885 173.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -74.54 -11.0 60.09 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.853 1.427 . . . . 2.1400000000000001 114.853 172.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.13 -56.89 3.52 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.307 1.443 . . . . 2.0499999999999998 111.145 163.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -34.18 69.0 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 113.255 0.835 . . . . 2.23 113.255 -176.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -55.14 -32.2 61.91 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 121.047 -1.033 . . . . 3.8399999999999999 113.765 170.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 17.3 mt -79.97 -40.09 28.73 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.254 1.022 . . . . 1.8799999999999999 110.416 -176.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 39.6 mm -49.74 -54.42 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.101 1.36 . . . . 2.29 110.733 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -65.4 -37.85 88.2 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.517 1.127 . . . . 2.5 113.369 -178.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -34.18 74.36 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.1 1.36 . . . . 4.1699999999999999 112.988 170.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.81 -41.0 18.01 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.738 1.215 . . . . 3.48 110.282 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -51.39 -46.61 62.88 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.676 1.59 . . . . 2.6499999999999999 112.817 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -55.22 -20.71 11.53 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.72 1.378 . . . . 2.6800000000000002 114.72 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -112.64 4.57 17.29 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.021 1.328 . . . . 2.71 113.459 -176.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -151.51 100.71 2.74 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 117.52 2.415 . . . . 4.2000000000000002 117.52 -153.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -19.08 4.1 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.49 2.716 . . . . 4.6399999999999997 115.793 171.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 96.15 26.46 11.25 Favored Glycine 0 CA--C 1.53 0.987 0 CA-C-O 118.915 -0.936 . . . . 3.73 113.087 -167.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 54.3 mmt-85 -78.63 84.16 4.76 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.35 1.575 . . . . 5.4100000000000001 107.154 154.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 11.3 mt -62.05 132.59 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 CA-C-N 118.795 0.725 . . . . 4.1600000000000001 109.324 -173.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 21.2 m -94.39 158.45 15.56 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 122.012 -0.43 . . . . 2.2000000000000002 110.33 166.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -63.63 -37.86 88.95 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 119.521 -0.872 . . . . 3.1699999999999999 111.474 166.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -21.63 65.53 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.652 1.581 . . . . 2.9399999999999999 114.266 177.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -62.43 -59.21 5.3 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.94 0.896 . . . . 3.4900000000000002 110.933 -177.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -54.51 -46.81 73.57 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.437 -0.789 . . . . 3.77 112.856 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 40.7 t-105 -61.96 -45.72 92.43 Favored 'General case' 0 C--O 1.239 0.542 0 O-C-N 121.998 -0.439 . . . . 0.68999999999999995 111.078 -176.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -72.27 -23.19 61.16 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-O 117.317 -1.325 . . . . 2.6800000000000002 112.436 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 30.9 mt -69.91 -42.61 73.14 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 120.081 1.31 . . . . 1.8999999999999999 112.844 167.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 32.2 mm -56.81 -36.08 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 CA-C-N 120.928 1.694 . . . . 1.74 112.497 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.21 -19.16 67.99 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.043 -0.865 . . . . 0.69999999999999996 114.077 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.84 -20.55 65.35 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-N 119.356 1.578 . . . . 0.84999999999999998 113.751 176.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.2 mp -90.86 -43.21 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 CA-C-N 118.497 1.149 . . . . 2.1099999999999999 110.25 168.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 4.1 m -78.13 83.89 4.38 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 107.86 -1.163 . . . . 1.6799999999999999 107.86 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -165.31 -74.55 0.03 OUTLIER Glycine 0 CA--C 1.533 1.16 0 CA-C-O 118.128 -1.373 . . . . 1.3899999999999999 114.109 -172.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.68 -42.55 38.34 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.158 2.572 . . . . 1.1299999999999999 111.617 176.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.9 pt -77.11 -12.4 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 114.93 1.456 . . . . 2.75 114.93 169.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.45 -52.17 66.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.75 1.614 . . . . 2.3199999999999998 112.605 -175.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . 0.44 ' HZ2' ' CD ' ' B' ' 199' ' ' GLU . 0.0 OUTLIER -53.66 -48.8 69.09 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.523 -0.736 . . . . 4.1100000000000003 112.284 170.441 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 10.2 tt -56.52 -37.64 70.73 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 125.318 1.447 . . . . 2.6800000000000002 111.979 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 75.4 mt -56.56 -61.94 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 119.648 1.113 . . . . 2.04 111.069 169.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -55.71 -28.42 55.6 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.726 -0.609 . . . . 1.8799999999999999 112.585 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . 0.44 ' CD ' ' HZ2' ' B' ' 195' ' ' LYS . 54.3 mt-10 -83.66 -23.76 31.63 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.33 1.052 . . . . 3.7000000000000002 112.35 178.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -76.55 -42.31 43.45 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.961 1.305 . . . . 2.25 112.838 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.58 3.01 6.79 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 122.659 1.219 . . . . 2.5699999999999998 112.548 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -120.23 -57.8 1.91 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 126.959 2.103 . . . . 3.1200000000000001 110.572 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.28 6.5 pt20 56.11 1.18 0.06 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 130.678 3.591 . . . . 6.0899999999999999 115.506 171.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 39.6 m -103.12 9.14 38.53 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.458 1.503 . . . . 7.1699999999999999 113.122 -168.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 46.9 m -159.68 43.71 0.22 Allowed 'General case' 0 N--CA 1.481 1.093 0 O-C-N 120.268 -1.52 . . . . 8.9299999999999997 111.556 -178.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 39.1 p . . . . . 0 C--O 1.25 1.08 0 C-N-CA 128.916 2.887 . . . . 10.57 115.072 -179.122 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.3 m . . . . . 0 N--CA 1.47 0.547 0 N-CA-C 107.0 -1.482 . . . . 8.8000000000000007 107.0 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.418 ' CG ' ' H ' ' A' ' 4' ' ' CYS . 34.2 t70 -55.39 -117.53 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 120.129 -0.628 . . . . 6.2199999999999998 109.434 112.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.418 ' H ' ' CG ' ' A' ' 3' ' ' ASP . 50.6 t -96.77 -95.7 0.2 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.557 2.343 . . . . 5.04 108.237 171.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.1 m-30 140.95 153.42 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.079 1 C-N-CA 132.65 4.38 . . . . 3.4700000000000002 111.809 176.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.2 t -76.26 134.83 39.69 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 108.184 -1.043 . . . . 2.9300000000000002 108.184 153.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -61.7 -28.66 69.57 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 122.683 0.393 . . . . 2.9300000000000002 110.638 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.03 -40.82 67.41 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.541 -0.725 . . . . 2.21 110.991 175.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -67.16 -61.3 1.99 Allowed 'General case' 0 C--N 1.337 0.058 0 O-C-N 121.909 -0.494 . . . . 2.5299999999999998 109.971 176.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.4 tptt -54.56 -26.94 35.33 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.416 1.265 . . . . 6.6299999999999999 114.416 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.7 -44.5 56.36 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.258 1.423 . . . . 2.0899999999999999 112.254 170.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 77.6 t -59.46 -39.53 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 120.547 1.521 . . . . 2.0800000000000001 110.025 168.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.5 mt -55.57 -50.42 66.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-O 117.689 -1.148 . . . . 1.77 110.516 170.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.7 t -58.43 -40.68 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-N 120.42 1.464 . . . . 1.6299999999999999 111.685 178.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.23 -51.53 65.86 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.071 0.85 . . . . 1.9299999999999999 111.914 173.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.1 t -60.63 -46.8 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.5 1.52 . . . . 2.04 112.883 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.42 ' HG2' ' HD1' ' B' ' 198' ' ' HIS . 8.0 tm-20 -66.6 -44.34 82.41 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 3.3300000000000001 110.111 -176.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.5 t30 -65.59 -34.66 78.76 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.085 0.772 . . . . 3.0 113.085 177.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -63.63 -50.65 68.51 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 120.556 -1.34 . . . . 3.3799999999999999 112.459 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -63.34 -42.91 98.98 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 117.491 -1.242 . . . . 3.8999999999999999 113.037 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.8 ptmt -63.0 -29.58 70.94 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.251 1.841 . . . . 5.5599999999999996 112.932 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -74.5 -49.23 22.96 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.043 -1.036 . . . . 3.6600000000000001 112.719 172.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.4 t -66.54 -50.85 63.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 CA-C-N 119.371 0.987 . . . . 4.4199999999999999 112.903 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.3 p -175.1 -81.44 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.343 1.857 . . . . 5.0 109.392 -178.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.6 tttp 179.85 -60.43 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 129.179 2.992 . . . . 6.29 108.934 -177.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -131.22 3.06 4.29 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.545 1.138 . . . . 7.7199999999999998 113.993 -175.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.6 p -142.06 96.92 3.04 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.421 -1.424 . . . . 4.8099999999999996 112.886 -164.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 mp -87.26 -28.26 22.43 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.378 1.251 . . . . 9.3100000000000005 114.378 -173.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.1 m -65.11 -20.14 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 125.628 1.571 . . . . 5.7599999999999998 112.741 -175.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.55 111.94 23.88 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.17 1.388 . . . . 8.7400000000000002 112.525 179.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -42.33 131.56 3.63 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 125.672 1.589 . . . . 9.1600000000000001 112.527 170.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -173.23 -52.91 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 126.883 2.073 . . . . 11.140000000000001 109.718 -170.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.4 tt -77.38 164.78 3.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 N-CA-C 108.236 -1.024 . . . . 3.54 108.236 157.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.4 m -118.05 156.3 28.84 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.402 -0.811 . . . . 3.2400000000000002 110.825 164.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.41 ' HZ3' ' HA ' ' A' ' 67' ' ' ASP . 11.8 ttpt -64.96 -19.27 65.88 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.237 -1.539 . . . . 3.0899999999999999 113.145 -177.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.1 p -65.34 -28.96 69.66 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.112 1.365 . . . . 2.1400000000000001 114.079 164.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.9 m -68.3 -30.78 69.86 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.383 -1.448 . . . . 1.3500000000000001 112.815 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -59.24 -57.86 11.16 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 120.579 1.536 . . . . 3.6000000000000001 111.819 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -55.27 -25.06 31.51 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.589 1.155 . . . . 2.8700000000000001 112.152 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.401 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 26.2 mt-10 -90.34 -50.13 6.14 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 125.774 1.629 . . . . 3.79 112.662 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 59.7 ttp -45.37 -45.57 12.64 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 124.12 0.968 . . . . 2.4100000000000001 110.243 162.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.1 mt -58.16 -50.49 73.33 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 125.264 1.426 . . . . 1.8799999999999999 112.732 171.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -20.86 59.78 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 120.427 1.467 . . . . 3.0 113.972 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 1.4 mppt? -87.41 -48.55 7.87 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.778 1.231 . . . . 3.8300000000000001 110.237 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -74.64 -74.35 0.2 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.267 1.027 . . . . 3.8199999999999998 111.615 171.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.0 mt -74.77 32.68 0.09 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.69 1.596 . . . . 3.6699999999999999 113.422 -173.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -59.25 -22.79 61.66 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.675 1.59 . . . . 1.6299999999999999 113.47 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -77.5 -62.55 1.62 Allowed 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.181 0.901 . . . . 2.23 110.279 -178.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 6.8 ptp -62.23 -29.87 70.7 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.583 1.083 . . . . 3.2000000000000002 113.362 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.83 -61.62 1.79 Allowed 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.88 -0.785 . . . . 4.3600000000000003 108.88 170.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.9 m 54.86 -82.52 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.09 1.756 . . . . 4.7400000000000002 111.45 -169.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.2 161.12 24.13 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.7 2.0 . . . . 3.7999999999999998 113.97 -174.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.5 m -69.61 -23.81 63.57 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.864 1.666 . . . . 3.27 112.377 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.86 -52.17 54.56 Favored Glycine 0 N--CA 1.471 1.018 0 C-N-CA 126.188 1.851 . . . . 1.73 112.784 173.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -61.5 -27.0 68.28 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.052 0.541 . . . . 3.6899999999999999 112.15 172.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 94.0 mtm-85 -80.74 -17.06 52.23 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 114.055 1.132 . . . . 7.2800000000000002 114.055 170.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt -66.45 -36.05 81.82 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 119.055 -2.278 . . . . 4.54 110.918 169.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.8 -18.74 34.84 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 114.859 1.429 . . . . 1.8500000000000001 114.859 163.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -80.72 -53.26 6.67 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 119.913 1.233 . . . . 2.0699999999999998 110.896 166.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -57.44 -40.55 78.69 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.889 1.275 . . . . 2.7999999999999998 113.873 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.0 ptmt -53.3 -30.96 41.62 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.905 0.882 . . . . 3.9399999999999999 112.542 178.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 30.1 mt -80.21 -44.69 19.31 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 118.503 -0.761 . . . . 1.8100000000000001 111.067 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 6.2 mm -54.47 -48.14 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-O 118.624 -0.703 . . . . 1.9399999999999999 109.783 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -67.36 -28.76 68.22 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 114.162 1.171 . . . . 2.3500000000000001 114.162 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -73.89 -35.52 64.7 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.307 0.643 . . . . 4.6900000000000004 112.244 171.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -72.43 -29.08 63.38 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.607 1.163 . . . . 3.48 111.515 172.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.41 ' HA ' ' HZ3' ' A' ' 35' ' ' LYS . 79.1 m-20 -62.52 -21.6 65.66 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.83 1.652 . . . . 3.4199999999999999 113.355 175.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.15 -10.91 59.78 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.748 1.388 . . . . 2.6299999999999999 114.748 169.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -135.99 -34.28 0.81 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 116.206 1.928 . . . . 2.3500000000000001 116.206 -166.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.6 m170 -115.64 115.89 27.16 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.421 -1.425 . . . . 4.46 112.105 -170.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -140.95 152.88 45.33 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.187 1.395 . . . . 5.8200000000000003 110.342 162.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.32 -41.6 0.78 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 127.309 2.385 . . . . 3.7799999999999998 114.353 -177.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.3 mmt85 -98.41 139.92 33.44 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 127.949 2.5 . . . . 6.5700000000000003 111.414 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 45.3 mm -101.41 145.67 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 N-CA-C 107.803 -1.184 . . . . 2.8599999999999999 107.803 148.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 t -101.62 152.93 20.22 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.518 -0.739 . . . . 1.8899999999999999 111.759 169.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -58.23 -51.66 68.84 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.021 0.828 . . . . 3.6699999999999999 110.96 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -61.06 -15.14 29.16 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.119 1.368 . . . . 3.21 112.565 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -64.51 -57.85 8.03 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.468 1.107 . . . . 3.0600000000000001 111.963 -174.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.56 -42.32 78.39 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.012 -1.68 . . . . 3.0499999999999998 111.768 176.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 30.0 t-105 -63.96 -48.54 76.06 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 119.247 -0.406 . . . . 0.68999999999999995 111.907 -177.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 36.5 p -62.59 -44.71 95.62 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.777 1.231 . . . . 3.4399999999999999 111.064 175.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 93.3 mt -62.28 -38.69 90.31 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 118.389 -0.815 . . . . 1.8500000000000001 112.852 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 23.3 mm -55.22 -46.67 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 CA-C-N 120.397 1.453 . . . . 2.0600000000000001 111.585 175.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.55 -29.23 72.93 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 119.458 -0.634 . . . . 0.82999999999999996 113.186 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.42 -22.82 77.79 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-O 118.676 -1.069 . . . . 0.60999999999999999 114.163 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.7 mp -88.24 -47.62 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 118.959 1.38 . . . . 2.0099999999999998 110.323 162.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.6 m -75.97 31.89 0.12 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 127.017 2.127 . . . . 2.4900000000000002 112.355 -169.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.61 -85.39 1.16 Allowed Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.3 0.952 . . . . 1.4299999999999999 111.095 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -64.23 -36.16 47.93 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.743 2.295 . . . . 1.8 111.974 -176.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.62 -17.63 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 113.579 0.955 . . . . 2.4900000000000002 113.579 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.54 -44.31 94.55 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 120.037 1.289 . . . . 2.21 112.846 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.25 -36.83 84.96 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 120.753 -1.217 . . . . 4.5499999999999998 110.643 176.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.32 -46.87 88.38 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.579 1.152 . . . . 2.1600000000000001 111.355 173.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 83.4 mt -50.69 -58.87 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.732 0.813 . . . . 2.25 110.636 172.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -63.92 -37.13 86.29 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.859 -0.526 . . . . 1.9099999999999999 112.251 -176.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.291 3.9 pt-20 -76.83 -13.99 59.95 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.041 -1.037 . . . . 3.0499999999999998 112.239 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.61 -29.18 30.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.44 1.896 . . . . 2.46 114.643 167.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -76.23 3.94 9.74 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 123.104 1.43 . . . . 2.4399999999999999 111.995 173.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -132.41 -61.2 0.87 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 126.119 1.768 . . . . 3.0600000000000001 111.06 -175.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.32 14.12 2.02 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 129.113 2.965 . . . . 4.7800000000000002 115.879 164.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.6 t -158.89 32.7 0.22 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.298 1.439 . . . . 6.71 110.968 -174.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 49.2 m -78.37 -13.42 59.85 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.472 -1.393 . . . . 8.7699999999999996 114.332 176.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.255 1.365 0 C-N-CA 130.905 3.682 . . . . 10.82 109.032 -172.351 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 107.005 -1.479 . . . . 8.6199999999999992 107.005 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . 0.414 ' CG ' ' H ' ' B' ' 107' ' ' CYS . 36.3 t70 -50.5 -117.88 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.441 0 CA-C-N 118.387 0.54 . . . . 6.1799999999999997 110.389 109.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . 0.414 ' H ' ' CG ' ' B' ' 106' ' ' ASP . 50.2 t -98.6 -96.68 0.22 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.202 2.201 . . . . 4.4900000000000002 108.746 172.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 135.44 150.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.199 1 C-N-CA 132.793 4.437 . . . . 3.4500000000000002 111.783 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 7.2 t -75.4 137.64 41.17 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.093 -1.077 . . . . 2.8700000000000001 108.093 153.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -60.77 -28.67 68.9 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 122.568 0.347 . . . . 2.8599999999999999 110.573 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -39.25 69.42 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.131 -0.981 . . . . 2.4199999999999999 111.006 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -68.43 -60.67 2.27 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-O 119.319 -0.372 . . . . 2.5499999999999998 110.359 176.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -55.87 -27.24 50.83 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.341 1.237 . . . . 7.4800000000000004 114.341 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.14 -45.61 59.84 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.193 1.397 . . . . 2.1699999999999999 111.821 169.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 63.2 t -59.63 -39.62 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-N 120.892 1.678 . . . . 2.0499999999999998 110.442 170.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 10.6 mt -53.9 -50.21 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-O 117.605 -1.188 . . . . 1.8400000000000001 110.962 169.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 3.7 t -59.07 -43.23 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.072 1.306 . . . . 1.6299999999999999 111.671 178.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.3 mp -61.25 -45.76 93.2 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.06 0.845 . . . . 1.98 111.615 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 38.6 t -66.89 -44.38 88.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.262 1.425 . . . . 1.8700000000000001 113.141 178.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -66.43 -42.17 88.12 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.346 1.058 . . . . 3.1299999999999999 110.359 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -62.76 -31.02 71.89 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.625 0.972 . . . . 2.6299999999999999 113.625 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -71.32 -55.32 8.26 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.478 -1.389 . . . . 3.5899999999999999 111.949 176.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -61.13 -39.6 90.63 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.86 -1.15 . . . . 3.8799999999999999 113.191 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.65 -32.43 72.59 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.179 1.354 . . . . 5.4800000000000004 112.798 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -76.32 -43.62 40.41 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.76 -1.213 . . . . 3.6200000000000001 112.128 172.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 54.0 t -64.67 -51.03 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.462 1.105 . . . . 4.0999999999999996 113.173 -177.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 36.3 p 176.83 -80.47 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 127.624 2.37 . . . . 4.96 108.379 -174.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 37.6 tttp 178.25 -60.24 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 129.97 3.308 . . . . 6.2599999999999998 108.72 -177.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -131.27 4.35 4.36 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 114.257 1.206 . . . . 7.75 114.257 -173.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 5.6 p -141.77 106.53 4.89 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.371 -1.455 . . . . 4.8099999999999996 113.503 -170.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 1.1 mt -85.84 -37.98 18.61 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.535 1.134 . . . . 9.6099999999999994 113.285 -176.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 6.4 m -62.08 -28.57 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.404 1.082 . . . . 5.7599999999999998 112.035 -176.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.12 93.06 5.74 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.342 1.057 . . . . 8.5999999999999996 111.587 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 64.1 t-20 -39.58 126.6 1.88 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 125.89 1.676 . . . . 9.3599999999999994 112.72 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -171.27 -55.87 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 126.23 1.812 . . . . 10.949999999999999 110.705 -164.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.5 tt -71.52 176.65 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 107.476 -1.305 . . . . 3.54 107.476 156.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 66.8 m -142.96 161.36 38.32 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 119.769 -1.832 . . . . 3.5299999999999998 110.198 173.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . 0.437 ' HZ3' ' HA ' ' B' ' 170' ' ' ASP . 3.0 ttpt -68.4 -20.7 64.69 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 120.907 -1.12 . . . . 3.1699999999999999 112.806 -175.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 7.8 p -66.77 -31.25 71.77 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.262 1.425 . . . . 2.21 113.371 164.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 6.1 m -67.51 -35.56 79.34 Favored 'General case' 0 C--O 1.225 -0.229 0 O-C-N 120.574 -1.329 . . . . 1.3600000000000001 112.344 -177.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . 0.403 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 12.9 t80 -57.72 -58.8 6.74 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 119.606 1.094 . . . . 3.2200000000000002 111.434 -177.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -54.81 -26.07 32.44 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.618 1.167 . . . . 2.7000000000000002 112.373 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . 0.402 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 24.6 mt-10 -90.38 -50.88 5.71 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 125.739 1.616 . . . . 3.54 112.703 -174.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 63.5 ttp -45.53 -45.14 13.19 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 124.247 1.019 . . . . 2.6200000000000001 110.176 162.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 5.3 mt -57.85 -50.48 73.16 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 125.281 1.432 . . . . 1.8799999999999999 112.759 170.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -75.12 -21.96 58.51 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.411 1.46 . . . . 3.1299999999999999 114.139 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . 0.402 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 1.5 mppt? -85.02 -49.43 8.3 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.895 1.278 . . . . 3.52 110.068 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -74.27 -74.23 0.2 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.092 0.957 . . . . 3.8500000000000001 111.442 172.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 10.7 mt -75.11 33.61 0.1 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.946 1.699 . . . . 3.7599999999999998 113.214 -173.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -59.01 -23.03 61.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.641 1.576 . . . . 1.51 113.286 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -79.34 -61.42 2.01 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.226 0.921 . . . . 2.3100000000000001 110.687 -177.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 ptp -63.14 -26.73 68.95 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.564 1.075 . . . . 3.2200000000000002 113.848 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.08 -62.25 1.46 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.433 0.561 . . . . 4.3700000000000001 109.696 167.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 32.3 m 56.75 -82.13 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.894 1.678 . . . . 4.6399999999999997 111.995 -169.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -85.22 161.65 19.5 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.368 1.867 . . . . 3.8999999999999999 113.779 -170.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 44.0 m -70.8 -25.58 62.93 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 125.684 1.594 . . . . 3.52 112.164 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -59.01 -52.62 52.31 Favored Glycine 0 N--CA 1.469 0.889 0 C-N-CA 126.204 1.859 . . . . 1.95 112.345 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -60.34 -30.75 69.73 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.208 -0.584 . . . . 3.6299999999999999 112.101 172.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -77.61 -15.85 58.96 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 120.915 -1.116 . . . . 7.25 113.878 171.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -65.54 -35.55 81.19 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 119.165 -2.209 . . . . 4.7199999999999998 111.192 169.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.61 -19.23 36.87 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 114.901 1.445 . . . . 1.74 114.901 164.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.69 -54.0 6.28 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.632 1.106 . . . . 2.1000000000000001 111.151 166.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -57.57 -40.41 78.91 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.487 1.115 . . . . 2.71 113.468 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -52.9 -32.71 46.68 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.897 0.879 . . . . 3.9399999999999999 112.456 178.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 39.7 mt -77.98 -45.14 24.65 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 118.708 -0.663 . . . . 1.8500000000000001 110.543 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.81 -47.83 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.36 -0.829 . . . . 1.9199999999999999 109.575 -177.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -66.84 -32.38 73.62 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.961 1.097 . . . . 2.29 113.961 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -69.22 -35.71 76.47 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.555 -0.716 . . . . 4.7999999999999998 112.003 171.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -74.28 -28.54 61.24 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.829 1.252 . . . . 3.7200000000000002 111.943 173.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . 0.437 ' HA ' ' HZ3' ' B' ' 138' ' ' LYS . 79.2 m-20 -63.73 -21.48 66.42 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.095 1.758 . . . . 3.48 113.266 175.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.57 -9.42 59.78 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.701 1.371 . . . . 2.5899999999999999 114.701 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -136.34 -35.02 0.76 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.104 1.89 . . . . 2.3700000000000001 116.104 -166.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -109.54 108.1 18.44 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.47 -1.394 . . . . 4.3799999999999999 111.469 -174.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -121.04 156.32 32.45 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.32 1.448 . . . . 5.1399999999999997 110.309 161.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 64.91 -5.13 1.33 Allowed Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.647 1.594 . . . . 3.7200000000000002 116.615 169.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 21.8 mmt85 -144.88 152.73 40.69 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 126.902 2.081 . . . . 6.2699999999999996 111.214 -165.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 32.7 mm -122.01 150.18 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.528 1.531 . . . . 3.0499999999999998 107.44 156.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.3 t -108.03 157.97 17.79 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.632 0.773 . . . . 2.0299999999999998 112.226 169.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -60.01 -50.86 72.06 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 121.109 -0.995 . . . . 3.52 111.353 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -61.7 -16.24 47.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.796 1.238 . . . . 3.3900000000000001 112.637 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -64.2 -55.25 22.98 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.115 0.966 . . . . 3.0899999999999999 112.188 -175.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -57.22 -44.17 83.48 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.185 -1.572 . . . . 3.1800000000000002 111.848 175.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -64.01 -48.04 77.92 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 119.258 -0.401 . . . . 0.75 112.031 -177.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 40.3 p -62.42 -44.52 96.22 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.659 1.184 . . . . 3.4100000000000001 111.286 175.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . 0.403 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 93.8 mt -62.91 -38.8 92.42 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 118.164 -0.922 . . . . 1.76 112.599 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 23.2 mm -54.36 -46.18 69.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 CA-C-N 120.514 1.506 . . . . 2.0099999999999998 111.389 174.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.46 -29.1 72.4 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 118.569 0.622 . . . . 0.77000000000000002 113.035 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.69 -22.49 78.68 Favored Glycine 0 CA--C 1.535 1.304 0 CA-C-O 118.651 -1.083 . . . . 0.59999999999999998 114.264 178.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.6 mp -87.29 -48.67 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 CA-C-N 119.132 1.466 . . . . 2.0299999999999998 109.879 162.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 2.6 m -75.38 33.62 0.11 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 127.209 2.204 . . . . 2.4100000000000001 111.913 -169.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -88.95 -87.17 1.24 Allowed Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.54 1.067 . . . . 1.5 110.758 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.78 -34.29 62.08 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.799 2.333 . . . . 1.8 111.954 -175.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.29 -20.98 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 118.703 -0.665 . . . . 2.5 112.764 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.01 87.71 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 120.159 1.345 . . . . 2.0499999999999998 112.911 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.37 -36.83 83.5 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 120.825 -1.172 . . . . 4.5199999999999996 110.231 177.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -46.68 88.54 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.751 1.221 . . . . 2.4100000000000001 111.886 173.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 77.8 mt -50.61 -59.35 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.9 0.88 . . . . 2.25 110.515 171.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . 0.42 ' HD1' ' HG2' ' A' ' 17' ' ' GLU . 81.2 t60 -65.02 -35.95 82.83 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.935 -0.478 . . . . 1.8500000000000001 112.269 -175.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.264 4.3 pt-20 -77.08 -15.89 59.41 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 117.951 -1.024 . . . . 3.2799999999999998 112.139 177.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -81.12 -32.04 33.98 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.944 1.697 . . . . 2.3999999999999999 114.392 168.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -73.47 5.04 4.07 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 123.212 1.482 . . . . 2.3100000000000001 112.177 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -134.29 -61.46 0.78 Allowed 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 126.644 1.977 . . . . 3.0699999999999998 111.24 -174.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.68 16.5 1.98 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 129.202 3.001 . . . . 4.7300000000000004 115.729 163.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 47.6 t -159.41 32.12 0.2 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.619 1.568 . . . . 6.8600000000000003 110.915 -175.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 46.4 m -78.38 -13.03 60.02 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 120.596 -1.315 . . . . 8.9600000000000009 114.467 176.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.257 1.468 0 C-N-CA 131.653 3.981 . . . . 10.949999999999999 107.723 -172.152 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 m . . . . . 0 N--CA 1.473 0.705 0 CA-C-O 118.871 -0.585 . . . . 10.82 110.645 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -71.54 -116.5 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 107.376 -1.342 . . . . 7.1399999999999997 107.376 140.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 53.2 t -79.06 -74.19 0.3 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.627 1.171 . . . . 4.3099999999999996 109.345 154.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 86.11 146.22 0.06 Allowed 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 129.58 3.152 . . . . 3.7999999999999998 112.029 -176.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 47.3 p -81.23 155.41 26.13 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 121.323 -0.861 . . . . 2.0299999999999998 109.792 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.426 ' CD ' ' HZ1' ' A' ' 10' ' ' LYS . 4.8 tp10 -61.21 -35.44 77.2 Favored 'General case' 0 C--O 1.223 -0.307 0 O-C-N 120.556 -1.34 . . . . 2.1299999999999999 111.641 -177.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -49.56 76.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.507 1.523 . . . . 1.99 110.9 174.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.416 ' CD ' ' HD1' ' B' ' 151' ' ' HIS . 50.3 tt0 -69.0 -53.06 22.55 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.217 1.807 . . . . 2.7400000000000002 111.27 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.426 ' HZ1' ' CD ' ' A' ' 7' ' ' GLU . 0.3 OUTLIER -52.07 -34.82 45.42 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.256 1.022 . . . . 6.29 110.356 169.908 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.04 -39.28 50.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 117.343 -1.313 . . . . 1.5900000000000001 112.992 177.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.7 t -52.72 -45.28 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 121.111 1.778 . . . . 1.72 110.719 164.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.06 -50.55 77.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.124 0.874 . . . . 1.8600000000000001 111.148 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.9 t -60.07 -34.95 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.63 1.172 . . . . 1.6000000000000001 112.702 176.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 mp -72.09 -43.03 65.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.8 1.182 . . . . 1.96 110.967 174.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.3 t -58.6 -45.7 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 125.456 1.503 . . . . 1.8700000000000001 110.99 173.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.418 ' CD ' ' HZ3' ' A' ' 21' ' ' LYS . 16.3 tm-20 -67.01 -45.76 76.57 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.867 1.267 . . . . 2.8999999999999999 111.12 174.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.403 ' HA ' ' CD ' ' A' ' 21' ' ' LYS 0.285 1.5 t30 -71.1 -7.32 45.69 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 115.143 1.534 . . . . 2.8300000000000001 115.143 179.244 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -82.82 -66.79 0.85 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.547 0.739 . . . . 3.6499999999999999 111.892 153.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -59.73 -32.8 70.88 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.266 1.21 . . . . 3.5299999999999998 114.266 -167.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.418 ' HZ3' ' CD ' ' A' ' 17' ' ' GLU . 10.0 ptmt -54.76 -25.88 30.68 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 119.723 -1.861 . . . . 3.21 113.756 175.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -82.66 -1.36 50.88 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.719 1.377 . . . . 4.0800000000000001 114.719 178.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.1 m -69.91 156.16 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.84 1.2 . . . . 4.9900000000000002 109.808 170.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.6 t -69.25 -13.3 62.33 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 115.777 1.769 . . . . 7.2400000000000002 115.777 -166.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -179.68 -51.26 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.025 2.13 . . . . 12.640000000000001 111.952 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -164.13 155.74 16.28 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 129.305 3.042 . . . . 9.8399999999999999 109.426 175.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.2 p -179.25 114.57 0.06 Allowed 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.391 0.996 . . . . 5.7199999999999998 113.219 176.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.0 mt -86.51 -11.21 52.34 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.533 1.679 . . . . 9.9100000000000001 115.533 -175.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.437 ' CG1' ' H ' ' A' ' 30' ' ' LYS . 11.3 p -140.54 -78.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.318 0 C-N-CA 124.839 1.255 . . . . 7.4199999999999999 108.809 157.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.437 ' H ' ' CG1' ' A' ' 29' ' ' VAL . 11.4 ttpp -69.36 109.77 4.34 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 112.809 0.67 . . . . 10.960000000000001 112.809 -171.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -76.76 -179.91 5.67 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 122.321 1.058 . . . . 11.02 112.911 178.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.3 tmtt? -143.37 44.55 1.53 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 126.014 1.726 . . . . 9.3300000000000001 109.404 172.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.4 tt -72.64 169.26 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.825 1.65 . . . . 3.79 109.374 161.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.1 t -102.43 141.98 34.37 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.916 -1.115 . . . . 3.8500000000000001 109.526 164.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.425 ' HZ2' ' CD2' ' A' ' 70' ' ' HIS . 73.4 mttt -61.24 -17.8 55.18 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.054 -1.654 . . . . 3.3199999999999998 113.026 174.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.3 t -61.4 -33.2 73.28 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.466 -0.771 . . . . 4.6200000000000001 112.578 166.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -65.02 -37.5 87.83 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 120.878 -1.138 . . . . 1.9299999999999999 113.185 -173.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 67.8 t80 -62.15 -54.75 36.61 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.887 1.221 . . . . 3.4700000000000002 111.899 176.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 24.7 ptt180 -65.64 -5.91 9.71 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.203 1.001 . . . . 2.8999999999999999 113.187 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.416 ' HB3' ' HE2' ' A' ' 44' ' ' LYS . 6.5 mt-10 -102.27 -43.1 5.8 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 126.657 1.983 . . . . 2.8199999999999998 111.851 176.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 4.9 ttm -52.65 -43.29 65.4 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.766 1.27 . . . . 2.3399999999999999 109.968 168.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.412 HD13 ' CZ ' ' A' ' 38' ' ' PHE . 72.1 mt -74.72 11.92 0.94 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 127.889 2.476 . . . . 2.2200000000000002 115.402 169.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -125.74 -11.38 6.67 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 125.7 1.6 . . . . 2.9500000000000002 113.023 166.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.416 ' HE2' ' HB3' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -109.0 -76.48 0.61 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.278 1.431 . . . . 2.2799999999999998 110.983 176.51 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.47 -19.67 66.03 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 120.624 1.557 . . . . 3.1000000000000001 115.026 -175.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.34 7.02 22.82 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.427 1.269 . . . . 2.6699999999999999 114.427 177.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -50.32 -33.9 21.82 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 117.615 2.45 . . . . 2.0699999999999998 117.615 -165.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -68.47 -25.12 64.82 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 121.102 1.773 . . . . 5.0099999999999998 112.214 -177.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.2 tpp -73.12 -7.44 51.37 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.673 1.989 . . . . 2.71 113.144 175.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.28 21.98 4.81 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.91 1.684 . . . . 4.9500000000000002 114.317 -162.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.5 t -35.31 -63.45 0.34 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 126.132 1.773 . . . . 4.6299999999999999 112.426 164.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -81.53 95.97 7.29 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 124.335 1.054 . . . . 6.1399999999999997 108.167 -177.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.2 p -51.42 -18.12 0.95 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.563 1.945 . . . . 4.5499999999999998 115.831 -168.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -58.02 -35.07 74.71 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.39 0.995 . . . . 2.1200000000000001 112.63 171.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 74.1 m-80 -59.22 -38.41 79.87 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 117.83 0.815 . . . . 4.4199999999999999 111.535 172.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.94 -27.15 49.27 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 114.498 1.296 . . . . 6.0199999999999996 114.498 172.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -59.56 -37.01 77.32 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 119.546 -1.971 . . . . 4.1200000000000001 110.971 167.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.3 -11.5 42.33 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.952 1.464 . . . . 2.1400000000000001 114.952 169.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.69 -52.03 6.38 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 120.502 1.501 . . . . 1.71 112.173 164.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.94 -35.32 76.42 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 118.951 0.796 . . . . 2.3100000000000001 112.268 -176.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -24.67 67.73 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.892 1.071 . . . . 5.6100000000000003 113.892 177.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.6 mt -73.98 -34.66 64.3 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 122.662 0.385 . . . . 1.8500000000000001 111.067 176.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 37.8 mm -58.27 -50.36 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.064 0.946 . . . . 2.1299999999999999 110.982 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.36 -38.18 89.29 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.016 0.926 . . . . 2.8500000000000001 112.645 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.38 -41.51 76.34 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.845 0.858 . . . . 4.0 112.12 166.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -73.16 -40.97 64.41 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 123.437 0.695 . . . . 4.2000000000000002 111.449 -178.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -49.57 -41.99 43.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.893 1.277 . . . . 2.5600000000000001 112.723 175.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.82 -16.93 62.5 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.322 1.601 . . . . 2.5699999999999998 115.322 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -133.68 16.04 3.97 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.505 1.298 . . . . 3.7999999999999998 114.505 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.425 ' CD2' ' HZ2' ' A' ' 35' ' ' LYS . 18.4 t60 -119.48 107.05 12.84 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.897 1.279 . . . . 5.71 110.97 -174.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -73.63 0.23 13.38 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.467 1.907 . . . . 5.54 114.223 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.59 -2.43 57.31 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 117.785 -1.564 . . . . 3.1400000000000001 113.54 -167.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.433 HH11 ' HG2' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -70.89 77.03 0.64 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.134 1.967 . . . . 5.7800000000000002 109.804 164.306 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -55.46 125.79 11.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 107.763 -1.199 . . . . 4.3600000000000003 107.763 164.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 36.9 t -137.31 146.19 44.34 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 124.792 1.237 . . . . 2.2200000000000002 111.594 -170.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -53.09 -41.6 65.09 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.95 1.093 . . . . 3.3700000000000001 113.95 -171.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -76.62 -14.46 59.98 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.837 0.681 . . . . 4.29 112.837 -174.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -64.84 -49.31 71.1 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.146 -0.971 . . . . 2.98 109.453 172.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -53.68 -48.18 69.73 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.261 -1.524 . . . . 3.1600000000000001 111.929 171.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 30.5 t-105 -68.97 -46.15 68.85 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.843 0.683 . . . . 0.60999999999999999 112.843 -171.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 57.5 p -59.73 -45.91 90.73 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.994 0.918 . . . . 3.29 111.027 171.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.422 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 91.6 mt -62.19 -38.46 89.21 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 117.31 -1.329 . . . . 1.73 112.323 -179.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.4 mm -50.61 -44.02 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 121.294 1.861 . . . . 1.77 111.261 174.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.11 -22.25 72.37 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 125.194 1.378 . . . . 0.56999999999999995 114.308 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.14 -20.0 70.66 Favored Glycine 0 CA--C 1.532 1.123 0 CA-C-N 118.362 1.081 . . . . 0.59999999999999998 113.193 173.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.5 mp -102.84 -45.49 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.768 1.227 . . . . 2.1600000000000001 110.947 163.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.0 m -80.88 72.45 7.88 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 127.108 2.163 . . . . 1.6899999999999999 108.635 -176.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -158.92 -71.23 0.02 OUTLIER Glycine 0 CA--C 1.525 0.664 0 C-N-CA 127.467 2.461 . . . . 1.0600000000000001 109.052 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -55.77 -55.63 2.84 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.187 2.591 . . . . 1.2 111.64 170.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.8 pt -74.27 -17.33 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 N-CA-C 114.361 1.245 . . . . 1.95 114.361 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.74 -48.06 82.43 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.91 0.777 . . . . 1.8100000000000001 112.435 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.69 -47.65 76.43 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.217 -0.927 . . . . 3.9500000000000002 111.804 169.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.4 tt -57.01 -45.35 83.13 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-O 117.722 -1.132 . . . . 2.8999999999999999 111.403 -178.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.9 mt -46.32 -55.28 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 120.009 1.277 . . . . 1.8300000000000001 111.005 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -61.73 -49.98 74.25 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.296 0.638 . . . . 1.8100000000000001 111.305 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -61.9 -36.58 81.73 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.891 0.876 . . . . 3.9399999999999999 111.434 -178.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -68.13 -44.6 75.73 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 127.896 2.478 . . . . 2.8100000000000001 111.314 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -68.2 -21.86 64.84 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.31 1.414 . . . . 3.3300000000000001 111.714 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.93 -51.49 8.5 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.535 0.734 . . . . 2.6200000000000001 111.191 172.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -64.6 -26.87 68.59 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.26 1.824 . . . . 7.2699999999999996 113.324 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.6 m 53.91 20.26 2.3 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.608 2.363 . . . . 8.2100000000000009 114.021 -170.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 74.89 21.85 1.98 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 128.541 2.737 . . . . 12.76 114.242 -178.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 24.9 t . . . . . 0 C--O 1.253 1.247 0 CA-C-O 115.569 -2.158 . . . . 10.880000000000001 114.515 168.782 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 52.6 m . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 119.145 -0.455 . . . . 12.02 109.847 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.56 -117.47 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.123 0 N-CA-C 108.348 -0.982 . . . . 8.1199999999999992 108.348 138.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 42.0 t -80.81 -83.26 0.11 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.581 1.952 . . . . 5.1500000000000004 110.868 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 94.73 157.54 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 129.048 2.939 . . . . 3.5299999999999998 114.039 163.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.1 p -81.83 155.23 25.49 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.866 -1.146 . . . . 2.25 109.754 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -61.05 -36.51 79.79 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 120.728 1.604 . . . . 2.3599999999999999 111.752 -178.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -47.86 84.43 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.615 1.166 . . . . 1.8799999999999999 110.34 176.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -68.15 -54.1 20.41 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.314 1.446 . . . . 2.98 111.645 -177.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -33.91 66.6 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.517 1.127 . . . . 5.4100000000000001 109.96 172.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.96 -45.33 67.63 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 117.199 -1.381 . . . . 1.6499999999999999 112.201 173.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 22.5 t -53.78 -41.27 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-N 121.154 1.797 . . . . 1.8600000000000001 110.625 170.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 70.3 mt -58.48 -54.47 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.405 -0.807 . . . . 2.0699999999999998 112.172 169.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.4 t -58.34 -42.88 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 119.405 1.002 . . . . 1.79 112.103 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.5 mp -64.87 -47.1 79.1 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.796 1.238 . . . . 2.1699999999999999 111.469 176.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.9 t -57.65 -48.22 83.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 123.292 0.637 . . . . 1.8300000000000001 110.514 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . 0.511 ' CD ' ' HZ3' ' B' ' 124' ' ' LYS . 8.8 tm-20 -62.89 -34.18 76.86 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.532 1.133 . . . . 2.8700000000000001 111.738 175.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.0 -25.24 64.41 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.596 1.544 . . . . 2.6499999999999999 113.465 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -72.63 -52.86 13.62 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.566 -0.708 . . . . 3.3300000000000001 111.0 165.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -65.9 -43.59 87.74 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.545 -0.722 . . . . 3.5699999999999998 112.923 -173.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . 0.511 ' HZ3' ' CD ' ' B' ' 120' ' ' GLU . 7.9 ptmt -58.01 -16.58 13.08 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 120.274 -1.516 . . . . 4.2699999999999996 114.941 177.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -89.61 -4.25 57.9 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.737 1.384 . . . . 4.4800000000000004 114.737 173.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 3.4 m -77.96 158.72 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 120.593 1.542 . . . . 4.5999999999999996 111.188 173.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 2.1 t -60.27 -11.78 7.3 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 118.469 2.766 . . . . 7.2199999999999998 118.469 -168.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -176.2 -50.91 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.465 1.906 . . . . 11.869999999999999 111.973 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -172.84 148.72 1.86 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 130.313 3.445 . . . . 10.08 107.313 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 100.0 p -162.74 121.68 2.18 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 121.106 1.775 . . . . 6.1399999999999997 114.127 174.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 32.5 mt -82.7 -20.26 36.43 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 115.61 1.707 . . . . 9.8000000000000007 115.61 -168.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 11.9 p -149.05 -65.64 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 C-N-CA 126.996 2.118 . . . . 7.8399999999999999 108.874 168.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 12.4 ttpp -80.58 110.5 16.12 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.142 0.496 . . . . 10.75 111.551 -177.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -77.47 179.36 6.54 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.989 1.376 . . . . 11.619999999999999 113.152 -178.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.45 56.18 0.98 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.479 1.911 . . . . 9.0399999999999991 107.936 168.278 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 16.6 tt -82.11 169.78 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 N-CA-C 106.991 -1.485 . . . . 3.8500000000000001 106.991 157.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 29.6 t -100.18 144.56 29.06 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 120.735 -1.228 . . . . 3.77 109.559 161.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -58.16 -21.64 47.91 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.572 -1.33 . . . . 3.1899999999999999 112.766 171.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 5.1 t -63.43 -34.46 77.8 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.756 0.65 . . . . 4.46 112.756 170.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 14.7 m -63.17 -42.66 99.44 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 120.942 -1.099 . . . . 2.0299999999999998 112.05 -175.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . 0.424 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 65.4 t80 -51.33 -60.28 3.3 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.174 0.99 . . . . 3.3500000000000001 112.061 171.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.1 ptt180 -65.18 -14.7 61.24 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.604 0.964 . . . . 3.04 113.604 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . 0.447 ' HB3' ' HE2' ' B' ' 147' ' ' LYS . 7.6 mt-10 -94.21 -40.91 9.76 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 126.467 1.907 . . . . 2.8399999999999999 113.398 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.3 tmm? -59.77 -39.44 84.86 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.342 -0.614 . . . . 2.4900000000000002 109.342 167.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.76 9.15 0.2 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.275 2.23 . . . . 2.8999999999999999 115.352 164.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -128.6 -21.84 3.39 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.465 1.283 . . . . 3.0800000000000001 114.465 168.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . 0.447 ' HE2' ' HB3' ' B' ' 143' ' ' GLU . 0.0 OUTLIER -108.19 -42.44 4.63 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.758 1.223 . . . . 2.3700000000000001 113.56 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -106.77 -26.07 11.45 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.723 2.009 . . . . 2.9100000000000001 112.67 -163.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.93 18.8 20.84 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.881 1.672 . . . . 2.6400000000000001 111.996 167.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -59.5 -35.46 74.18 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 116.04 1.867 . . . . 2.3599999999999999 116.04 -159.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . 0.416 ' HD1' ' CD ' ' A' ' 9' ' ' GLU . 1.5 m80 -60.95 -45.48 94.55 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 120.002 1.273 . . . . 4.8899999999999997 111.159 -178.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 tpp -59.8 -17.03 32.6 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.042 1.737 . . . . 2.7799999999999998 113.174 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.07 26.25 9.78 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.836 2.055 . . . . 5.2999999999999998 112.686 -174.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 43.4 t -64.85 -16.69 63.48 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.161 1.541 . . . . 4.8600000000000003 115.161 177.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -100.98 125.41 47.58 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 120.019 1.281 . . . . 5.0899999999999999 108.354 161.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 58.0 p -64.43 -21.51 66.67 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.802 1.038 . . . . 4.3799999999999999 113.802 -173.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -61.64 -37.1 93.66 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-N 119.646 1.112 . . . . 2.29 111.89 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -62.66 -38.71 91.41 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 119.01 -0.519 . . . . 4.3799999999999999 111.688 174.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -77.19 -27.45 53.6 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 119.739 1.154 . . . . 5.7599999999999998 114.018 173.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -57.68 -40.29 79.07 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 119.601 -1.937 . . . . 4.21 111.473 166.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.06 -12.9 43.06 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.31 1.596 . . . . 2.3700000000000001 115.31 170.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.53 -50.04 8.65 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 120.368 1.44 . . . . 1.8799999999999999 112.337 165.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.55 -35.1 76.81 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.617 0.644 . . . . 2.1600000000000001 112.173 -177.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.8 -23.11 67.08 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 114.13 1.159 . . . . 5.5700000000000003 114.13 176.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 22.1 mt -74.13 -33.85 63.69 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 122.579 0.352 . . . . 1.8799999999999999 111.46 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 29.1 mm -59.71 -50.08 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 124.349 1.06 . . . . 1.97 110.527 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -65.52 -36.04 82.65 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.471 0.653 . . . . 2.6800000000000002 112.671 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -57.14 -43.46 82.47 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.672 0.789 . . . . 4.1600000000000001 112.232 165.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 4.9 tp -69.79 -42.23 74.02 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 118.485 0.584 . . . . 4.2800000000000002 111.287 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -51.5 -40.83 60.33 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.196 1.398 . . . . 2.6699999999999999 112.173 174.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.46 -15.25 62.44 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.914 1.82 . . . . 2.5299999999999998 115.914 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -135.08 14.71 3.55 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 115.199 1.555 . . . . 4.04 115.199 -175.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -122.68 110.0 14.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.934 1.294 . . . . 5.75 110.908 -171.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -73.47 -27.04 61.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.876 2.07 . . . . 5.46 113.634 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 125.36 -8.33 7.91 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-O 117.953 -1.471 . . . . 3.6200000000000001 113.728 -169.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -68.51 76.7 0.28 Allowed 'General case' 0 C--N 1.346 0.421 0 CA-C-N 120.411 2.106 . . . . 8.8499999999999996 109.522 157.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.73 137.4 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 107.922 -1.14 . . . . 4.5999999999999996 107.922 164.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 16.9 t -142.24 147.25 36.18 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.623 0.601 . . . . 2.3399999999999999 112.623 -173.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -48.9 -48.53 42.38 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.793 1.237 . . . . 3.2999999999999998 113.751 -172.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -74.36 -12.71 60.6 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 113.636 0.976 . . . . 4.3899999999999997 113.636 -174.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -60.96 -51.45 69.21 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.135 -0.978 . . . . 3.0600000000000001 109.399 171.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -52.29 -49.13 64.75 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.746 -1.221 . . . . 3.1899999999999999 112.494 172.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 26.7 t-105 -69.1 -45.13 71.02 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 118.576 -0.726 . . . . 0.71999999999999997 112.457 -172.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 46.3 p -59.34 -45.36 91.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.458 1.103 . . . . 3.25 110.808 170.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . 0.424 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 58.7 mt -59.06 -40.91 86.61 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 117.36 -1.305 . . . . 1.6399999999999999 112.584 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 22.5 mm -53.69 -40.8 44.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 121.382 1.901 . . . . 1.76 112.074 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -65.18 -25.84 71.25 Favored Glycine 0 N--CA 1.473 1.107 0 C-N-CA 124.407 1.004 . . . . 0.56000000000000005 113.545 177.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -62.25 -19.68 59.86 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 118.391 1.095 . . . . 0.71999999999999997 113.986 173.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.2 mp -110.27 -36.78 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 CA-C-N 118.449 1.125 . . . . 2.1299999999999999 111.733 166.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 22.7 m -82.32 73.79 9.33 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 125.948 1.699 . . . . 1.71 108.04 -178.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -161.85 -67.78 0.02 OUTLIER Glycine 0 CA--C 1.529 0.947 0 C-N-CA 127.283 2.373 . . . . 1.1100000000000001 110.026 -175.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -58.27 -61.28 0.28 Allowed 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.307 2.671 . . . . 1.0800000000000001 111.178 168.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.9 pt -66.48 -28.09 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 CA-C-N 119.242 0.928 . . . . 2.2000000000000002 112.975 177.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -56.57 -46.01 80.98 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.889 0.768 . . . . 1.8999999999999999 112.826 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -65.98 -30.17 70.69 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.171 -0.955 . . . . 5.9800000000000004 113.488 172.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 35.4 mt -68.14 -41.02 82.26 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.589 1.086 . . . . 6.1100000000000003 111.943 176.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 70.5 mt -53.53 -42.88 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 119.278 0.944 . . . . 1.8899999999999999 110.805 171.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -61.98 -47.77 83.33 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 117.835 -1.078 . . . . 2.3500000000000001 111.93 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -52.57 -49.32 65.2 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.368 1.067 . . . . 3.4700000000000002 110.666 171.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -46.52 66.55 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.036 1.334 . . . . 5.7599999999999998 112.761 -177.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -77.8 -4.7 47.78 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.614 0.643 . . . . 2.7000000000000002 112.527 -177.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -98.82 -49.04 4.7 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.061 0.945 . . . . 3.8199999999999998 111.261 170.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -64.43 -28.7 69.85 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 128.019 2.527 . . . . 6.3099999999999996 112.967 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 59.46 16.72 5.41 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.373 1.869 . . . . 7.3799999999999999 113.314 -166.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 8.0 t 82.43 12.65 0.54 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 128.397 2.679 . . . . 12.42 116.229 174.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.255 1.365 0 CA-C-O 115.184 -2.341 . . . . 11.15 115.757 175.306 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 CA--C 1.503 -0.827 0 N-CA-C 108.736 -0.839 . . . . 10.640000000000001 108.736 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -133.74 -17.7 2.2 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 124.813 1.321 . . . . 6.8300000000000001 113.223 -134.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 74.8 m 64.65 20.66 12.21 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.677 1.991 . . . . 3.7599999999999998 115.828 162.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -44.72 120.75 2.4 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.978 1.311 . . . . 3.77 111.916 -177.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.9 p -61.84 156.58 20.27 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 118.967 0.803 . . . . 1.99 110.403 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.421 ' CD ' ' HZ3' ' A' ' 10' ' ' LYS . 16.6 tp10 -63.19 -27.78 69.6 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.047 0.758 . . . . 2.1600000000000001 113.047 -178.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt -69.36 -47.87 63.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.728 1.211 . . . . 2.5899999999999999 109.984 172.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -49.74 62.8 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 122.837 0.455 . . . . 2.5499999999999998 111.367 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.421 ' HZ3' ' CD ' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -48.94 -36.49 17.48 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.729 1.612 . . . . 6.4699999999999998 111.124 172.539 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.19 -21.33 56.6 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.184 -1.572 . . . . 2.0099999999999998 113.716 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.1 t -60.89 -38.03 78.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 CA-C-N 121.143 1.792 . . . . 2.3100000000000001 110.066 169.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.5 mt -56.7 -56.95 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-O 118.825 -0.607 . . . . 2.3700000000000001 109.967 168.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 99.5 t -54.34 -40.28 47.66 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 124.642 1.177 . . . . 1.9299999999999999 112.933 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -72.62 -39.02 67.6 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.268 -0.895 . . . . 2.1099999999999999 112.432 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.1 t -64.55 -40.41 88.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.067 0.947 . . . . 1.98 111.53 172.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -55.15 -54.21 46.16 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.38 1.072 . . . . 2.6899999999999999 110.094 174.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -56.48 -30.16 62.6 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 115.479 1.659 . . . . 3.25 115.479 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -73.59 -57.85 3.71 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.532 0.606 . . . . 3.7599999999999998 112.171 173.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -68.38 -17.33 64.21 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.311 1.226 . . . . 3.02 114.311 -171.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -44.27 -32.64 1.34 Allowed 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 120.546 1.521 . . . . 3.8199999999999998 113.215 171.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -93.4 8.02 42.17 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.07 1.748 . . . . 3.4700000000000002 114.033 -174.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.4 m -139.66 165.49 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 125.398 1.479 . . . . 3.27 110.27 172.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.21 -42.68 62.39 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.39 0.885 . . . . 3.6499999999999999 113.39 -172.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.437 ' HE2' ' CD2' ' B' ' 198' ' ' HIS . 0.9 OUTLIER -169.5 -51.19 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.951 1.3 . . . . 5.9900000000000002 110.246 173.959 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -125.85 13.52 7.95 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.426 1.49 . . . . 7.6500000000000004 111.925 -175.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.432 ' C ' ' H ' ' A' ' 29' ' ' VAL . 0.8 OUTLIER -80.36 36.94 0.38 Allowed 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 115.665 1.728 . . . . 4.9299999999999997 115.665 -156.786 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -59.02 14.09 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 130.199 3.4 . . . . 9.4900000000000002 115.331 176.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.432 ' H ' ' C ' ' A' ' 27' ' ' SER . 2.5 t -152.71 141.47 14.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 128.941 2.897 . . . . 4.96 107.059 -178.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt 72.96 -47.08 0.67 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 127.063 2.145 . . . . 9.5199999999999996 114.294 177.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -65.38 -65.21 0.7 Allowed 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.021 0.828 . . . . 7.6799999999999997 109.876 -178.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.42 ' HZ3' ' HB3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER 69.15 111.55 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.855 1.662 . . . . 7.4500000000000002 112.207 167.539 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 12.0 pt -64.61 151.87 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 O-C-N 120.681 -1.262 . . . . 3.77 111.085 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.4 t -76.41 138.63 40.5 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 120.504 -1.372 . . . . 4.0199999999999996 111.954 177.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.9 mtpt -72.51 -6.74 45.96 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.098 -0.955 . . . . 4.1299999999999999 113.309 169.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.1 p -80.3 -48.31 13.2 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.294 0.952 . . . . 3.8999999999999999 111.056 156.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.6 m -59.06 -35.6 73.61 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 117.234 -1.365 . . . . 1.7 113.751 -167.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -60.16 -60.38 3.91 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 121.058 1.754 . . . . 3.8100000000000001 112.07 172.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -63.78 -23.87 67.54 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.872 0.693 . . . . 3.4500000000000002 112.872 -178.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -71.45 -49.0 45.77 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.121 1.368 . . . . 3.23 112.774 169.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 8.4 tmm? -59.37 -35.88 74.73 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 126.125 1.77 . . . . 1.74 111.804 -174.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.2 mt -59.07 -20.24 51.58 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.679 1.592 . . . . 2.02 114.695 168.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -1.15 18.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.789 1.177 . . . . 2.79 113.228 175.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.62 -37.14 7.23 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.144 1.378 . . . . 2.77 112.839 172.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -96.79 -72.2 0.65 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.93 1.692 . . . . 4.5 109.637 169.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.95 20.7 0.06 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 125.944 1.698 . . . . 2.4300000000000002 114.769 -171.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -66.63 -23.01 66.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 128.964 2.906 . . . . 1.45 116.2 -164.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.478 ' H ' ' CD2' ' A' ' 48' ' ' HIS . 0.3 OUTLIER -76.42 -54.84 6.16 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.417 1.008 . . . . 2.0099999999999998 109.608 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.4 tpp -47.7 -42.91 26.07 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.485 2.314 . . . . 2.79 113.797 162.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -109.22 34.72 3.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.729 1.212 . . . . 5.3600000000000003 113.076 -175.262 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.4 p -62.88 -39.49 94.63 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 114.942 -1.026 . . . . 6.9699999999999998 110.942 167.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -68.98 137.43 53.72 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.286 1.434 . . . . 4.6799999999999997 112.991 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.8 m -69.35 -32.79 72.08 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.954 1.701 . . . . 2.8599999999999999 112.327 175.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.85 -50.53 57.82 Favored Glycine 0 N--CA 1.47 0.922 0 CA-C-N 119.568 1.076 . . . . 1.76 111.963 178.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -59.4 -29.29 67.63 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.971 -0.723 . . . . 3.77 112.35 172.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -80.02 -31.85 39.59 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.679 0.992 . . . . 6.9900000000000002 113.679 174.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 mmmt -60.67 -35.88 77.34 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 119.249 -2.157 . . . . 4.5599999999999996 111.872 169.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.88 -29.89 56.73 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 117.25 -1.357 . . . . 1.95 114.076 167.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.65 -41.32 79.53 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 120.514 1.506 . . . . 1.79 113.157 167.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -63.38 -35.31 79.99 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 125.845 1.658 . . . . 3.46 112.606 -177.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -47.82 -43.04 27.64 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.628 1.171 . . . . 4.0099999999999998 112.835 168.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.4 mt -70.12 -38.48 75.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.601 -1.182 . . . . 2.0899999999999999 110.35 -174.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.3 mm -63.89 -42.12 94.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 122.988 0.515 . . . . 2.0099999999999998 111.518 -176.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -72.13 -37.4 69.46 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 123.319 0.648 . . . . 2.5099999999999998 111.583 176.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -67.16 -30.68 70.72 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.183 -0.948 . . . . 4.6799999999999997 112.383 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 28.2 tp -69.14 -24.3 64.07 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 120.895 -1.128 . . . . 4.6399999999999997 112.394 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.51 -25.96 28.7 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.143 1.777 . . . . 4.8899999999999997 113.731 171.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -85.47 -4.43 59.16 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.817 1.414 . . . . 4.1600000000000001 114.817 174.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -127.59 -30.22 2.58 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 114.372 1.249 . . . . 3.9399999999999999 114.372 -171.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -90.97 57.97 3.65 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.943 1.297 . . . . 6.5999999999999996 112.528 -163.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -87.47 84.23 7.18 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.361 1.065 . . . . 5.6799999999999997 111.543 177.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 74.0 -28.6 0.95 Allowed Glycine 0 N--CA 1.476 1.309 0 C-N-CA 125.831 1.681 . . . . 5.0099999999999998 115.863 167.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 -89.14 152.15 21.79 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 126.229 1.812 . . . . 8.7799999999999994 110.329 169.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.4 mp -127.39 138.48 54.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 106.0 -1.852 . . . . 5.3600000000000003 106.0 170.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.0 152.28 20.38 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.579 0.228 . . . . 2.9100000000000001 111.219 173.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -61.62 -48.67 79.84 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 123.408 1.575 . . . . 3.3700000000000001 109.558 167.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.2 -16.5 64.34 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.95 2.9 . . . . 2.8999999999999999 114.308 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.2 tt0 -59.85 -55.04 39.07 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.444 1.498 . . . . 2.9199999999999999 110.256 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -59.49 -38.3 80.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.367 -0.833 . . . . 3.5899999999999999 111.813 177.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 22.2 t-105 -61.96 -49.98 73.94 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 118.818 -0.611 . . . . 0.59999999999999998 111.084 177.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.3 t -71.63 -15.6 62.25 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 113.924 1.083 . . . . 2.7799999999999998 113.924 176.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.3 mt -74.34 -47.53 33.81 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 120.009 1.277 . . . . 1.9099999999999999 111.861 164.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.8 mm -51.31 -40.66 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-N 120.895 1.679 . . . . 1.99 113.77 -174.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.11 -22.62 60.81 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 118.767 0.712 . . . . 0.71999999999999997 113.641 177.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.41 -16.76 80.43 Favored Glycine 0 CA--C 1.534 1.234 0 O-C-N 121.181 -1.187 . . . . 0.68999999999999995 113.882 175.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.8 mp -95.62 -46.36 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 CA-C-N 118.382 1.091 . . . . 2.0099999999999998 110.871 161.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 28.8 m -84.78 83.55 8.0 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 126.128 1.771 . . . . 1.8700000000000001 108.54 -171.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -167.45 -64.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.961 0 C-N-CA 125.428 1.49 . . . . 1.3600000000000001 111.932 -171.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -58.19 -53.17 4.5 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.2 2.6 . . . . 1.52 111.293 165.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.9 pt -61.22 -24.61 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 113.115 0.783 . . . . 2.9300000000000002 113.115 174.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.39 -53.42 52.64 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.412 1.006 . . . . 1.8799999999999999 112.389 -175.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -61.08 -34.17 74.51 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.621 -1.299 . . . . 3.6800000000000002 112.662 175.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.6 tt -66.24 -44.47 83.67 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.211 1.004 . . . . 2.2000000000000002 111.23 -178.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 56.0 mt -49.32 -59.91 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.63 0.772 . . . . 2.21 109.734 166.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -61.95 -28.52 69.6 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.014 -1.054 . . . . 1.9399999999999999 113.409 -173.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.348 3.2 pt-20 -87.21 -11.43 49.84 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 121.277 -0.89 . . . . 3.1400000000000001 113.095 175.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.507 ' C ' ' H ' ' A' ' 99' ' ' GLN . 0.6 OUTLIER -81.86 -40.73 22.02 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.433 1.893 . . . . 2.1899999999999999 113.935 169.553 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -66.43 7.66 0.31 Allowed 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 123.501 1.62 . . . . 2.4500000000000002 112.889 174.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.507 ' H ' ' C ' ' A' ' 97' ' ' GLN . 16.0 mm-40 -130.8 -64.94 0.81 Allowed 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.891 2.076 . . . . 2.1499999999999999 109.704 -175.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 49.05 12.06 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 130.419 3.488 . . . . 5.0899999999999999 116.162 171.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.0 t 179.75 31.72 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 128.116 2.566 . . . . 6.5999999999999996 109.764 -168.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 23.3 p -95.02 24.72 4.64 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 119.82 -1.8 . . . . 8.5700000000000003 112.255 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 41.3 m . . . . . 0 N--CA 1.479 0.989 1 C-N-CA 133.504 4.722 . . . . 10.19 107.905 -162.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 23.1 m . . . . . 0 CA--C 1.503 -0.83 0 N-CA-C 108.626 -0.879 . . . . 10.6 108.626 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -134.49 -16.13 2.1 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 124.824 1.327 . . . . 6.7000000000000002 113.364 -134.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 93.6 m 66.42 19.61 10.94 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.769 2.028 . . . . 3.6499999999999999 115.798 162.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 5.9 m-30 -46.93 124.34 6.18 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.562 1.145 . . . . 3.7999999999999998 112.237 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 5.4 p -65.52 166.78 9.85 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 118.436 0.562 . . . . 1.8999999999999999 111.878 -176.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -62.19 -37.9 87.07 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.379 -0.826 . . . . 2.9300000000000002 111.957 173.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.38 -51.49 65.66 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.278 0.631 . . . . 2.3900000000000001 109.724 173.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.79 -54.8 10.29 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.26 -0.274 . . . . 2.4700000000000002 110.26 -169.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . 0.257 0.7 OUTLIER -60.49 -23.41 64.48 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 122.057 -0.402 . . . . 5.29 111.621 177.06 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.24 -25.03 61.47 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 119.34 -2.1 . . . . 2.4100000000000001 114.324 169.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 34.3 t -61.58 -35.38 66.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 121.297 1.862 . . . . 2.3399999999999999 110.879 170.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 71.2 mt -54.52 -55.8 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 121.383 -0.823 . . . . 2.1899999999999999 110.713 165.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 78.9 t -56.26 -41.45 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.951 1.3 . . . . 2.1200000000000001 112.474 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.71 -38.77 87.41 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.369 0.668 . . . . 2.1400000000000001 112.287 176.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 71.7 t -71.39 -39.32 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.709 0.804 . . . . 2.02 111.494 177.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -51.04 -55.89 15.24 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.726 1.21 . . . . 2.71 109.605 171.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -50.52 -40.77 52.43 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.9 1.444 . . . . 3.3500000000000001 114.9 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -66.44 -57.53 7.18 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.705 0.684 . . . . 3.73 111.79 178.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -66.05 -20.52 66.2 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.617 0.969 . . . . 3.0299999999999998 113.617 -171.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -45.88 -32.68 2.77 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 120.216 1.371 . . . . 3.9900000000000002 113.526 170.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -93.89 8.37 41.51 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.242 1.417 . . . . 3.2999999999999998 113.916 -174.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.0 m -135.74 175.56 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.742 1.617 . . . . 3.2799999999999998 110.033 169.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.48 -32.65 64.42 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 120.823 -1.173 . . . . 3.73 113.93 -175.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 171.08 -55.41 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 129.846 3.258 . . . . 5.3499999999999996 109.945 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -118.73 3.76 11.63 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.728 1.211 . . . . 7.7800000000000002 113.855 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' SER . . . . . 0.401 ' C ' ' H ' ' B' ' 132' ' ' VAL . 1.4 m -78.29 41.77 0.39 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 117.047 2.24 . . . . 4.9199999999999999 117.047 -152.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.05 10.02 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 129.065 2.946 . . . . 9.6799999999999997 115.806 176.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . 0.401 ' H ' ' C ' ' B' ' 130' ' ' SER . 15.0 t -143.64 137.98 25.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 128.111 2.565 . . . . 5.2400000000000002 106.916 -179.125 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt 75.29 -44.04 0.52 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.931 2.492 . . . . 9.1899999999999995 114.166 -178.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -68.14 -64.18 0.91 Allowed 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.674 0.67 . . . . 7.6799999999999997 111.842 -167.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.27 108.6 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.15 1.78 . . . . 7.3399999999999999 112.954 177.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 22.0 pt -59.9 145.41 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 108.441 -0.948 . . . . 3.5800000000000001 108.441 169.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 30.3 t -73.18 138.14 45.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 117.637 -1.625 . . . . 3.5699999999999998 111.209 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mtpt -63.94 -13.93 49.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.641 0.776 . . . . 4.2199999999999998 112.934 167.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 97.2 p -77.38 -27.73 52.6 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.02 -1.05 . . . . 3.0699999999999998 113.233 163.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.3 m -78.55 -39.56 37.44 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.937 1.244 . . . . 1.51 113.118 -173.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -55.51 -55.9 26.47 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 120.366 1.439 . . . . 3.6899999999999999 111.727 -177.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -55.49 -19.45 9.71 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.402 1.481 . . . . 3.0099999999999998 113.805 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -100.36 -46.23 5.32 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 125.332 1.453 . . . . 3.25 112.496 -174.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -51.15 -41.95 60.47 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.944 1.297 . . . . 1.74 110.646 165.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.8 mt -59.82 -17.25 34.62 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 116.098 1.888 . . . . 1.74 116.098 168.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -114.77 -5.0 12.65 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 120.679 1.581 . . . . 2.6699999999999999 113.955 174.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -107.18 -36.02 6.67 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.605 1.562 . . . . 4.1299999999999999 113.23 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -87.92 -72.65 0.52 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.307 1.443 . . . . 4.3499999999999996 108.617 163.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.58 22.65 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.794 2.038 . . . . 2.5800000000000001 114.918 -171.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -66.11 -25.67 67.1 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.376 2.67 . . . . 1.54 116.622 -166.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . 0.521 ' H ' ' CD2' ' B' ' 151' ' ' HIS . 0.6 OUTLIER -73.17 -55.87 5.87 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.936 1.244 . . . . 2.0 109.805 -177.639 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 27.2 tpp -47.77 -49.79 27.5 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.704 2.002 . . . . 3.1800000000000002 112.891 163.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 1.4 mt -99.7 35.37 2.02 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.667 1.187 . . . . 5.4000000000000004 113.147 -174.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 13.5 p -65.51 -36.77 84.82 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.785 -1.098 . . . . 6.7000000000000002 111.183 167.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -71.89 135.7 46.64 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.102 1.361 . . . . 4.96 113.062 174.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 96.9 m -67.07 -33.15 74.88 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.877 1.671 . . . . 3.2200000000000002 112.533 174.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -64.29 -52.56 42.84 Favored Glycine 0 N--CA 1.471 0.992 0 CA-C-N 119.98 1.264 . . . . 1.8999999999999999 112.152 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -58.4 -29.87 66.39 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.013 0.925 . . . . 3.8500000000000001 112.446 173.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 57.7 mtm-85 -78.64 -31.52 46.9 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.779 1.4 . . . . 7.0999999999999996 114.779 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -60.93 -37.09 81.11 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 119.879 -1.763 . . . . 4.6799999999999997 111.68 168.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -53.22 -32.14 46.75 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-O 117.581 -1.2 . . . . 1.8799999999999999 113.795 168.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.6 -44.42 74.36 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.869 1.268 . . . . 2.0699999999999998 113.152 169.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -62.96 -36.32 83.08 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.754 2.022 . . . . 3.5899999999999999 112.842 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -52.53 -36.21 55.05 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.916 -1.115 . . . . 3.8100000000000001 112.336 171.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 9.8 mt -73.36 -36.14 66.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.949 -0.569 . . . . 2.1400000000000001 111.247 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.0 mm -58.86 -44.8 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 123.797 0.839 . . . . 2.04 111.54 177.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -76.04 -33.11 59.62 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 123.168 0.587 . . . . 2.1699999999999999 112.014 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -67.29 -32.4 73.36 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.341 -0.85 . . . . 4.5499999999999998 112.364 170.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 22.2 tp -67.73 -23.85 65.31 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.014 -1.054 . . . . 4.4100000000000001 112.123 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.2 -32.78 49.77 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.537 1.535 . . . . 5.0300000000000002 113.843 170.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.09 -7.4 58.86 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.645 1.35 . . . . 4.2199999999999998 114.645 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -127.31 -26.44 3.07 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 115.091 1.515 . . . . 3.7000000000000002 115.091 -168.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 32.7 t60 -100.21 66.75 1.33 Allowed 'General case' 0 CA--C 1.548 0.889 0 O-C-N 120.885 -1.135 . . . . 6.1799999999999997 112.817 -163.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -81.41 69.58 8.08 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.847 1.308 . . . . 5.8499999999999996 111.898 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.96 -24.54 1.04 Allowed Glycine 0 CA--C 1.536 1.399 0 C-N-CA 125.858 1.694 . . . . 4.3399999999999999 115.694 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 16.9 mmt85 -79.97 142.71 34.8 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.752 1.221 . . . . 8.5899999999999999 110.494 169.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 3.4 mp -111.27 145.53 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 N-CA-C 106.547 -1.649 . . . . 5.6299999999999999 106.547 165.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.79 150.74 25.28 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 122.907 0.483 . . . . 2.8999999999999999 109.816 168.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -59.61 -49.6 77.13 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 123.569 1.652 . . . . 3.3799999999999999 109.559 169.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.44 -16.91 26.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 129.821 3.248 . . . . 3.1600000000000001 114.687 176.368 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -59.36 -57.51 12.67 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.243 1.417 . . . . 3.0299999999999998 110.649 175.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -57.62 -40.2 78.61 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.444 -0.785 . . . . 3.6200000000000001 112.331 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.9 t-105 -60.85 -51.47 69.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.229 -0.891 . . . . 0.72999999999999998 111.351 174.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 7.1 t -69.43 -18.58 63.75 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.982 1.264 . . . . 2.6899999999999999 113.701 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 97.3 mt -68.87 -51.27 42.12 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 120.092 1.314 . . . . 1.72 110.978 164.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 30.1 mm -52.0 -37.29 21.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 CA-C-N 121.035 1.743 . . . . 1.8899999999999999 114.336 -173.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.33 -22.07 65.02 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 119.309 0.959 . . . . 0.67000000000000004 114.238 175.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.79 -18.22 78.72 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 118.63 1.215 . . . . 0.69999999999999996 113.527 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.2 mp -101.48 -41.54 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 118.385 1.093 . . . . 2.0899999999999999 110.681 166.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 24.7 m -82.11 84.93 6.87 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.272 1.429 . . . . 1.97 108.84 -177.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -171.88 -66.17 0.04 OUTLIER Glycine 0 CA--C 1.528 0.896 0 CA-C-O 118.258 -1.301 . . . . 1.54 112.194 -170.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -58.36 -54.19 3.3 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.066 2.511 . . . . 1.55 110.95 167.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 35.5 pt -64.95 -21.04 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 113.387 0.884 . . . . 2.8700000000000001 113.387 175.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.01 -55.91 24.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.493 1.042 . . . . 1.8400000000000001 112.643 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -59.56 -34.21 72.4 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.518 -1.364 . . . . 3.79 112.558 175.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.3 tt -66.14 -43.58 86.66 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 124.126 0.97 . . . . 2.29 110.725 -177.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 48.4 mt -51.69 -58.26 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.97 0.908 . . . . 2.3199999999999998 109.631 167.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . 0.437 ' CD2' ' HE2' ' A' ' 25' ' ' LYS . 80.7 t60 -70.79 -5.57 31.22 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 114.668 1.358 . . . . 1.8899999999999999 114.668 -173.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.339 3.5 pt-20 -104.01 -15.06 15.71 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.954 1.302 . . . . 3.0600000000000001 112.842 167.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . 0.522 ' C ' ' H ' ' B' ' 202' ' ' GLN . 0.2 OUTLIER -80.08 -39.55 29.43 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 126.434 1.894 . . . . 2.1699999999999999 114.674 169.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.06 10.34 0.11 Allowed 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 121.411 1.914 . . . . 2.5099999999999998 112.977 171.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.522 ' H ' ' C ' ' B' ' 200' ' ' GLN . 2.3 mm-40 -126.29 -76.51 0.58 Allowed 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 127.241 2.216 . . . . 2.1800000000000002 109.149 -178.022 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.17 17.07 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 130.333 3.453 . . . . 4.79 116.72 169.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 41.9 t -173.43 26.58 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 127.142 2.177 . . . . 6.4000000000000004 109.937 -168.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 94.2 p -114.45 10.34 16.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.126 1.37 . . . . 8.5500000000000007 112.783 -177.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 49.9 m . . . . . 0 C--O 1.247 0.938 1 C-N-CA 132.667 4.387 . . . . 9.9100000000000001 107.198 -167.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 CA--C 1.504 -0.799 0 N-CA-C 109.165 -0.68 . . . . 10.57 109.165 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -131.29 -14.62 3.34 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 118.914 -1.114 . . . . 6.71 113.525 -132.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.9 t 69.25 3.39 4.09 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.836 2.054 . . . . 5.3300000000000001 115.88 164.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -35.25 106.71 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 126.198 1.799 . . . . 3.2400000000000002 113.94 -174.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 81.8 p -68.2 153.88 42.84 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.871 0.469 . . . . 2.0600000000000001 110.661 -175.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -52.58 -38.46 60.05 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.776 0.83 . . . . 2.5699999999999998 111.355 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -42.77 99.77 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.362 1.865 . . . . 1.9199999999999999 111.672 177.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -50.69 13.61 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 118.69 0.677 . . . . 2.7999999999999998 111.607 -177.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -49.68 -34.82 19.59 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.237 1.015 . . . . 6.8899999999999997 111.17 165.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.38 -40.63 77.31 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 116.821 -1.561 . . . . 1.78 114.229 171.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.4 t -53.76 -47.32 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 CA-C-N 121.438 1.926 . . . . 2.25 110.077 169.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.2 mt -52.46 -51.53 32.84 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 CA-C-N 118.556 0.617 . . . . 1.79 111.505 172.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 16.9 t -60.21 -47.67 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.421 1.088 . . . . 1.8600000000000001 112.195 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 mp -57.92 -45.85 85.9 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.417 1.087 . . . . 1.8899999999999999 111.022 175.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.9 t -59.22 -54.13 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 126.072 1.749 . . . . 1.6599999999999999 111.792 -178.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 tp10 -71.22 -32.95 69.43 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.11 1.323 . . . . 5.04 112.234 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -67.72 -17.64 64.63 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 120.214 1.37 . . . . 2.5899999999999999 113.432 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -80.26 -56.68 4.04 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.321 -0.862 . . . . 3.2000000000000002 111.65 161.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -59.67 -34.28 72.65 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.246 -0.883 . . . . 3.2200000000000002 113.059 -169.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -47.6 -39.34 16.57 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.672 1.578 . . . . 3.8599999999999999 113.949 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.43 ' CE2' ' HG3' ' A' ' 41' ' ' MET . 90.9 m-85 -82.61 -19.69 37.86 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 120.747 -1.221 . . . . 3.6600000000000001 113.562 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 1.5 t -77.38 -38.64 26.92 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.283 1.833 . . . . 3.9700000000000002 110.97 168.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.4 p 146.57 -110.67 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.891 1 C-N-CA 132.29 4.236 . . . . 4.8200000000000003 111.648 171.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.42 -10.51 0.36 Allowed 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 116.266 1.951 . . . . 8.9000000000000004 116.266 -170.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -151.92 -6.94 0.23 Allowed 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 116.208 1.929 . . . . 8.2200000000000006 116.208 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.5 t -163.38 143.17 8.65 Favored 'General case' 0 N--CA 1.477 0.917 0 O-C-N 118.936 -2.353 . . . . 5.3099999999999996 112.211 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 91.7 mt -49.58 -31.44 10.56 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 127.937 2.495 . . . . 8.9100000000000001 114.002 172.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.9 t -133.94 61.67 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-O 123.935 1.826 . . . . 4.4699999999999998 110.041 -175.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.8 ttpp -111.71 -6.19 14.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.414 2.286 . . . . 9.1699999999999999 113.315 168.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -170.08 -35.01 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 128.024 2.53 . . . . 8.0 110.783 -168.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 71.89 84.98 0.13 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.062 1.345 . . . . 7.9500000000000002 111.529 163.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.0 tt -50.94 142.1 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.647 0.779 . . . . 4.9000000000000004 110.539 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.9 m -113.61 138.27 50.41 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.12 -1.437 . . . . 3.75 107.12 168.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.492 ' HE2' ' OE2' ' A' ' 78' ' ' GLU . 15.2 mttp -76.64 -15.96 59.68 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.133 0.973 . . . . 4.4100000000000001 110.633 -154.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.3 p -41.49 -27.86 0.11 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.238 1.815 . . . . 2.71 114.722 154.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.9 m -74.33 -44.27 53.14 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.19 0.996 . . . . 2.7999999999999998 112.64 171.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -52.95 -50.47 63.97 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.152 1.381 . . . . 3.04 112.104 -172.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -54.35 -31.53 54.76 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.878 1.271 . . . . 4.4500000000000002 113.397 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -95.56 -36.67 11.18 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 112.78 0.659 . . . . 4.1100000000000003 112.78 -174.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' MET . . . . . 0.43 ' HG3' ' CE2' ' A' ' 22' ' ' TYR . 11.8 tmm? -48.57 -47.77 39.36 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.487 0.715 . . . . 2.54 110.179 159.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.1 mt -54.48 -51.49 64.89 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.523 0.729 . . . . 1.8600000000000001 112.685 173.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.41 -6.49 59.39 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.535 1.68 . . . . 3.73 115.535 -174.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.93 -37.33 9.44 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.63 1.172 . . . . 3.0499999999999998 113.715 167.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -107.1 -21.85 12.84 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.006 1.322 . . . . 2.9300000000000002 114.537 -167.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 64.3 mt -111.01 44.49 1.28 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.846 1.258 . . . . 3.48 109.843 162.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.6 p30 -66.76 -2.78 5.43 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 115.865 1.802 . . . . 1.5800000000000001 115.865 -169.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -100.34 -48.77 4.47 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.648 1.979 . . . . 2.6000000000000001 111.977 178.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 45.4 tpp -72.17 33.03 0.06 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.801 2.04 . . . . 2.8700000000000001 112.816 175.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 tp -89.1 -36.05 15.95 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 127.014 2.126 . . . . 4.6299999999999999 113.129 -157.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.96 28.13 17.09 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.733 0.813 . . . . 5.8799999999999999 112.094 -175.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.5 t70 58.61 -77.53 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 129.043 2.937 . . . . 5.2300000000000004 112.617 -170.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 50.9 m -132.26 -17.28 2.68 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 126.827 2.051 . . . . 3.2000000000000002 111.334 -173.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -69.84 -65.37 2.58 Favored Glycine 0 N--CA 1.473 1.129 0 CA-C-N 120.566 1.53 . . . . 1.8600000000000001 112.983 -170.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -59.7 -24.09 63.67 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.652 0.781 . . . . 4.4699999999999998 112.83 172.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -79.89 -46.04 17.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.675 1.19 . . . . 6.0199999999999996 113.736 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -58.28 -37.1 74.34 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.039 -1.663 . . . . 4.3099999999999996 111.26 167.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.26 -46.17 79.78 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 117.45 -1.262 . . . . 2.2999999999999998 112.0 168.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.34 -48.76 65.3 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.244 1.018 . . . . 1.8100000000000001 112.386 170.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.37 -28.53 69.76 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 124.458 1.103 . . . . 2.5899999999999999 113.319 -178.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -59.24 -38.22 79.47 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 120.446 -1.409 . . . . 4.3600000000000003 112.196 173.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 mt -66.05 -35.35 80.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.308 -0.86 . . . . 2.0299999999999998 110.953 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 20.0 mm -67.1 -50.11 66.94 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.253 0 C-N-CA 123.938 0.895 . . . . 2.0 110.973 -177.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -67.41 -24.91 65.71 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.234 1.014 . . . . 4.3600000000000003 112.363 -178.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -67.71 -49.61 61.8 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 124.328 1.051 . . . . 3.9399999999999999 113.795 164.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -97.73 -34.0 11.08 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 120.461 -1.4 . . . . 3.46 114.674 -163.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -65.39 -14.43 60.86 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 119.888 -1.758 . . . . 4.5800000000000001 112.861 169.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.25 -16.65 52.03 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.533 1.308 . . . . 4.8300000000000001 114.533 167.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -128.44 -4.04 5.44 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.726 1.75 . . . . 3.9199999999999999 115.726 -167.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -137.54 118.94 14.72 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 120.376 -1.453 . . . . 5.2300000000000004 109.854 172.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -94.24 -108.03 0.13 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.485 1.514 . . . . 4.04 113.33 -163.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -89.03 15.44 57.98 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 128.09 2.757 . . . . 3.9300000000000002 113.342 176.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.4 mmt-85 -126.38 147.57 49.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.816 1.646 . . . . 5.8099999999999996 109.311 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.0 mm -142.8 141.35 27.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 125.337 1.455 . . . . 3.6099999999999999 108.453 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.4 t -94.4 156.38 16.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.393 0.542 . . . . 2.6000000000000001 112.059 169.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -58.98 -40.39 84.7 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.796 0.808 . . . . 3.1000000000000001 111.188 161.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -73.38 -16.6 61.34 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.385 1.074 . . . . 4.0899999999999999 112.686 -172.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.492 ' OE2' ' HE2' ' A' ' 35' ' ' LYS . 25.6 mt-10 -60.75 -52.44 65.08 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.893 0.77 . . . . 3.0899999999999999 111.374 175.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -54.13 -42.84 69.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 121.228 -0.92 . . . . 2.8999999999999999 111.092 174.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -65.33 -52.34 54.58 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 118.292 -0.861 . . . . 0.67000000000000004 112.475 -177.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.7 t -68.65 -26.82 65.52 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.572 1.078 . . . . 2.77 112.742 177.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.0 mt -68.57 -38.71 80.93 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 119.986 1.266 . . . . 1.6599999999999999 111.357 173.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.4 mm -58.42 -38.88 72.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 120.469 1.486 . . . . 2.1899999999999999 112.718 -178.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.42 -24.64 52.85 Favored Glycine 0 CA--C 1.54 1.594 0 CA-C-N 119.288 0.949 . . . . 0.96999999999999997 113.405 174.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.68 -8.81 57.62 Favored Glycine 0 CA--C 1.534 1.266 0 O-C-N 121.131 -1.217 . . . . 0.81999999999999995 114.12 173.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.2 mp -124.44 -41.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.878 1.339 . . . . 2.1499999999999999 112.154 172.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 79.5 m -81.74 94.05 6.93 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.052 1.741 . . . . 1.99 108.361 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -177.37 -68.95 0.06 OUTLIER Glycine 0 CA--C 1.527 0.829 0 CA-C-O 118.606 -1.108 . . . . 1.4299999999999999 112.253 -172.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.76 -43.73 30.07 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.71 2.273 . . . . 1.21 111.378 169.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 12.2 pt -75.64 -19.56 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 N-CA-C 113.569 0.952 . . . . 2.0299999999999998 113.569 172.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.08 -54.67 43.2 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.717 1.144 . . . . 2.2599999999999998 111.973 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.435 ' HZ3' ' CD ' ' A' ' 96' ' ' GLU . 0.0 OUTLIER -56.49 -42.68 78.7 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 118.23 -0.89 . . . . 3.7000000000000002 112.673 169.43 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.9 tt -59.78 -42.15 92.69 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 118.891 0.769 . . . . 2.2599999999999998 112.126 -176.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.2 mt -55.79 -56.9 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 124.109 0.964 . . . . 2.21 109.504 173.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 60.0 t60 -59.64 -36.29 76.08 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.82 1.248 . . . . 2.3199999999999998 112.789 -177.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.435 ' CD ' ' HZ3' ' A' ' 92' ' ' LYS . 2.8 pt-20 -88.47 -9.19 53.32 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.07 0.948 . . . . 3.1499999999999999 113.282 179.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.9 -48.47 7.77 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 124.453 1.101 . . . . 2.9300000000000002 113.802 169.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -57.52 -37.59 73.27 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.128 0.966 . . . . 2.5299999999999998 111.99 -171.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -68.56 -53.05 25.38 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.471 1.108 . . . . 2.54 111.553 174.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -59.71 -0.87 0.21 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 127.462 2.305 . . . . 7.5300000000000002 114.098 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.1 m -144.73 30.2 1.21 Allowed 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.26 -1.525 . . . . 6.6600000000000001 112.487 163.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 39.1 m -75.13 -6.3 48.83 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.933 -1.104 . . . . 10.02 113.316 168.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 C--O 1.247 0.932 0 C-N-CA 129.582 3.153 . . . . 11.609999999999999 109.313 -174.565 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 24.1 m . . . . . 0 CA--C 1.504 -0.816 0 N-CA-C 108.982 -0.748 . . . . 10.279999999999999 108.982 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -135.8 -10.1 2.08 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.821 1.045 . . . . 6.3600000000000003 113.821 -132.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 8.6 t 78.45 -7.7 1.76 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 128.139 2.575 . . . . 6.1799999999999997 114.799 169.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -35.25 106.4 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 126.881 2.072 . . . . 3.3599999999999999 113.111 -175.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 82.2 p -74.08 157.47 36.01 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 122.831 0.453 . . . . 2.3799999999999999 109.797 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -63.6 -23.34 67.34 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.656 -0.653 . . . . 2.6499999999999999 111.962 176.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.4 -41.11 98.41 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.369 0.668 . . . . 1.8 110.053 170.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.76 -51.02 12.16 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.759 0.651 . . . . 3.0299999999999998 112.759 -177.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -34.31 -50.26 0.41 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.774 1.23 . . . . 4.9100000000000001 111.899 159.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.04 -41.85 85.84 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 116.488 -1.72 . . . . 2.0099999999999998 113.959 178.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 15.6 t -53.83 -47.37 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-N 122.138 2.245 . . . . 2.25 110.788 168.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 16.6 mt -55.01 -49.19 73.62 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 119.454 1.025 . . . . 1.8600000000000001 111.224 173.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 23.2 t -65.62 -42.14 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.958 1.303 . . . . 1.8799999999999999 112.389 -176.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.6 mp -60.55 -42.44 96.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.615 1.166 . . . . 1.9399999999999999 111.153 172.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 18.0 t -65.06 -54.13 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.113 1.365 . . . . 1.71 112.807 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 34.7 tp10 -69.69 -34.35 73.8 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 121.016 1.735 . . . . 4.75 111.874 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -68.73 -19.34 64.34 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.885 1.22 . . . . 2.5800000000000001 113.481 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -72.65 -65.97 0.72 Allowed 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.452 -0.78 . . . . 3.3199999999999998 110.985 158.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -56.35 -34.07 66.27 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 117.802 -1.094 . . . . 3.29 113.777 -167.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 13.5 ptmt -46.78 -38.06 9.54 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 121.392 1.905 . . . . 3.6800000000000002 114.034 175.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . 0.517 ' CE2' ' HG3' ' B' ' 144' ' ' MET . 91.3 m-85 -82.89 -10.01 59.03 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 120.359 -1.463 . . . . 3.54 114.145 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 2.3 t -101.73 -30.87 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 127.057 2.143 . . . . 4.2000000000000002 111.459 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 79.4 p 147.02 -110.5 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.873 1 C-N-CA 132.327 4.251 . . . . 4.7599999999999998 111.913 163.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.87 -12.92 0.19 Allowed 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 116.057 1.873 . . . . 8.9100000000000001 116.057 -168.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -151.65 -4.61 0.27 Allowed 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 116.157 1.91 . . . . 8.2300000000000004 116.157 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 25.1 t -162.7 148.97 12.62 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 118.996 -2.315 . . . . 5.4299999999999997 112.464 177.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.53 -26.62 68.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.932 1.693 . . . . 8.9800000000000004 114.113 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 4.5 t -132.2 61.53 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 CA-C-O 123.749 1.738 . . . . 4.4900000000000002 109.944 -177.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 4.6 ttpp -112.49 -5.2 14.07 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.947 2.099 . . . . 9.0999999999999996 113.283 171.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -172.54 -35.78 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 127.58 2.352 . . . . 8.1600000000000001 110.198 -165.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.48 83.84 0.14 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.978 1.311 . . . . 7.9100000000000001 110.715 164.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 8.2 tt -51.45 144.77 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 123.316 0.646 . . . . 4.6399999999999997 109.952 173.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 58.6 m -117.84 144.31 45.51 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 121.011 -1.055 . . . . 3.8199999999999998 108.26 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . 0.454 ' HE2' ' OE1' ' B' ' 181' ' ' GLU . 17.2 mttp -73.1 -16.71 61.46 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.331 -0.856 . . . . 4.1600000000000001 112.183 -154.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.1 p -48.85 -29.5 4.71 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.652 1.981 . . . . 2.4399999999999999 114.048 161.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 46.7 m -68.59 -46.9 68.11 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.745 1.157 . . . . 1.4099999999999999 112.577 171.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -55.93 -53.85 51.86 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 120.196 1.362 . . . . 3.1800000000000002 112.245 -170.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -50.17 -29.56 9.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.285 1.034 . . . . 4.3600000000000003 113.19 175.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -94.89 -36.2 11.72 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 114.505 1.298 . . . . 3.6000000000000001 114.505 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' MET . . . . . 0.517 ' HG3' ' CE2' ' B' ' 125' ' ' TYR . 4.6 tmm? -53.37 -44.77 68.84 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 118.942 -0.551 . . . . 1.6399999999999999 110.43 163.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 43.1 mt -53.21 -49.11 67.44 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.92 0.782 . . . . 2.0600000000000001 112.155 170.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.0 -8.13 59.65 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.012 1.486 . . . . 3.4300000000000002 115.012 -172.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.37 -40.64 7.0 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.852 1.261 . . . . 2.6299999999999999 113.859 167.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -101.35 -28.74 12.43 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.382 1.473 . . . . 2.7599999999999998 113.209 -165.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 46.3 mt -108.41 40.5 1.76 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.323 1.449 . . . . 3.73 111.022 166.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -62.0 -20.17 63.61 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.597 1.703 . . . . 1.3500000000000001 115.597 -169.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . 0.545 ' H ' ' CD2' ' B' ' 151' ' ' HIS . 0.0 OUTLIER -80.83 -59.94 2.49 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.165 1.386 . . . . 2.3500000000000001 111.916 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 42.7 tpp -58.64 -15.63 12.5 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 126.055 1.742 . . . . 2.8700000000000001 115.524 173.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 50.9 tp -51.08 -29.87 14.3 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.634 2.774 . . . . 4.2400000000000002 115.779 -171.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 21.7 m 60.08 29.67 19.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.622 1.169 . . . . 5.4900000000000002 112.823 -174.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 12.0 t70 42.64 -97.53 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.352 1.861 . . . . 6.1799999999999997 111.71 -163.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 30.4 m -93.89 -25.3 17.37 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.106 1.362 . . . . 3.3799999999999999 112.164 -168.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -67.13 -68.44 1.66 Allowed Glycine 0 N--CA 1.477 1.383 0 CA-C-N 120.712 1.596 . . . . 1.95 113.305 -167.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -60.53 -21.87 62.97 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.094 0.958 . . . . 4.3700000000000001 112.759 173.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -82.41 -37.83 24.94 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.326 1.45 . . . . 5.8700000000000001 114.509 -178.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 18.2 mmmt -63.56 -37.54 87.71 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 119.981 -1.699 . . . . 5.4100000000000001 111.387 165.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -55.03 -43.54 73.81 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-O 117.192 -1.385 . . . . 2.3999999999999999 111.646 168.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -52.53 -52.57 54.05 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.46 1.104 . . . . 1.95 111.926 170.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -56.78 -37.18 70.74 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.865 1.266 . . . . 2.5800000000000001 113.212 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 34.7 mtmt -57.79 -38.36 75.37 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 121.167 -0.958 . . . . 4.46 112.753 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 10.2 mt -66.27 -42.42 88.47 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.037 -0.983 . . . . 2.04 110.619 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 17.3 mm -56.13 -56.09 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.464 1.106 . . . . 1.98 109.925 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -68.01 -27.56 66.67 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.201 0.815 . . . . 2.96 113.201 -175.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.08 -42.98 99.75 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.253 1.021 . . . . 3.6400000000000001 113.472 167.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.46 -26.88 16.29 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.045 -1.034 . . . . 3.9900000000000002 112.605 -169.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.17 -12.26 54.8 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.137 -1.602 . . . . 3.48 113.714 172.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.08 -11.79 60.0 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.942 1.09 . . . . 2.9900000000000002 113.942 164.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -128.02 -15.55 4.76 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.502 1.667 . . . . 2.5899999999999999 115.502 -166.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -143.18 125.81 15.91 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 120.448 1.476 . . . . 5.1600000000000001 110.418 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . 0.475 ' CG ' ' H ' ' B' ' 175' ' ' GLY . 12.2 p-10 -114.6 -108.06 0.37 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 125.358 1.463 . . . . 3.77 112.835 -167.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . 0.475 ' H ' ' CG ' ' B' ' 174' ' ' ASP . . . -77.57 15.18 7.87 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 127.126 2.298 . . . . 3.5800000000000001 114.196 173.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -131.57 150.24 52.22 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.412 1.885 . . . . 6.0599999999999996 110.039 170.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 35.2 mm -143.8 139.61 25.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 126.802 2.041 . . . . 3.6499999999999999 107.622 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 25.2 t -92.33 151.4 20.31 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.133 0.424 . . . . 2.6600000000000001 110.447 167.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -50.14 -41.37 48.78 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.403 0.621 . . . . 3.1000000000000001 111.169 164.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -71.65 -12.89 61.56 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.5 0.926 . . . . 4.2199999999999998 113.5 -173.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . 0.454 ' OE1' ' HE2' ' B' ' 138' ' ' LYS . 14.6 mt-10 -60.13 -51.63 68.77 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.655 1.116 . . . . 2.79 111.385 177.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -56.64 -43.58 80.42 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.134 -0.979 . . . . 3.1499999999999999 111.89 174.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 24.2 t-105 -62.87 -57.38 11.02 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 118.837 -0.602 . . . . 0.67000000000000004 111.875 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.7 t -65.09 -28.71 69.64 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.923 -1.037 . . . . 2.6699999999999999 112.73 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 77.2 mt -71.54 -35.57 70.7 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.854 1.206 . . . . 1.8200000000000001 112.975 173.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 7.0 mm -54.98 -39.2 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 CA-C-N 121.242 1.837 . . . . 1.99 112.292 177.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.07 -28.83 71.19 Favored Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.067 0.841 . . . . 0.72999999999999998 113.317 176.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -67.98 -14.23 65.42 Favored Glycine 0 CA--C 1.533 1.164 0 O-C-N 121.03 -1.277 . . . . 0.81999999999999995 113.461 175.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.7 mp -109.3 -32.52 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 118.465 1.133 . . . . 2.2400000000000002 112.313 166.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 18.6 m -91.88 97.24 10.85 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.379 1.871 . . . . 1.9399999999999999 110.05 -175.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -177.06 -64.77 0.06 OUTLIER Glycine 0 CA--C 1.529 0.938 0 C-N-CA 124.868 1.223 . . . . 1.4299999999999999 111.968 -172.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -62.33 -47.86 8.98 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.627 2.218 . . . . 1.3500000000000001 110.762 167.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 13.5 pt -67.93 -25.15 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 112.966 0.728 . . . . 2.4900000000000002 112.966 172.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.24 -58.95 6.18 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.836 1.198 . . . . 2.0800000000000001 111.939 -178.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . 0.458 ' HZ3' ' CD ' ' B' ' 199' ' ' GLU . 0.0 OUTLIER -57.11 -38.99 74.21 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 118.378 -0.82 . . . . 3.6699999999999999 112.549 173.583 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.1 tt -61.89 -41.97 98.52 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 118.511 -0.757 . . . . 2.3399999999999999 112.019 -177.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 32.8 mt -55.59 -56.17 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 119.478 1.035 . . . . 2.2599999999999998 109.639 173.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -59.46 -36.13 75.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.275 1.03 . . . . 2.4199999999999999 112.555 -176.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . 0.458 ' CD ' ' HZ3' ' B' ' 195' ' ' LYS . 2.8 pt-20 -90.51 -8.94 49.04 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.249 0.833 . . . . 3.3599999999999999 113.249 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -88.16 -49.02 7.28 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.434 1.094 . . . . 3.0 113.792 169.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -58.82 -33.85 70.85 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.05 0.929 . . . . 2.6600000000000001 112.144 -170.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -72.77 -52.82 13.48 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.675 1.19 . . . . 2.6800000000000002 111.388 175.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -60.16 -0.29 0.22 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.212 2.205 . . . . 7.8700000000000001 113.837 177.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 69.7 m -145.13 31.05 1.13 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.394 -1.441 . . . . 6.4100000000000001 112.369 163.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 16.8 m -76.36 -3.67 38.15 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.809 -1.182 . . . . 9.7599999999999998 112.973 168.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 74.6 m . . . . . 0 C--O 1.249 1.043 0 C-N-CA 129.347 3.059 . . . . 11.43 109.641 -175.684 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.5 m . . . . . 0 CA--C 1.502 -0.902 0 N-CA-C 108.773 -0.825 . . . . 11.039999999999999 108.773 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -133.32 -14.93 2.55 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 118.539 -1.264 . . . . 6.9800000000000004 113.889 -134.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 87.5 m 61.97 -82.2 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.235 2.214 . . . . 4.5 113.061 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.411 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 3.6 m-30 59.43 104.77 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.674 2.39 . . . . 3.6499999999999999 110.279 -159.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.3 p -71.82 155.52 40.33 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 119.186 0.903 . . . . 2.0600000000000001 110.703 -176.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -61.29 -24.33 66.33 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 114.276 1.213 . . . . 2.7599999999999998 114.276 -171.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -48.86 79.41 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 119.7 1.137 . . . . 2.1299999999999999 110.643 170.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.24 -46.84 69.39 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.381 1.472 . . . . 2.8900000000000001 112.025 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.4 mmtt -52.17 -42.09 63.14 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.973 -1.08 . . . . 7.1200000000000001 111.495 169.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.42 -39.46 77.87 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.098 -1.43 . . . . 1.8999999999999999 112.064 177.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.2 t -54.6 -40.09 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 121.503 1.956 . . . . 2.3799999999999999 110.458 167.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.1 mt -59.67 -55.67 22.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 CA-C-N 120.07 1.304 . . . . 1.8999999999999999 111.809 170.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.9 t -58.11 -39.28 72.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 125.467 1.507 . . . . 1.8300000000000001 112.976 -177.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -70.48 -41.7 72.37 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.518 1.127 . . . . 1.8700000000000001 112.098 176.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 70.6 t -71.03 -35.88 61.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 123.826 0.85 . . . . 1.76 111.396 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -62.32 -46.29 89.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.115 0.966 . . . . 2.7000000000000002 110.848 168.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -55.11 -31.78 61.5 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.827 1.418 . . . . 2.27 114.827 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -78.24 -62.23 1.75 Allowed 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.645 -0.659 . . . . 3.2599999999999998 111.607 171.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -64.6 -26.57 68.46 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 118.288 -0.863 . . . . 3.1299999999999999 113.094 -169.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.0 -20.05 8.28 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 120.502 1.501 . . . . 3.3199999999999998 114.146 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -90.41 0.22 57.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.142 1.377 . . . . 3.6600000000000001 114.584 176.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.0 m -138.29 170.81 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 125.592 1.557 . . . . 3.48 111.007 178.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.33 -36.72 77.22 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.397 1.258 . . . . 3.6299999999999999 114.397 -177.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt 150.37 -76.64 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 130.921 3.688 . . . . 6.4699999999999998 110.45 -166.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -124.7 -0.35 8.04 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.133 1.531 . . . . 8.5199999999999996 115.133 -171.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.6 m -61.67 -1.3 0.56 Allowed 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 116.634 2.087 . . . . 5.7800000000000002 116.634 -173.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 84.7 mt -50.77 -28.34 9.05 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 127.936 2.494 . . . . 8.4100000000000001 116.051 -156.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.06 -47.18 94.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 119.218 0.917 . . . . 5.9800000000000004 110.745 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 mtpp -87.58 -53.16 4.94 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.17 0.988 . . . . 9.1600000000000001 111.737 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -122.05 127.83 50.68 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.579 0.752 . . . . 8.5 111.581 -164.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.49 172.86 14.83 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.908 1.683 . . . . 7.9900000000000002 111.451 -173.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.5 pt -82.21 173.78 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.979 0.912 . . . . 4.0 111.85 166.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.2 t -77.61 149.39 34.78 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.693 0.759 . . . . 3.77 111.533 168.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -56.1 -23.0 31.38 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 120.607 -1.308 . . . . 3.1699999999999999 111.624 164.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.8 p -80.8 -9.42 59.81 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.009 -1.682 . . . . 2.2999999999999998 115.388 170.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.8 m -83.36 -33.98 25.71 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.042 1.292 . . . . 1.4099999999999999 112.24 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -45.49 -60.25 2.27 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.865 1.266 . . . . 3.4199999999999999 110.934 176.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.7 ptt180 -58.1 -24.25 57.92 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.692 1.597 . . . . 2.96 113.229 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -94.5 -40.39 9.91 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 126.154 1.782 . . . . 3.29 111.842 -172.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 5.7 tmm? -55.06 -40.44 70.32 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 120.298 -1.501 . . . . 1.9299999999999999 111.811 163.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.87 6.06 0.98 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.94 2.496 . . . . 2.8999999999999999 114.972 169.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -115.58 -13.5 11.52 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.207 1.803 . . . . 2.6899999999999999 113.607 165.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.55 -37.57 9.11 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.847 1.425 . . . . 2.6899999999999999 114.847 178.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -82.9 -56.29 3.91 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 118.591 0.632 . . . . 4.5800000000000001 109.77 164.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.95 75.06 4.49 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.482 -0.762 . . . . 2.8900000000000001 109.704 171.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -121.82 -2.92 9.23 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.216 1.807 . . . . 2.1899999999999999 113.965 -174.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -118.11 -28.01 5.96 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.114 -0.991 . . . . 2.1400000000000001 112.027 176.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 36.9 tpp -65.49 -12.91 57.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.608 1.963 . . . . 2.3700000000000001 112.443 163.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.3 pp -151.5 175.39 12.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.555 1.542 . . . . 4.3300000000000001 112.841 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.0 m 156.06 -37.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 130.903 3.681 . . . . 7.46 107.922 -164.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -55.27 132.33 47.59 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.197 0.999 . . . . 4.25 110.505 156.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 50.3 m -80.73 -25.81 37.81 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.221 1.408 . . . . 3.1299999999999999 111.274 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.16 -48.12 87.49 Favored Glycine 0 N--CA 1.472 1.098 0 C-N-CA 124.738 1.161 . . . . 1.8899999999999999 111.82 177.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -46.52 -55.73 7.08 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.918 1.687 . . . . 3.3500000000000001 112.173 166.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -60.59 -29.08 68.98 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.536 -0.727 . . . . 8.0500000000000007 112.669 -177.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 mmmt -59.98 -37.73 80.47 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.613 -1.304 . . . . 5.2300000000000004 113.213 174.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.82 -19.48 62.6 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.4 1.259 . . . . 1.78 114.4 172.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.2 -43.25 19.56 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.669 1.122 . . . . 1.8200000000000001 111.42 164.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -60.96 -43.08 99.23 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 113.375 0.88 . . . . 2.23 113.375 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -56.4 -27.61 56.88 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.076 0.951 . . . . 3.54 112.715 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 24.3 mt -77.01 -35.22 57.26 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 121.809 -0.557 . . . . 1.8300000000000001 111.763 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.6 mm -55.28 -40.81 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.244 1.018 . . . . 2.0 110.89 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -73.42 -35.14 65.78 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.462 0.912 . . . . 3.5899999999999999 113.462 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -60.78 -28.05 68.45 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.782 0.833 . . . . 3.9300000000000002 111.914 170.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.74 -32.32 21.94 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.904 2.082 . . . . 2.96 111.832 174.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -67.46 -22.24 65.5 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.114 1.366 . . . . 3.8100000000000001 113.972 172.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.4 -15.5 49.33 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.408 1.262 . . . . 3.2200000000000002 114.408 169.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -151.37 -31.4 0.16 Allowed 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 118.048 2.61 . . . . 3.96 118.048 -170.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -90.37 100.95 13.69 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 121.427 1.921 . . . . 3.9900000000000002 111.385 -177.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -65.76 -5.23 8.14 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 116.635 2.087 . . . . 3.9300000000000002 116.635 -173.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.34 7.71 8.16 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.629 1.109 . . . . 2.7000000000000002 115.179 -169.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 41.4 mmt-85 -75.28 -179.89 4.73 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.714 1.757 . . . . 5.6500000000000004 109.71 149.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.5 mm -136.34 137.28 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 N-CA-C 106.672 -1.603 . . . . 2.7799999999999998 106.672 166.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.3 m -96.41 146.7 24.54 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.144 0.884 . . . . 2.9900000000000002 110.175 167.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -64.39 -51.34 63.71 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.729 0.641 . . . . 3.8999999999999999 112.729 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -70.55 -20.67 62.78 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.702 1.201 . . . . 4.6799999999999997 112.953 -177.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -63.78 -35.86 82.0 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 121.34 -0.85 . . . . 5.2300000000000004 110.834 173.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -53.85 -52.13 61.39 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.213 -1.555 . . . . 2.7799999999999998 110.749 170.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 -65.29 -45.82 82.88 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.865 0.866 . . . . 0.73999999999999999 111.465 -175.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 99.5 m -57.83 -46.25 85.01 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 127.102 2.161 . . . . 3.4100000000000001 111.287 177.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 85.1 mt -60.94 -26.52 67.56 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 118.196 -0.907 . . . . 1.8600000000000001 113.06 174.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 35.9 mm -61.37 -32.69 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 CA-C-N 121.603 2.001 . . . . 2.2400000000000002 112.445 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.59 -28.07 67.16 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.572 1.082 . . . . 0.75 112.939 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -72.79 -19.98 79.57 Favored Glycine 0 CA--C 1.533 1.192 0 O-C-N 121.373 -1.075 . . . . 0.62 114.301 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.9 mp -97.47 -35.25 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 CA-C-N 118.451 1.125 . . . . 2.0 110.281 166.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.4 m -82.83 56.64 3.49 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.688 1.995 . . . . 1.71 110.666 -175.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -131.98 -71.6 0.1 OUTLIER Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.341 1.924 . . . . 1.3300000000000001 111.497 175.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -63.94 -56.04 0.55 Allowed 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.302 2.668 . . . . 1.8 111.872 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.3 pt -65.31 -27.16 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 112.966 0.728 . . . . 2.7999999999999998 112.966 173.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.32 -35.81 78.35 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.429 1.013 . . . . 2.2999999999999998 113.458 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.4 ptpt -69.25 -32.41 71.6 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.379 -1.451 . . . . 4.25 113.478 166.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.96 -37.43 85.97 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 120.457 1.48 . . . . 2.5099999999999998 112.031 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -47.04 -59.95 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-N 119.785 1.175 . . . . 2.3500000000000001 109.411 162.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.416 ' NE2' ' HE3' ' B' ' 128' ' ' LYS . 30.0 t60 -64.72 -19.05 65.55 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.692 1.367 . . . . 2.3100000000000001 114.692 -175.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -74.6 -47.36 32.82 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.307 -0.871 . . . . 3.1699999999999999 112.372 162.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -69.21 -40.01 78.27 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 117.424 -1.274 . . . . 2.3100000000000001 114.065 -172.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -60.37 -17.21 42.04 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 120.023 1.283 . . . . 2.7400000000000002 112.227 173.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -92.11 -47.53 7.2 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.448 -1.407 . . . . 3.5800000000000001 110.919 172.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -67.99 1.91 2.4 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.335 1.854 . . . . 5.7999999999999998 113.097 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 52.0 m -143.72 35.64 1.28 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.829 1.652 . . . . 7.1399999999999997 111.655 161.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.5 m -71.65 -1.53 14.04 Favored 'General case' 0 N--CA 1.483 1.177 0 O-C-N 120.594 -1.316 . . . . 9.6699999999999999 113.811 168.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 58.5 m . . . . . 0 C--O 1.25 1.121 0 C-N-CA 129.595 3.158 . . . . 11.630000000000001 110.533 -176.185 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 CA--C 1.502 -0.894 0 N-CA-C 108.824 -0.806 . . . . 11.35 108.824 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -135.43 -17.91 1.74 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.656 1.222 . . . . 7.5300000000000002 113.162 -135.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 85.5 m 59.63 -75.35 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 128.003 2.521 . . . . 3.7599999999999998 114.489 172.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 56.54 106.74 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 128.175 2.59 . . . . 4.0499999999999998 111.816 -154.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.36 166.44 14.46 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 119.126 0.876 . . . . 2.1800000000000002 111.124 -177.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.87 -24.04 66.67 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 118.977 0.808 . . . . 2.8999999999999999 113.155 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.37 -43.67 98.27 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.921 1.237 . . . . 2.0099999999999998 110.036 172.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -71.34 -43.83 66.26 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.742 0.817 . . . . 3.1899999999999999 112.004 175.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 44.7 mmtt -53.52 -42.27 67.22 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.798 1.181 . . . . 7.1500000000000004 111.101 170.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.42 -45.41 69.25 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 124.331 1.052 . . . . 1.8500000000000001 111.977 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.33 -38.83 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 120.428 1.467 . . . . 1.95 110.031 170.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 76.9 mt -59.29 -56.1 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-O 117.694 -1.146 . . . . 1.96 111.378 168.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 t -58.21 -35.36 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 126.048 1.739 . . . . 1.8799999999999999 113.46 -177.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.42 -46.96 62.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.503 1.121 . . . . 1.8600000000000001 111.227 174.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 68.0 t -69.13 -34.68 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.976 0.91 . . . . 1.74 111.316 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -67.98 -44.55 76.42 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.39 1.476 . . . . 2.6699999999999999 110.445 170.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -55.63 -34.12 64.62 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.977 1.717 . . . . 2.1800000000000002 113.952 175.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -73.31 -64.93 0.88 Allowed 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.885 -0.51 . . . . 3.25 111.405 170.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -64.93 -28.89 69.83 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.66 0.985 . . . . 3.0600000000000001 113.66 -169.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -19.97 16.56 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 120.856 1.662 . . . . 3.52 113.834 177.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -89.94 -0.23 57.45 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.207 1.403 . . . . 3.25 114.17 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 33.6 m -136.66 172.77 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 125.295 1.438 . . . . 3.3999999999999999 110.763 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.3 m -68.55 -38.19 80.59 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.292 1.219 . . . . 3.5800000000000001 114.292 -178.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . 0.416 ' HE3' ' NE2' ' A' ' 95' ' ' HIS . 8.4 ttmt 150.58 -76.21 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 130.845 3.658 . . . . 6.5599999999999996 110.526 -164.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -127.64 3.17 6.13 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 115.329 1.603 . . . . 9.0 115.329 -173.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 10.9 m -61.81 0.04 0.41 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 116.551 2.056 . . . . 5.7400000000000002 116.551 -175.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 80.6 mt -50.69 -28.17 8.47 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 128.321 2.648 . . . . 8.3699999999999992 116.032 -157.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 24.3 t -62.51 -47.47 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 O-C-N 121.287 -0.883 . . . . 5.7999999999999998 110.888 175.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -87.9 -49.13 7.28 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.229 1.012 . . . . 9.0800000000000001 112.341 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -126.03 129.95 50.2 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.485 0.714 . . . . 8.5800000000000001 111.515 -164.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.36 171.57 11.9 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.098 1.759 . . . . 7.96 111.916 -172.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 23.9 pt -80.21 179.45 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.604 1.162 . . . . 4.0199999999999996 112.583 166.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 42.1 t -83.04 148.92 27.25 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.369 -0.832 . . . . 3.54 111.233 171.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 18.0 ttpt -56.18 -20.3 17.31 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.734 -1.229 . . . . 3.3500000000000001 112.14 163.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 76.0 p -83.04 -8.32 59.56 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 115.674 1.731 . . . . 2.3500000000000001 115.674 169.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 67.4 m -76.71 -42.09 42.75 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.444 1.474 . . . . 1.29 112.692 -176.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -50.86 -54.79 20.89 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.443 1.019 . . . . 3.21 112.88 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -54.38 -26.26 29.21 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.292 1.037 . . . . 3.3199999999999998 113.517 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -95.75 -42.37 8.4 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.231 1.813 . . . . 3.1499999999999999 112.238 -174.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.9 tmm? -53.72 -40.06 65.78 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.852 -1.155 . . . . 1.6899999999999999 111.917 163.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.71 -21.36 54.72 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.688 1.366 . . . . 1.98 114.688 168.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -97.24 -5.37 37.0 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.418 1.487 . . . . 2.6099999999999999 112.386 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.85 -33.12 8.99 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.78 1.4 . . . . 2.3999999999999999 114.78 168.034 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -89.09 -63.87 1.23 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.904 0.881 . . . . 4.0300000000000002 111.521 175.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.35 35.98 0.15 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.045 1.338 . . . . 3.02 112.514 174.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -80.26 3.75 19.88 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.655 2.382 . . . . 1.8999999999999999 114.43 -171.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . 0.411 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 17.3 m-70 -117.05 -26.12 6.95 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 118.826 0.739 . . . . 2.1899999999999999 111.611 173.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 42.5 tpp -68.43 -26.99 65.8 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.21 2.204 . . . . 2.8199999999999998 112.406 165.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 1.8 pp -123.98 167.25 14.4 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.849 1.66 . . . . 4.4299999999999997 111.131 167.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 21.8 m -167.8 -54.58 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.299 1.84 . . . . 6.8200000000000003 107.479 175.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -63.82 143.93 57.46 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.636 0.732 . . . . 4.2599999999999998 109.678 160.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 5.9 m -65.58 -23.72 66.91 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.602 1.161 . . . . 4.4400000000000004 111.08 172.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.36 -28.39 50.26 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.292 1.425 . . . . 2.77 114.793 -178.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -71.25 -61.86 1.61 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 118.133 0.967 . . . . 3.0899999999999999 109.142 168.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.6 ttp-105 -48.56 -21.4 0.57 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.501 1.92 . . . . 5.4500000000000002 116.137 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -45.68 -38.35 6.73 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.635 1.107 . . . . 4.3899999999999997 113.224 164.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -70.94 -18.38 62.64 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 115.286 1.587 . . . . 1.79 115.286 174.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.46 -46.93 12.83 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 120.041 1.291 . . . . 1.97 109.926 165.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -57.32 -41.96 80.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.544 1.538 . . . . 1.98 112.539 -177.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -58.43 -28.33 65.15 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.445 1.276 . . . . 3.8100000000000001 114.445 174.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 52.5 mt -76.98 -35.87 56.86 Favored 'General case' 0 C--O 1.222 -0.388 0 O-C-N 121.908 -0.495 . . . . 1.96 110.773 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 14.7 mm -55.38 -40.36 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.607 0.763 . . . . 2.02 110.64 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -71.35 -34.76 70.78 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.583 0.957 . . . . 3.6800000000000002 113.583 176.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -64.15 -31.18 72.28 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.973 0.909 . . . . 4.0099999999999998 111.712 171.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.56 -36.28 57.72 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.123 2.169 . . . . 3.21 111.56 172.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -70.3 -22.19 62.86 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.631 1.172 . . . . 3.8199999999999998 113.556 177.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -63.61 -13.36 41.41 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.573 1.323 . . . . 3.02 114.573 169.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -149.36 -34.07 0.19 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 118.169 2.655 . . . . 3.9199999999999999 118.169 -171.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -88.44 98.21 11.5 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 121.229 1.831 . . . . 4.04 111.326 -175.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -64.83 -4.21 4.17 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 116.994 2.22 . . . . 3.8799999999999999 116.994 -172.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 120.41 5.67 10.18 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.679 -1.067 . . . . 2.4900000000000002 115.044 -167.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 37.7 mmt-85 -75.94 176.14 8.16 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.829 1.815 . . . . 5.71 109.848 150.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 32.7 mm -135.3 136.63 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 106.832 -1.544 . . . . 2.8900000000000001 106.832 167.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 23.8 m -95.21 147.55 23.35 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.837 0.744 . . . . 3.0499999999999998 110.28 168.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -61.87 -51.63 67.41 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.513 0.673 . . . . 3.8500000000000001 112.384 177.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -70.36 -16.02 62.93 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.562 1.545 . . . . 4.5700000000000003 112.777 -176.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -68.32 -38.02 81.16 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.085 -1.01 . . . . 4.8200000000000003 111.319 174.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -56.16 -45.43 79.68 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 119.963 -1.711 . . . . 2.9700000000000002 111.826 170.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.9 t-105 -68.09 -45.27 74.22 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.309 0.644 . . . . 0.77000000000000002 112.062 -177.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 87.2 m -58.25 -48.23 81.08 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.702 2.001 . . . . 3.21 110.783 175.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 84.0 mt -61.25 -27.65 68.6 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.394 0.887 . . . . 1.6799999999999999 113.394 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 23.7 mm -62.12 -39.88 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 CA-C-N 120.851 1.659 . . . . 1.8899999999999999 111.604 176.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -59.34 -30.65 68.21 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.645 1.117 . . . . 0.58999999999999997 113.012 175.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -69.12 -20.09 74.54 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-O 118.836 -0.98 . . . . 0.57999999999999996 114.297 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.5 mp -98.27 -36.53 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 119.17 1.485 . . . . 2.0299999999999998 110.912 163.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 17.4 m -81.54 64.92 6.46 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.973 2.109 . . . . 1.75 110.203 -173.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -137.66 -72.5 0.06 OUTLIER Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.403 1.478 . . . . 1.1399999999999999 111.649 178.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -65.43 -47.74 3.99 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.049 2.5 . . . . 1.3600000000000001 111.563 177.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 10.0 pt -66.99 -25.42 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 112.814 0.672 . . . . 2.29 112.814 174.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.76 -38.2 79.91 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.32 -0.863 . . . . 1.8100000000000001 112.692 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -65.78 -34.23 77.69 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 117.54 -1.219 . . . . 4.3600000000000003 112.922 165.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.2 tt -65.82 -39.43 90.84 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 121.206 1.821 . . . . 2.6000000000000001 111.872 177.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 96.3 mt -48.59 -59.28 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 CA-C-N 119.773 1.17 . . . . 2.2799999999999998 109.655 163.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 21.5 t60 -63.86 -22.37 66.89 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.661 1.356 . . . . 2.2400000000000002 114.661 -175.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -71.06 -46.29 62.21 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.385 1.074 . . . . 3.1600000000000001 112.106 164.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 25.2 mm100 -68.6 -41.99 78.8 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 117.64 -1.171 . . . . 2.4700000000000002 113.731 -173.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.25 -18.73 28.69 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.616 1.098 . . . . 2.7000000000000002 112.553 174.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -91.38 -47.37 7.5 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.603 -1.31 . . . . 3.7400000000000002 111.064 173.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -67.67 2.66 1.75 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 126.429 1.891 . . . . 5.9800000000000004 113.355 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 48.9 m -145.4 33.63 1.07 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.248 1.819 . . . . 6.9000000000000004 111.511 163.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 3.8 m -71.32 -5.25 31.02 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 120.727 -1.233 . . . . 9.6199999999999992 113.649 167.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 55.5 m . . . . . 0 C--O 1.25 1.104 0 C-N-CA 130.293 3.437 . . . . 11.56 109.641 -176.269 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 t . . . . . 0 N--CA 1.469 0.516 0 N-CA-C 110.786 -0.079 . . . . 12.960000000000001 110.786 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -67.35 -100.12 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 128.947 2.899 . . . . 9.6600000000000001 112.503 171.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 14.8 m -64.0 -44.88 91.3 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.662 -1.274 . . . . 5.1600000000000001 112.12 -167.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -82.78 103.59 12.38 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 106.949 -1.5 . . . . 4.4699999999999998 106.949 158.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 p -57.5 169.02 0.7 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.027 1.731 . . . . 2.6800000000000002 113.799 -163.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.0 -8.94 53.23 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.743 -1.223 . . . . 3.6800000000000002 113.786 172.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.51 -39.94 10.14 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.458 1.026 . . . . 2.0099999999999998 110.641 167.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -77.51 -58.85 3.04 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 120.702 -1.249 . . . . 3.5699999999999998 110.784 -173.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -56.67 -23.56 42.65 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.865 -0.522 . . . . 6.5499999999999998 111.624 171.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.04 -53.8 33.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.066 -1.021 . . . . 2.5899999999999999 112.785 168.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.03 -36.04 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 CA-C-N 119.865 1.211 . . . . 2.4399999999999999 110.727 174.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.4 mm -54.6 -50.93 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 119.463 1.029 . . . . 3.4500000000000002 110.645 167.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 31.0 t -69.67 -29.49 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 124.759 1.224 . . . . 2.5299999999999998 112.188 -174.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.2 mp -70.59 -39.79 73.63 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.7 1.137 . . . . 2.77 111.571 170.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.8 t -63.48 -46.46 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.046 0.938 . . . . 2.27 111.295 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -65.18 -45.72 83.73 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.362 0.983 . . . . 4.9500000000000002 111.244 172.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -57.85 -27.93 63.67 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 119.534 -1.979 . . . . 3.9199999999999999 113.815 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -74.63 -67.35 0.64 Allowed 'General case' 0 C--O 1.24 0.559 0 C-N-CA 123.266 0.626 . . . . 3.2400000000000002 111.709 165.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -61.11 -34.67 75.33 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 117.578 -1.201 . . . . 3.75 112.334 -168.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.8 mtpt -43.54 -51.43 6.79 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 126.861 2.064 . . . . 3.8799999999999999 113.044 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -81.6 -32.64 31.95 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.788 1.235 . . . . 4.0599999999999996 111.248 -176.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.6 t -77.96 56.01 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 128.217 2.607 . . . . 4.6299999999999999 110.115 177.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 t 72.89 -29.07 0.2 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 130.263 3.425 . . . . 3.8100000000000001 116.122 -171.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.1 tptp 119.32 -14.87 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.944 1 C-N-CA 133.677 4.791 . . . . 8.9399999999999995 113.279 -158.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -166.45 -17.57 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 117.155 2.28 . . . . 7.3700000000000001 117.155 -162.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.0 m -120.66 5.44 10.55 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 118.308 2.707 . . . . 5.0700000000000003 118.308 -140.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 91.0 mt 56.37 -81.92 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.575 1.95 . . . . 8.2300000000000004 113.286 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.5 p -102.74 -25.24 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 128.132 2.573 . . . . 4.7400000000000002 113.535 -170.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.32 -36.18 65.94 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.076 0.95 . . . . 8.1899999999999995 111.235 178.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.3 m120 -140.93 101.1 3.98 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.652 -1.61 . . . . 7.79 106.652 161.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.73 134.16 35.42 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 119.092 -0.48 . . . . 9.0 110.896 178.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 36.3 pt -68.83 160.48 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 CA-C-N 119.996 1.271 . . . . 2.8599999999999999 111.337 169.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.5 m -78.19 135.98 37.72 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 121.196 -0.94 . . . . 2.9500000000000002 109.072 157.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.5 mttp -59.1 -27.91 66.02 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.069 -1.02 . . . . 3.1600000000000001 112.256 -178.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.2 p -57.37 -30.8 65.17 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.253 1.575 . . . . 2.0899999999999999 115.253 168.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.8 m -71.19 -39.07 72.04 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.641 1.11 . . . . 1.6000000000000001 112.461 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -50.95 -53.91 28.83 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.038 0.935 . . . . 3.52 111.611 176.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 23.7 ptt85 -69.61 -14.42 62.82 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.611 1.337 . . . . 3.8999999999999999 114.611 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -89.18 -46.02 9.12 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.193 0.997 . . . . 4.5199999999999996 111.009 175.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 3.3 tmm? -47.45 -47.25 27.1 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.518 1.127 . . . . 1.78 111.69 164.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.5 mt -60.12 -37.29 79.6 Favored 'General case' 0 C--O 1.212 -0.879 0 C-N-CA 123.49 0.716 . . . . 2.9100000000000001 111.655 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -69.96 -14.31 62.65 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 120.001 1.273 . . . . 3.0299999999999998 113.736 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.82 -46.48 3.48 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.391 1.476 . . . . 3.71 114.108 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -87.28 -28.17 22.46 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 119.478 1.035 . . . . 3.5899999999999999 111.921 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.48 49.04 0.81 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.87 2.068 . . . . 2.5499999999999998 110.766 162.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 42.1 p30 -69.05 -178.37 1.24 Allowed 'General case' 0 CA--C 1.548 0.904 0 O-C-N 120.561 -1.337 . . . . 4.6699999999999999 111.467 166.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 61.5 m170 80.29 -32.27 0.12 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 116.872 2.175 . . . . 4.04 116.872 158.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.7 ptp -76.21 -19.66 58.18 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 113.383 0.883 . . . . 3.02 113.383 163.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.8 mp -69.28 107.87 3.44 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.505 0.722 . . . . 3.3500000000000001 110.857 -177.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.5 m -76.58 -19.5 57.81 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.956 0.724 . . . . 4.4299999999999997 112.956 167.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -162.67 160.61 25.83 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 127.73 2.412 . . . . 3.6899999999999999 107.902 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 p -51.28 -20.93 1.85 Allowed 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 126.455 1.902 . . . . 5.2999999999999998 114.004 164.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -48.88 -34.86 16.46 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-N 120.983 1.719 . . . . 2.1800000000000002 114.291 176.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 30.5 t30 -71.57 -38.71 70.91 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 118.158 0.979 . . . . 4.4299999999999997 112.304 175.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -63.73 -37.56 87.84 Favored 'General case' 0 C--N 1.346 0.446 0 O-C-N 121.003 -1.061 . . . . 5.5800000000000001 112.184 165.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -64.34 -27.48 69.05 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 119.643 -1.911 . . . . 3.8399999999999999 113.327 174.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.56 -12.95 61.63 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.906 1.076 . . . . 1.8999999999999999 113.906 166.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.75 -46.47 14.2 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.162 0.892 . . . . 2.3599999999999999 111.608 160.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -51.86 -44.01 63.48 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.64 1.176 . . . . 1.8999999999999999 113.259 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -55.92 -28.45 56.88 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.715 1.005 . . . . 3.9399999999999999 113.715 175.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.7 mt -79.39 -41.43 27.76 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.346 1.059 . . . . 2.0600000000000001 111.238 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 mm -53.44 -54.22 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 124.407 1.083 . . . . 1.77 110.175 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -58.1 -43.06 86.94 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.234 0.54 . . . . 2.4700000000000002 112.439 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -31.31 70.73 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.374 1.47 . . . . 3.77 112.829 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.6 mt -95.05 -23.24 17.43 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 114.01 1.115 . . . . 3.8799999999999999 114.01 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -67.84 -14.67 63.15 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.506 1.503 . . . . 3.0 112.394 170.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.15 -18.73 48.95 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.064 1.505 . . . . 3.2400000000000002 115.064 163.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -130.53 -24.17 2.53 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 116.455 2.02 . . . . 3.2400000000000002 116.455 -166.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.416 ' HD1' ' CD ' ' A' ' 78' ' ' GLU . 2.1 m170 -121.88 138.94 54.2 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.288 -1.507 . . . . 5.0099999999999998 112.885 -171.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.592 ' CG ' ' H ' ' A' ' 72' ' ' GLY . 13.3 t0 -96.37 -160.6 0.81 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 126.456 1.902 . . . . 4.5800000000000001 111.072 -175.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.592 ' H ' ' CG ' ' A' ' 71' ' ' ASP . . . -59.84 -10.74 14.52 Favored Glycine 0 CA--C 1.527 0.793 0 O-C-N 120.011 -1.681 . . . . 3.25 113.843 152.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.7 mmt-85 -69.93 79.1 0.47 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.356 1.578 . . . . 5.79 108.992 161.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.4 mt -83.32 135.54 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 N-CA-C 107.505 -1.294 . . . . 3.48 107.505 172.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.7 t -104.17 166.45 10.39 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.551 0.691 . . . . 2.2000000000000002 111.79 172.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -78.11 -42.97 30.31 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.273 1.035 . . . . 3.8799999999999999 112.496 -178.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.5 p-10 -71.63 -24.1 61.81 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.588 1.955 . . . . 3.6499999999999999 112.644 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.416 ' CD ' ' HD1' ' A' ' 70' ' ' HIS . 83.7 tt0 -52.86 -57.31 10.65 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.311 1.844 . . . . 2.8799999999999999 111.103 169.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -56.47 -46.73 80.26 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.223 -0.923 . . . . 3.27 111.814 177.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -59.76 -39.94 86.52 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.822 -0.549 . . . . 1.3100000000000001 111.747 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 73.2 m -63.9 -42.02 97.55 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 126.243 1.817 . . . . 2.8500000000000001 110.769 175.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.01 -38.83 92.22 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 117.929 -1.034 . . . . 2.0 113.289 174.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.1 mm -57.75 -34.4 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 120.716 1.598 . . . . 2.21 110.947 173.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.02 -6.06 36.32 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.87 1.224 . . . . 1.4099999999999999 114.618 176.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -97.46 -19.85 24.18 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.034 1.417 . . . . 0.73999999999999999 114.599 171.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 5.1 mp -92.89 -35.96 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 118.776 1.288 . . . . 2.6699999999999999 110.451 170.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.8 m -74.42 145.7 43.49 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.575 -0.898 . . . . 2.3999999999999999 108.575 171.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.45 -60.15 0.49 Allowed Glycine 0 CA--C 1.535 1.292 0 CA-C-O 117.086 -1.952 . . . . 2.1200000000000001 115.428 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -65.55 -64.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.81 0 CA-C-N 121.356 2.578 . . . . 1.45 111.095 -173.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.5 -7.98 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 112.897 0.703 . . . . 2.8700000000000001 112.897 175.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.67 -34.04 70.8 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.846 1.203 . . . . 1.8300000000000001 113.225 -178.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -66.68 -27.59 67.78 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.335 -1.478 . . . . 4.7599999999999998 111.873 175.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.1 tt -80.21 -33.56 38.01 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.655 1.582 . . . . 2.5800000000000001 111.564 174.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 98.0 mt -47.42 -52.49 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 CA-C-N 119.226 0.921 . . . . 1.96 110.435 165.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -53.53 -42.06 67.02 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.157 1.169 . . . . 3.77 114.157 177.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.56 -49.5 76.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.794 0.838 . . . . 6.5 110.731 173.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -60.56 -39.91 89.72 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 120.905 -1.122 . . . . 2.6899999999999999 113.35 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -66.94 -22.71 65.93 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 119.589 1.086 . . . . 3.4399999999999999 112.283 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -96.9 -47.72 5.72 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.162 -0.961 . . . . 2.1899999999999999 112.017 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -67.45 -18.8 65.22 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.601 0.76 . . . . 4.6399999999999997 112.329 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.1 t -86.7 11.31 13.3 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.699 1.2 . . . . 8.5399999999999991 113.515 164.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 46.8 t -150.73 52.13 0.87 Allowed 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.296 -1.503 . . . . 9.3800000000000008 112.798 -169.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 C--O 1.25 1.107 0 C-N-CA 126.997 2.119 . . . . 11.199999999999999 110.844 172.934 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 N--CA 1.47 0.556 0 CA-C-O 120.362 0.125 . . . . 12.779999999999999 110.856 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -65.07 -100.42 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 129.172 2.989 . . . . 9.2400000000000002 112.689 172.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 19.1 m -66.2 -51.11 60.87 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.435 -1.415 . . . . 4.8200000000000003 111.668 -168.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -74.61 98.21 3.34 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 106.426 -1.694 . . . . 4.5899999999999999 106.426 159.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 11.2 p -58.32 168.2 1.15 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 126.214 1.805 . . . . 2.6899999999999999 113.72 -162.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.51 -6.88 21.73 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.432 -1.417 . . . . 3.4399999999999999 113.742 171.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.61 -38.72 9.43 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.663 1.12 . . . . 1.9399999999999999 111.344 166.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.87 -58.39 3.29 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 120.537 -1.352 . . . . 3.5 110.407 -174.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 14.0 tptp -57.84 -26.06 61.51 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 122.087 -0.383 . . . . 7.5800000000000001 110.66 174.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.23 -55.97 23.25 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 121.477 -0.764 . . . . 2.4900000000000002 112.887 169.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.25 -35.09 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-N 119.911 1.232 . . . . 2.46 110.668 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 19.8 mt -57.68 -44.53 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 118.596 0.635 . . . . 2.2000000000000002 112.167 167.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 39.8 t -72.73 -29.46 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 124.26 1.024 . . . . 2.4900000000000002 111.558 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.4 mp -69.68 -43.44 72.51 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.15 0.886 . . . . 2.8999999999999999 111.184 168.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 19.2 t -57.41 -46.76 85.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.566 1.146 . . . . 2.3500000000000001 111.728 171.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -62.31 -51.9 65.81 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.961 0.904 . . . . 4.6799999999999997 111.869 172.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -59.95 -25.59 65.32 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.489 -1.382 . . . . 3.9199999999999999 113.497 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -72.64 -69.54 0.4 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.688 0.795 . . . . 3.7200000000000002 111.534 164.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -62.98 -32.15 73.42 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 118.328 -0.844 . . . . 3.5499999999999998 113.025 -167.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . 0.401 ' HZ1' ' CD ' ' B' ' 148' ' ' GLU . 28.0 mtpt -43.86 -54.23 5.42 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.376 1.87 . . . . 3.8100000000000001 113.2 174.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . 0.418 ' CZ ' ' HG3' ' B' ' 144' ' ' MET . 43.1 m-85 -75.5 -30.2 59.78 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 123.531 0.732 . . . . 3.8599999999999999 110.783 -177.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . 0.443 HG11 ' H ' ' B' ' 131' ' ' LEU . 65.2 t -79.29 49.91 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 C-N-CA 127.683 2.393 . . . . 4.2599999999999998 110.702 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 72.97 -26.41 0.19 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 129.504 3.122 . . . . 3.8100000000000001 115.791 -172.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 38.9 tptt 116.67 -17.79 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.946 1 C-N-CA 133.47 4.708 . . . . 9.0999999999999996 113.631 -157.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -159.54 -26.07 0.07 Allowed 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 117.693 2.479 . . . . 7.5599999999999996 117.693 -169.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 4.0 m -104.66 6.72 34.57 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 118.57 2.804 . . . . 5.1600000000000001 118.57 -140.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . 0.443 ' H ' HG11 ' B' ' 126' ' ' VAL . 88.0 mt 57.43 -79.31 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.987 2.115 . . . . 7.9199999999999999 113.788 173.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 11.0 p -102.71 -25.12 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 126.12 1.768 . . . . 4.8600000000000003 113.56 -174.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.15 -40.4 77.13 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.382 1.073 . . . . 8.0399999999999991 111.164 177.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 23.1 m120 -131.12 83.81 2.14 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.449 1.5 . . . . 7.6900000000000004 107.652 162.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.92 133.31 49.75 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.106 -0.637 . . . . 8.9700000000000006 111.757 171.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 35.9 pt -80.09 168.12 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-O 121.708 0.766 . . . . 2.79 112.403 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 5.5 m -99.07 127.2 44.97 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 121.825 -0.547 . . . . 2.9199999999999999 109.933 176.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 32.0 mttp -60.79 -28.63 68.9 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 120.836 -1.165 . . . . 3.1699999999999999 112.256 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 10.8 p -60.2 -33.69 72.58 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.75 1.62 . . . . 2.0600000000000001 113.801 168.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.2 m -79.95 -37.36 34.63 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 118.197 -0.906 . . . . 1.8100000000000001 111.792 174.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -49.05 -54.07 17.49 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.571 1.078 . . . . 3.27 111.878 173.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 14.0 ptt85 -66.08 -17.17 64.53 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 114.211 1.189 . . . . 4.4500000000000002 114.211 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -94.02 -48.12 6.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.205 1.402 . . . . 3.8599999999999999 110.086 -177.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' MET . . . . . 0.418 ' HG3' ' CZ ' ' B' ' 125' ' ' TYR . 5.6 tmm? -45.17 -45.73 11.69 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.118 2.167 . . . . 1.99 112.51 162.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 8.9 mt -54.35 -40.87 68.48 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 123.625 0.77 . . . . 2.52 111.292 176.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -71.04 -13.66 62.06 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.634 -1.292 . . . . 2.9700000000000002 113.944 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.76 -53.78 3.31 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.902 1.281 . . . . 2.6099999999999999 113.086 175.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.401 ' CD ' ' HZ1' ' B' ' 124' ' ' LYS . 14.4 mt-10 -86.98 -26.96 23.55 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.385 0.539 . . . . 3.6400000000000001 111.657 -174.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -107.61 46.83 0.92 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.921 2.089 . . . . 2.4900000000000002 110.951 164.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 48.9 p30 -65.84 -178.38 0.57 Allowed 'General case' 0 CA--C 1.554 1.109 0 O-C-N 120.952 -1.093 . . . . 4.79 111.864 168.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 60.6 m170 79.17 -35.43 0.16 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 117.168 2.284 . . . . 3.8900000000000001 117.168 156.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 10.5 ptp -73.46 -19.37 60.96 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 118.716 0.689 . . . . 3.1000000000000001 112.77 162.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.33 99.83 0.58 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.935 0.894 . . . . 3.2400000000000002 111.04 -172.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 1.2 m -75.14 -14.7 60.58 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.259 1.024 . . . . 4.4100000000000001 113.378 175.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -167.22 159.97 13.29 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 128.574 2.749 . . . . 3.8900000000000001 108.035 166.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 72.9 p -50.01 -24.19 2.47 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.035 1.734 . . . . 6.0800000000000001 113.5 165.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -51.71 -29.67 26.24 Favored Glycine 0 CA--C 1.529 0.967 0 CA-C-N 120.822 1.646 . . . . 2.5499999999999998 114.073 174.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -74.31 -36.16 63.71 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 118.3 1.05 . . . . 4.2699999999999996 112.377 174.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 17.4 ttt-85 -64.12 -39.56 94.3 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.994 0.815 . . . . 5.4000000000000004 111.884 162.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.6 mtmt -65.8 -20.95 66.44 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 119.893 -1.754 . . . . 4.25 113.652 174.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -73.18 -10.39 59.72 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.239 -0.913 . . . . 1.98 113.447 168.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.02 -44.44 15.21 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 117.334 -1.317 . . . . 2.3799999999999999 111.471 158.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -48.52 -44.59 36.31 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 120.86 1.664 . . . . 1.9399999999999999 113.632 176.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -55.37 -30.29 60.06 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.105 1.15 . . . . 4.54 114.105 174.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 39.5 mt -78.4 -38.25 42.04 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.481 -0.762 . . . . 2.0600000000000001 111.892 173.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 9.5 mm -58.8 -53.39 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 124.004 0.815 . . . . 1.8999999999999999 109.669 -174.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -60.61 -31.34 70.52 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.256 0.835 . . . . 2.6200000000000001 113.256 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -73.84 -39.9 63.69 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.927 1.691 . . . . 3.3799999999999999 112.738 176.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.02 -18.02 22.29 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 114.09 1.144 . . . . 4.21 114.09 -173.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -58.88 -24.2 61.92 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.847 1.259 . . . . 3.0800000000000001 113.021 166.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.58 -24.75 45.35 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.065 1.135 . . . . 3.0699999999999998 114.065 169.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -109.34 -16.49 14.02 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.739 1.385 . . . . 2.5899999999999999 114.739 -170.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 5.7 t-80 -142.08 97.2 3.09 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 120.57 -1.331 . . . . 4.6299999999999999 112.576 -163.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -65.49 167.52 8.68 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 108.857 -0.794 . . . . 4.7999999999999998 108.857 149.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -67.39 31.35 0.21 Allowed Glycine 0 CA--C 1.527 0.818 0 C-N-CA 126.113 1.816 . . . . 3.73 116.799 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 30.8 mmt-85 -76.24 50.57 0.64 Allowed 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.476 1.638 . . . . 6.2999999999999998 109.864 161.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.9 mt -62.29 136.71 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.023 1.329 . . . . 3.8500000000000001 111.144 -162.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 12.8 t -117.83 155.91 29.28 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.667 1.187 . . . . 3.04 109.471 167.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -56.35 -34.78 66.94 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.488 1.115 . . . . 3.73 113.122 -173.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -68.52 -21.78 64.56 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.773 2.029 . . . . 3.9199999999999999 114.052 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -66.96 -58.63 4.59 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.008 1.277 . . . . 3.0899999999999999 110.944 178.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -50.03 -49.56 50.48 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.787 -0.571 . . . . 3.3999999999999999 111.706 172.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -61.17 -39.57 90.61 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.725 -0.609 . . . . 1.3200000000000001 112.085 -176.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 27.5 m -64.85 -44.18 90.58 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.746 1.618 . . . . 2.8199999999999998 110.86 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 88.4 mt -64.83 -36.47 84.45 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 117.847 -1.073 . . . . 2.1200000000000001 113.097 177.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 34.5 mm -56.21 -45.32 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 CA-C-N 120.898 1.681 . . . . 2.1600000000000001 111.344 172.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -64.82 -19.4 65.32 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 123.849 0.738 . . . . 1.1200000000000001 113.272 177.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.37 -20.82 65.94 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-O 118.257 -1.302 . . . . 1.03 113.915 173.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.3 mp -86.95 -43.09 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 CA-C-N 119.607 1.704 . . . . 2.1299999999999999 109.994 164.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 11.5 m -77.92 66.01 3.48 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.868 1.667 . . . . 2.27 111.375 -168.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -131.91 -75.39 0.12 Allowed Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.853 1.692 . . . . 1.6299999999999999 112.961 -174.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.52 -59.43 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.256 2.638 . . . . 1.6499999999999999 112.753 -168.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.3 pp -69.08 -11.55 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 113.282 0.845 . . . . 2.8599999999999999 113.282 -173.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -56.5 -35.9 68.53 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.624 1.102 . . . . 2.0600000000000001 112.899 175.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -74.08 -10.24 59.43 Favored 'General case' 0 CA--C 1.55 0.979 0 O-C-N 120.287 -1.508 . . . . 5.2800000000000002 112.785 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.1 tt -93.88 -30.33 14.84 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.176 2.19 . . . . 2.6600000000000001 112.377 166.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 91.6 mt -49.24 -48.14 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 120.661 -1.274 . . . . 2.2000000000000002 109.558 165.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -57.21 -30.31 64.46 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 115.458 1.651 . . . . 3.8100000000000001 115.458 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.67 -54.14 15.27 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.846 -0.427 . . . . 6.1799999999999997 109.846 168.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -58.8 -41.69 87.36 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.791 1.404 . . . . 3.0 114.791 -172.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -69.66 -17.65 63.52 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 119.541 1.064 . . . . 3.25 112.471 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.8 -50.82 4.3 Favored 'General case' 0 CA--C 1.514 -0.409 0 O-C-N 121.232 -0.918 . . . . 2.2999999999999998 111.735 177.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -67.08 -17.13 64.74 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.954 -1.021 . . . . 4.9400000000000004 112.757 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 26.3 t -91.71 15.29 13.04 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.549 1.14 . . . . 8.2699999999999996 113.031 165.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 41.4 t -148.17 55.5 1.04 Allowed 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.62 -1.3 . . . . 9.1199999999999992 112.106 -173.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 26.5 t . . . . . 0 C--O 1.254 1.315 0 C-N-CA 127.52 2.328 . . . . 11.1 111.029 174.892 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.437 ' H1 ' ' CG ' ' A' ' 3' ' ' ASP . 59.1 m . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 120.997 0.427 . . . . 11.970000000000001 110.185 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.437 ' CG ' ' H1 ' ' A' ' 2' ' ' SER . 11.3 m-20 -110.16 53.66 0.69 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 125.454 2.549 . . . . 7.0800000000000001 112.964 -133.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 74.0 m -83.49 77.25 9.85 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 109.608 -3.451 . . . . 3.7200000000000002 109.75 176.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -43.92 110.26 0.2 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.705 1.202 . . . . 3.2799999999999998 111.942 175.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.9 t -64.69 151.9 43.8 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.48 0.712 . . . . 3.3300000000000001 110.329 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.502 ' CD ' ' HZ1' ' A' ' 10' ' ' LYS . 4.5 tp10 -51.09 -38.95 54.82 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.484 1.114 . . . . 2.5299999999999998 112.033 -173.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.54 -49.16 73.39 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.281 1.432 . . . . 1.8999999999999999 111.611 178.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -72.95 -46.14 54.13 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.521 -0.737 . . . . 3.1699999999999999 111.341 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.502 ' HZ1' ' CD ' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -48.85 -37.13 18.6 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.635 0.731 . . . . 6.9900000000000002 110.951 169.657 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.96 -47.35 25.43 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.301 1.44 . . . . 1.53 112.326 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 74.3 t -54.66 -38.5 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 120.027 1.285 . . . . 1.7 110.398 171.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 85.5 mt -60.37 -55.01 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 118.403 -0.808 . . . . 2.3700000000000001 110.364 170.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.4 t -56.09 -40.98 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.537 1.062 . . . . 1.75 112.569 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -64.35 -36.98 85.88 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.265 -0.897 . . . . 2.0699999999999998 111.566 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.5 t -80.84 -35.98 15.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 124.363 1.065 . . . . 1.8999999999999999 111.339 -178.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.418 ' CD ' ' HZ3' ' A' ' 21' ' ' LYS . 14.6 tm-20 -54.83 -49.96 69.78 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.032 0.933 . . . . 2.8799999999999999 109.98 164.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -66.14 -9.48 31.94 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.496 1.295 . . . . 2.6400000000000001 114.496 -170.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -112.46 -50.42 2.9 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.729 1.211 . . . . 3.6699999999999999 113.631 -178.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -59.68 -25.87 65.1 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.368 1.44 . . . . 3.4700000000000002 112.912 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.418 ' HZ3' ' CD ' ' A' ' 17' ' ' GLU . 7.3 ptmt -53.64 -20.45 5.29 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.623 -1.298 . . . . 2.8700000000000001 114.437 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -80.3 -2.86 47.05 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.43 1.27 . . . . 3.7400000000000002 114.43 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.8 m -128.46 152.5 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 126.298 1.839 . . . . 3.6800000000000002 109.53 171.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 p -92.2 -45.04 8.45 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.161 1.541 . . . . 4.5599999999999996 115.161 -174.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 178.0 -63.54 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.9 1.28 . . . . 6.2199999999999998 113.01 -174.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -99.14 128.76 45.33 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.426 -0.806 . . . . 8.7400000000000002 110.624 -161.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 48.3 t -170.73 157.6 5.68 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.237 0.615 . . . . 5.3200000000000003 111.877 -166.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 34.8 mt -87.32 4.57 42.34 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.483 1.913 . . . . 11.02 113.237 176.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.4 p -164.81 153.76 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.631 1.972 . . . . 5.5300000000000002 110.541 -165.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -61.18 -28.48 69.17 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.186 1.18 . . . . 17.879999999999999 114.186 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -151.11 154.88 37.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.382 1.473 . . . . 12.49 112.423 168.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . 0.256 44.0 tttt -147.28 46.46 1.14 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 125.19 1.396 . . . . 9.3599999999999994 111.235 162.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.9 pt -68.99 167.26 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-N 114.722 -1.127 . . . . 3.6899999999999999 109.735 172.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.7 t -71.82 129.72 39.33 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 120.549 -1.344 . . . . 3.2000000000000002 109.932 166.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.6 mttp -61.53 -20.52 63.34 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.023 -1.048 . . . . 3.3700000000000001 111.815 173.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.8 m -68.72 -28.41 66.8 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.357 -0.839 . . . . 3.1699999999999999 112.99 172.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.2 m -74.98 -21.42 59.16 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 120.029 1.286 . . . . 1.76 113.71 -173.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -63.15 -57.26 11.14 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.656 -1.278 . . . . 3.1400000000000001 112.021 165.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -60.65 -30.06 69.65 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.849 -0.532 . . . . 3.5699999999999998 112.227 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.98 -58.64 5.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.31 2.244 . . . . 3.5099999999999998 110.266 171.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -52.53 -37.66 58.05 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 127.798 2.439 . . . . 2.0899999999999999 113.868 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 58.9 mt -56.68 -16.17 5.83 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 115.088 1.514 . . . . 2.2799999999999998 115.088 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . 0.253 0.1 OUTLIER -110.87 11.42 22.36 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 115.058 1.503 . . . . 2.9100000000000001 115.058 171.786 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.94 -56.28 2.22 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.54 1.136 . . . . 2.6200000000000001 111.532 164.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -81.28 -46.86 14.14 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.327 -0.858 . . . . 3.1200000000000001 112.344 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.43 15.4 3.06 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.385 -1.447 . . . . 2.96 114.295 -172.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.15 29.69 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 130.582 3.553 . . . . 2.3300000000000001 118.226 -174.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.412 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 21.4 m-70 -126.89 -67.1 0.87 Allowed 'General case' 0 CA--C 1.545 0.786 0 O-C-N 120.07 -1.644 . . . . 2.4100000000000001 111.705 -178.054 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.3 ptp -65.3 -11.83 45.61 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.301 1.41 . . . . 3.04 114.181 167.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.4 tp -58.44 99.54 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.12 1.768 . . . . 3.2999999999999998 110.286 -176.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.19 61.39 6.8 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.412 1.085 . . . . 4.4500000000000002 110.143 -171.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.492 ' CG ' ' H ' ' A' ' 53' ' ' THR . 36.1 t70 48.1 -135.74 1.04 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 127.318 2.247 . . . . 5.0 112.904 -178.125 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.492 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 14.4 p -76.61 -37.89 55.67 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 127.082 2.153 . . . . 3.25 111.18 -170.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.82 -40.58 93.19 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 119.166 0.893 . . . . 1.8100000000000001 111.824 175.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -68.81 -56.91 6.51 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.326 1.051 . . . . 3.1400000000000001 111.259 172.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -56.4 -39.27 72.72 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 114.459 1.281 . . . . 6.1500000000000004 114.459 -176.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 48.6 mmtt -54.15 -38.19 65.24 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.67 1.577 . . . . 3.8900000000000001 113.45 174.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.14 -30.02 61.54 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.869 -1.062 . . . . 1.8100000000000001 113.423 175.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.61 -47.96 65.33 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.173 0.897 . . . . 1.72 111.206 171.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -63.46 -32.36 73.78 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.433 1.093 . . . . 2.04 112.825 -175.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -57.27 -32.24 66.41 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 119.287 0.949 . . . . 4.1900000000000004 113.35 173.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -75.58 -43.54 47.77 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.01 0.924 . . . . 1.8500000000000001 111.637 175.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 27.0 mm -59.88 -45.21 95.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 117.847 0.294 . . . . 2.2400000000000002 110.671 -170.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -59.28 -40.4 85.98 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.837 0.827 . . . . 2.98 113.094 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -65.2 -23.83 67.2 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.794 1.238 . . . . 4.0899999999999999 112.486 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -93.21 -33.68 13.89 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 125.827 1.651 . . . . 3.3300000000000001 113.171 174.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -58.71 -28.87 66.21 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.663 -1.273 . . . . 2.7200000000000002 112.961 163.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.34 -14.43 62.92 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.115 1.524 . . . . 2.4300000000000002 115.115 167.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -136.69 3.1 2.72 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.972 1.841 . . . . 2.5499999999999998 115.972 -165.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -150.54 127.89 11.37 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 119.789 -1.819 . . . . 4.1699999999999999 112.231 -171.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -58.71 13.13 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 130.494 3.518 . . . . 4.7699999999999996 115.134 173.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.47 -18.96 4.12 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 118.537 -2.602 . . . . 3.5 111.745 -162.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -44.19 135.83 4.22 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.181 1.49 . . . . 5.5499999999999998 107.232 150.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -140.23 146.77 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.983 0.897 . . . . 4.2599999999999998 109.367 171.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 16.1 m -56.69 167.82 0.69 Allowed 'General case' 0 CA--C 1.552 1.057 0 CA-C-O 121.995 0.902 . . . . 2.2799999999999998 111.969 162.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -76.23 -33.16 59.21 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-O 124.258 1.98 . . . . 3.77 109.874 160.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.31 -20.38 48.09 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 130.284 3.434 . . . . 3.6699999999999999 110.859 -162.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -68.11 -58.46 4.44 Favored 'General case' 0 C--O 1.22 -0.475 0 C-N-CA 127.242 2.217 . . . . 4.8499999999999996 111.859 176.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -48.32 -49.14 35.26 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 121.395 1.907 . . . . 2.8100000000000001 111.937 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 14.7 t-105 -59.68 -47.71 84.56 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 118.802 -0.618 . . . . 1.0600000000000001 110.84 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 94.6 m -58.59 -51.29 70.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.958 1.303 . . . . 3.46 111.249 175.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.8 mt -58.6 -33.35 69.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.33 1.452 . . . . 2.21 113.227 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 19.5 mm -50.6 -42.48 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 CA-C-N 120.441 1.473 . . . . 1.8200000000000001 111.047 173.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.94 -17.88 37.96 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.455 1.026 . . . . 0.70999999999999996 114.776 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.75 -24.21 60.69 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-N 118.472 1.136 . . . . 0.78000000000000003 113.741 174.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.6 mp -95.32 -44.32 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 119.398 1.599 . . . . 1.71 109.704 169.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.8 m -74.29 54.07 0.54 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.167 2.187 . . . . 2.1499999999999999 109.983 165.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -124.1 -77.79 0.35 Allowed Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.532 1.539 . . . . 1.1399999999999999 111.182 177.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.88 -46.84 0.68 Allowed 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 123.323 2.682 . . . . 1.0900000000000001 112.685 -174.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -76.11 -16.38 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 113.195 0.813 . . . . 2.5 113.195 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.89 -31.38 64.64 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.34 0.867 . . . . 2.2599999999999998 113.34 -169.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -45.84 90.87 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.283 -0.886 . . . . 3.7000000000000002 111.777 168.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -57.81 -36.75 72.67 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 123.83 0.852 . . . . 2.8399999999999999 111.493 -173.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.1 mt -48.42 -59.7 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.72 1.208 . . . . 2.0299999999999998 110.699 171.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -64.39 -32.93 74.75 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.379 -0.825 . . . . 1.8200000000000001 112.978 -176.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.322 3.1 pt-20 -81.91 -22.66 36.68 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 112.989 0.737 . . . . 2.9100000000000001 112.989 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -68.15 -41.48 81.51 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 125.381 1.472 . . . . 3.0 113.761 167.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.08 -40.42 76.91 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.642 1.11 . . . . 2.6699999999999999 110.371 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -58.92 -49.88 76.16 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.339 0.656 . . . . 3.6899999999999999 111.28 173.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -67.97 -9.7 47.49 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.281 1.032 . . . . 5.79 113.451 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.4 m -111.76 7.83 20.39 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.048 1.739 . . . . 6.7199999999999998 111.912 177.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.0 m -82.63 10.18 7.98 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.637 1.347 . . . . 9.5199999999999996 114.637 -172.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 96.2 p . . . . . 0 C--O 1.247 0.968 0 C-N-CA 125.461 1.504 . . . . 11.859999999999999 112.96 -169.676 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' SER . . . . . 0.408 ' H1 ' ' CG ' ' B' ' 106' ' ' ASP . 74.5 m . . . . . 0 N--CA 1.479 0.99 0 CA-C-O 121.333 0.587 . . . . 11.92 110.133 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . 0.408 ' CG ' ' H1 ' ' B' ' 105' ' ' SER . 8.8 m-20 -113.39 65.78 0.65 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 125.137 2.399 . . . . 6.96 110.908 -138.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 39.4 t -66.43 -25.91 66.97 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 109.142 -3.663 . . . . 4.1799999999999997 113.849 -178.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.412 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 15.6 m-85 52.98 82.46 0.07 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 126.543 1.937 . . . . 3.5800000000000001 113.481 -174.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.4 t -67.43 152.92 44.84 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.514 0.726 . . . . 3.75 111.73 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -64.86 -31.65 72.98 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 114.149 1.166 . . . . 2.5899999999999999 114.149 -159.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.77 -46.39 84.62 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.524 1.056 . . . . 1.77 110.184 177.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.25 -50.34 22.85 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.136 -0.935 . . . . 3.1099999999999999 110.913 -176.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -38.43 -50.17 1.5 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.479 1.036 . . . . 4.9400000000000004 113.239 164.065 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.19 -37.39 80.89 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 118.234 -0.889 . . . . 1.54 112.553 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 70.4 t -61.43 -40.2 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.842 1.201 . . . . 1.71 110.477 169.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 48.0 mt -58.72 -51.12 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 119.452 1.024 . . . . 2.02 109.894 170.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 19.7 t -61.95 -41.02 89.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.799 1.24 . . . . 1.6799999999999999 112.717 -176.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.7 mp -63.72 -43.39 96.68 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.287 -0.883 . . . . 1.8300000000000001 111.078 175.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 54.1 t -71.66 -36.16 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.861 0.865 . . . . 1.8200000000000001 112.142 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . 0.406 ' CD ' ' HZ3' ' B' ' 124' ' ' LYS . 10.0 tm-20 -55.07 -51.06 67.55 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.496 1.118 . . . . 3.21 110.358 166.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -64.32 -6.52 7.14 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.947 1.462 . . . . 2.4700000000000002 114.947 -174.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -110.24 -57.37 2.21 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.988 1.315 . . . . 3.3900000000000001 112.856 -178.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -61.5 -20.86 63.67 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.426 1.012 . . . . 3.52 113.45 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . 0.406 ' HZ3' ' CD ' ' B' ' 120' ' ' GLU . 5.9 ptmt -53.86 -19.36 4.33 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 120.278 -1.513 . . . . 2.8799999999999999 114.598 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -81.14 -1.66 45.35 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 114.406 1.261 . . . . 3.6800000000000002 114.406 174.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 29.4 m -128.72 158.47 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 125.503 1.521 . . . . 3.5699999999999998 110.778 172.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 5.8 p -84.52 -41.82 16.14 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 114.959 1.466 . . . . 4.2199999999999998 114.959 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . 0.516 ' HB2' ' HZ3' ' B' ' 128' ' ' LYS . 4.6 ttmp? 141.1 -43.97 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.941 1 C-N-CA 132.121 4.168 . . . . 6.0899999999999999 112.546 -164.291 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -95.41 116.16 28.41 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.879 0.871 . . . . 9.2599999999999998 111.124 -166.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 29.3 t -174.2 160.67 3.4 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.165 0.986 . . . . 5.2999999999999998 110.961 -165.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 80.2 mt -81.51 -7.07 59.53 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.793 1.237 . . . . 11.24 113.436 171.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 2.3 m -153.43 160.58 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 126.629 1.972 . . . . 5.1600000000000001 111.716 -174.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -48.66 -50.99 30.66 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.539 1.136 . . . . 17.390000000000001 111.985 171.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -144.25 136.87 26.86 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.06 0.944 . . . . 12.359999999999999 112.502 170.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -126.82 54.65 1.6 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.953 1.301 . . . . 9.7100000000000009 108.55 153.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 29.7 pt -77.19 156.13 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 108.72 -0.845 . . . . 3.7000000000000002 108.72 173.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 41.7 t -61.21 122.2 14.47 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.918 -1.114 . . . . 3.1000000000000001 109.726 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 14.2 mttp -64.45 -17.35 63.74 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 120.961 -1.087 . . . . 3.7400000000000002 111.379 177.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 37.0 m -63.98 -29.54 70.69 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.331 -0.856 . . . . 2.96 112.778 167.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 58.6 m -74.83 -20.89 59.57 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.967 1.258 . . . . 1.75 113.733 -174.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.18 -58.68 5.38 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.171 1.35 . . . . 3.3900000000000001 110.744 167.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.6 ptt180 -60.49 -27.04 67.27 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.658 -0.651 . . . . 4.2599999999999998 112.475 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -66.82 -58.61 4.69 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.259 1.824 . . . . 3.6200000000000001 110.601 169.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.9 tmm? -50.98 -39.11 54.71 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 127.744 2.418 . . . . 2.0800000000000001 113.514 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 75.2 mt -63.14 -0.03 0.69 Allowed 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 116.106 1.891 . . . . 2.0099999999999998 116.106 175.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . 0.263 0.1 OUTLIER -118.46 9.88 12.49 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.27 1.582 . . . . 2.8799999999999999 115.27 164.044 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.91 -64.36 1.19 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.29 1.436 . . . . 2.6299999999999999 111.826 168.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -76.57 -30.2 56.95 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.778 0.717 . . . . 3.1299999999999999 111.511 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 mp -100.98 77.78 1.87 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.777 0.798 . . . . 2.8399999999999999 110.87 165.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -109.68 0.7 19.09 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.74 1.385 . . . . 2.0699999999999998 114.74 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -109.9 -39.83 4.95 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.9 1.227 . . . . 2.1499999999999999 113.671 -171.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 17.3 ptp -85.41 -15.78 41.94 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.766 -1.209 . . . . 2.6699999999999999 113.714 171.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.65 103.41 0.25 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 126.357 1.863 . . . . 3.0899999999999999 111.575 -166.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.14 59.1 5.42 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.076 0.951 . . . . 4.5300000000000002 110.841 -172.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . 0.527 ' CG ' ' H ' ' B' ' 156' ' ' THR . 35.3 t70 50.19 -139.7 0.86 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 127.042 2.137 . . . . 4.8099999999999996 112.395 -176.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 156' ' ' THR . . . . . 0.527 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 18.9 p -77.34 -35.58 54.58 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 126.669 1.988 . . . . 3.5 111.485 -167.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.3 -41.65 95.11 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 119.773 1.17 . . . . 1.9199999999999999 111.509 176.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 -66.62 -55.82 13.53 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.955 1.302 . . . . 3.0099999999999998 111.346 173.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -53.36 -39.36 64.12 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.573 1.323 . . . . 6.3600000000000003 114.573 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -60.34 -33.6 72.63 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.603 1.547 . . . . 3.8399999999999999 113.511 177.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -56.21 -28.16 57.31 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 118.148 -0.929 . . . . 1.8600000000000001 113.095 175.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.73 -48.68 63.19 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 118.757 0.708 . . . . 1.8300000000000001 111.657 169.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -65.88 -30.87 71.54 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.174 0.99 . . . . 2.2200000000000002 113.174 -173.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 23.5 mtmt -58.16 -30.38 66.34 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.19 0.905 . . . . 4.2699999999999996 113.351 171.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 5.9 mt -80.77 -42.51 21.65 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.145 0.978 . . . . 1.9199999999999999 111.742 174.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 16.1 mm -58.12 -44.73 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 CA-C-N 118.556 0.617 . . . . 2.3300000000000001 110.701 -173.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -56.49 -42.23 77.94 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.655 0.613 . . . . 3.1499999999999999 112.655 177.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -65.57 -25.8 67.58 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.504 1.121 . . . . 3.8199999999999998 113.275 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.24 -37.47 9.66 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.888 1.275 . . . . 3.54 113.131 -177.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -65.69 -22.45 66.63 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 120.904 -1.122 . . . . 3.2400000000000002 112.418 165.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.57 -23.54 62.62 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.729 1.381 . . . . 2.4900000000000002 114.729 164.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -118.31 -9.86 10.33 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.853 1.797 . . . . 2.5299999999999998 115.853 -169.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -140.83 129.44 22.76 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 120.887 1.676 . . . . 4.96 112.721 -171.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -64.09 70.41 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 126.993 2.117 . . . . 4.6299999999999999 112.986 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 57.05 -1.75 0.11 Allowed Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.467 1.508 . . . . 3.96 114.209 -167.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 15.3 mmt85 -69.39 144.53 53.36 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 118.675 1.237 . . . . 5.54 109.1 -172.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.7 mt -126.86 138.15 55.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 104.767 -2.309 . . . . 4.8300000000000001 104.767 156.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 39.3 m -74.98 -100.31 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.663 -0.648 . . . . 2.25 110.086 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -151.85 -66.72 0.17 Allowed 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.278 -1.513 . . . . 3.8300000000000001 109.339 166.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -22.2 -46.91 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 130.486 3.515 . . . . 3.2200000000000002 114.808 149.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -48.63 -61.65 1.92 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.583 1.953 . . . . 4.7999999999999998 115.291 169.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -54.85 -42.54 72.11 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 119.759 -1.838 . . . . 2.98 111.56 -178.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 18.6 t-105 -62.09 -44.75 95.98 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.959 0.903 . . . . 0.97999999999999998 111.509 178.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 90.6 m -61.26 -44.93 96.44 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.956 1.702 . . . . 3.6099999999999999 111.302 174.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.7 mt -62.28 -32.67 73.42 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 117.32 -1.324 . . . . 2.1200000000000001 112.794 177.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 26.4 mm -52.94 -42.13 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 121.556 1.98 . . . . 1.8300000000000001 110.684 173.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.82 -9.86 35.55 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 125.153 1.358 . . . . 0.68000000000000005 115.115 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -83.67 -21.67 57.49 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-N 119.023 1.412 . . . . 0.85999999999999999 113.528 169.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.7 mp -100.12 -52.1 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 118.771 1.285 . . . . 1.78 109.187 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 18.2 m -75.46 58.89 1.05 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.395 2.278 . . . . 2.3399999999999999 109.269 166.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -141.94 -70.54 0.03 OUTLIER Glycine 0 CA--C 1.526 0.725 0 C-N-CA 126.183 1.849 . . . . 1.0900000000000001 110.15 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.23 -51.67 3.35 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.959 2.439 . . . . 1.28 112.051 175.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 1.8 pp -81.64 -13.74 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 113.038 0.755 . . . . 2.46 113.038 -174.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.26 -31.64 72.12 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.221 0.822 . . . . 2.0600000000000001 113.221 -170.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . 0.424 ' HZ2' ' CD ' ' B' ' 199' ' ' GLU . 0.0 OUTLIER -55.62 -46.82 77.33 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.538 -0.726 . . . . 3.54 112.558 167.677 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.9 tt -60.17 -34.62 73.83 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.588 -0.72 . . . . 2.5099999999999998 111.379 -172.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 62.3 mt -51.46 -61.91 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.65 1.18 . . . . 1.9199999999999999 109.853 171.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -59.47 -36.15 75.45 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.835 0.68 . . . . 1.97 112.835 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . 0.424 ' CD ' ' HZ2' ' B' ' 195' ' ' LYS 0.345 3.1 pt-20 -80.19 -22.29 42.06 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 112.746 0.647 . . . . 2.9900000000000002 112.746 179.608 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -70.61 -39.87 73.5 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 125.003 1.321 . . . . 2.8199999999999998 113.617 167.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -53.54 -40.81 65.81 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.918 1.235 . . . . 2.52 110.506 175.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -48.13 76.62 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.267 1.027 . . . . 3.8599999999999999 110.936 177.11 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -69.43 -10.93 60.16 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.725 1.009 . . . . 5.9800000000000004 113.725 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 5.8 m -105.86 7.14 32.11 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.921 1.688 . . . . 6.6399999999999997 112.221 175.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 67.9 m -84.11 6.48 22.14 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 115.167 1.543 . . . . 9.3200000000000003 115.167 -172.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 92.7 p . . . . . 0 C--O 1.248 1.02 0 C-N-CA 125.13 1.372 . . . . 11.460000000000001 113.014 -173.926 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 CA--C 1.504 -0.808 0 N-CA-C 107.104 -1.443 . . . . 11.16 107.104 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -140.33 -13.28 1.03 Allowed 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.337 1.236 . . . . 9.1899999999999995 114.337 -148.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 33.1 t 135.07 -66.5 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.501 1 C-N-CA 132.02 4.128 . . . . 5.6200000000000001 104.505 -157.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -58.88 147.18 34.8 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 124.881 1.272 . . . . 3.3199999999999998 111.148 159.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.0 p -75.13 165.75 24.73 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.185 0.594 . . . . 2.1000000000000001 111.962 -175.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -58.68 -44.98 90.39 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.445 0.698 . . . . 2.7000000000000002 110.643 173.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.87 -38.61 86.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.194 1.398 . . . . 2.21 110.134 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -73.09 -53.79 10.16 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.085 -1.01 . . . . 2.9500000000000002 110.931 -177.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.0 mmtp -54.82 -33.32 61.45 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.777 -1.202 . . . . 5.7999999999999998 112.296 168.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.95 -45.09 83.03 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 117.955 -1.022 . . . . 1.76 112.425 169.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.6 t -58.53 -38.62 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-N 120.745 1.611 . . . . 2.0099999999999998 110.458 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.7 mt -56.34 -52.95 45.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 118.042 -0.98 . . . . 2.0600000000000001 111.323 165.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -61.52 -33.93 59.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 120.759 1.618 . . . . 1.8600000000000001 114.094 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.19 -36.48 79.64 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 120.424 -1.422 . . . . 1.8700000000000001 111.124 172.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 43.9 t -74.35 -34.94 38.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 123.707 0.803 . . . . 1.95 110.855 178.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.55 -53.8 54.05 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.897 1.279 . . . . 3.4500000000000002 111.122 164.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -52.93 -28.92 25.71 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.83 1.418 . . . . 3.5499999999999998 114.83 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -81.33 -61.75 1.85 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.121 0.785 . . . . 3.6800000000000002 113.121 168.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -64.0 -29.12 70.3 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.736 0.643 . . . . 3.0099999999999998 112.736 -167.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.5 ptmt -51.36 -27.19 9.14 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.867 1.062 . . . . 3.1600000000000001 113.867 173.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -94.95 -8.97 35.44 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 115.362 1.616 . . . . 3.7999999999999998 115.362 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.7 m -99.68 -148.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 CA-C-N 120.312 1.415 . . . . 2.8900000000000001 109.606 167.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.5 m -141.69 98.34 3.32 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 119.983 -1.698 . . . . 3.9399999999999999 110.38 165.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.52 ' HE3' ' CZ ' ' A' ' 26' ' ' TYR . 49.2 tttp 66.64 -70.74 0.1 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 128.304 2.641 . . . . 6.1699999999999999 115.154 167.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.52 ' CZ ' ' HE3' ' A' ' 25' ' ' LYS . 18.0 m-85 -114.71 -63.59 1.43 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.696 1.198 . . . . 6.9100000000000001 109.095 172.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.4 m 65.5 -57.99 0.3 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 127.71 2.404 . . . . 5.0300000000000002 114.867 176.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 64.1 mt 67.71 -38.85 0.37 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 130.311 3.445 . . . . 7.1699999999999999 115.6 162.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -152.74 -33.81 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 C-N-CA 127.872 2.469 . . . . 5.0599999999999996 110.655 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -82.0 53.01 2.09 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.258 1.023 . . . . 8.6999999999999993 111.131 167.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -74.86 138.79 42.72 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.761 1.023 . . . . 9.9600000000000009 113.761 -170.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.2 tttt -90.24 -5.15 56.67 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.132 0.79 . . . . 12.109999999999999 113.132 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 15.4 tt -91.87 138.55 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 123.776 0.831 . . . . 4.1200000000000001 109.115 171.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.8 t -113.36 163.53 14.73 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.729 0.776 . . . . 2.6400000000000001 110.623 167.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -53.63 -27.66 28.44 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.385 1.074 . . . . 5.6500000000000004 113.696 168.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.9 p -72.36 -25.81 61.67 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.695 0.998 . . . . 2.6699999999999999 113.695 172.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 m -78.08 -49.1 14.59 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.805 0.842 . . . . 1.73 111.257 -175.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -48.07 -57.61 5.58 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.798 1.239 . . . . 3.4900000000000002 112.024 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 13.4 ptt85 -59.23 -15.53 15.82 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.011 1.115 . . . . 5.5800000000000001 114.011 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -109.66 -26.05 10.09 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 114.513 1.301 . . . . 3.3300000000000001 114.513 -176.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 10.5 tmm? -53.06 -45.48 68.13 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 109.003 -0.74 . . . . 2.3300000000000001 109.003 151.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.8 mt -64.1 -11.77 33.04 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.114 1.524 . . . . 1.79 115.114 172.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -101.23 -23.3 14.45 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.1 0.96 . . . . 2.3799999999999999 113.582 172.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -99.71 -41.28 7.36 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.257 1.206 . . . . 2.5499999999999998 114.257 178.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -100.95 -20.45 15.43 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.89 1.276 . . . . 3.1099999999999999 114.356 -168.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.5 mt -118.48 41.4 2.98 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.534 1.534 . . . . 3.6000000000000001 111.406 165.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -70.72 -15.94 62.74 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.648 1.351 . . . . 1.46 114.648 -172.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -94.59 -15.44 24.06 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.547 1.067 . . . . 2.48 112.542 -170.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.2 mmm -80.64 14.62 2.02 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 126.153 1.781 . . . . 3.0800000000000001 114.703 174.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.3 mp -99.01 128.37 45.13 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.758 2.023 . . . . 3.1800000000000002 111.914 -176.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -109.49 -1.94 17.98 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.722 1.209 . . . . 5.1699999999999999 112.78 169.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -177.5 170.06 2.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 129.758 3.223 . . . . 4.3200000000000003 106.387 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -31.83 -39.08 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 125.329 1.452 . . . . 3.3500000000000001 112.573 147.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.13 -41.08 52.88 Favored Glycine 0 N--CA 1.473 1.16 0 C-N-CA 128.806 3.098 . . . . 1.8200000000000001 115.608 -171.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -59.22 -41.17 88.03 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 117.874 0.837 . . . . 3.4700000000000002 110.563 172.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 74.8 mtm-85 -73.5 -36.58 65.78 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 118.169 -0.919 . . . . 5.8799999999999999 112.79 172.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.3 mtmm -54.88 -28.94 54.11 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 121.485 1.948 . . . . 6.1200000000000001 112.516 171.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.12 -19.16 60.67 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 115.592 1.701 . . . . 1.9199999999999999 115.592 170.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.87 -52.67 9.84 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.565 1.146 . . . . 1.9399999999999999 110.191 161.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -66.42 -31.33 72.02 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.984 0.914 . . . . 2.1600000000000001 112.493 -170.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.8 ptmm? -55.76 -25.0 38.63 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.302 1.223 . . . . 4.2999999999999998 114.302 166.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 12.0 mt -84.92 -43.09 14.37 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.31 1.044 . . . . 1.9299999999999999 111.379 172.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.7 mm -51.83 -39.74 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.102 1.361 . . . . 1.8600000000000001 112.12 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -69.91 -30.13 67.47 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.348 1.459 . . . . 2.23 113.899 177.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -85.66 -23.75 27.34 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.09 1.756 . . . . 4.5 112.742 175.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.14 -26.09 68.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.868 1.267 . . . . 5.0099999999999998 112.456 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -67.11 -13.25 61.76 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.485 1.914 . . . . 2.9199999999999999 114.499 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -78.69 -6.11 54.89 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.192 0.812 . . . . 4.5300000000000002 113.192 166.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -132.07 -34.54 1.26 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.78 1.232 . . . . 4.0899999999999999 114.192 -169.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.8 m170 -110.28 67.78 0.65 Allowed 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.345 -1.472 . . . . 5.3700000000000001 114.764 -165.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -74.44 67.17 1.44 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.564 1.545 . . . . 4.3200000000000003 111.996 173.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.67 -40.0 0.94 Allowed Glycine 0 CA--C 1.532 1.147 0 C-N-CA 126.285 1.898 . . . . 2.9900000000000002 113.502 -177.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -68.14 76.51 0.24 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 127.924 2.489 . . . . 9.6199999999999992 110.369 173.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.7 mm -65.58 139.01 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 O-C-N 121.425 -0.797 . . . . 3.73 109.814 171.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 t -91.92 167.27 12.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.414 1.086 . . . . 2.0800000000000001 112.864 176.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -72.72 -57.8 3.83 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.752 0.787 . . . . 3.5099999999999998 109.731 160.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.09 -35.81 62.5 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.933 2.093 . . . . 3.3700000000000001 112.946 -167.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -73.23 -22.89 60.33 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 113.722 1.008 . . . . 5.9400000000000004 113.722 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -57.01 -48.81 77.59 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 119.552 -1.968 . . . . 3.1600000000000001 110.51 166.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.7 t-105 -67.2 -41.99 84.91 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.691 -0.671 . . . . 0.88 111.502 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.62 -41.66 92.45 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 119.342 0.973 . . . . 3.98 112.049 171.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.66 -37.48 78.84 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.524 1.056 . . . . 1.8700000000000001 112.525 176.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 40.0 mm -55.06 -42.82 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 CA-C-N 120.7 1.591 . . . . 2.0499999999999998 111.802 173.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.97 -27.63 73.62 Favored Glycine 0 CA--C 1.531 1.063 0 CA-C-N 118.54 0.609 . . . . 1.05 112.588 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.25 -20.38 71.22 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 118.164 0.982 . . . . 0.77000000000000002 113.983 177.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 mp -91.74 -50.07 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.512 1.125 . . . . 2.0800000000000001 110.107 162.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.8 m -81.96 46.36 1.0 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.441 2.297 . . . . 2.4300000000000002 112.097 -171.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.59 -70.97 0.57 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 126.084 1.802 . . . . 1.1399999999999999 110.514 175.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -61.61 -45.28 18.18 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.012 2.475 . . . . 1.21 112.82 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.3 pt -73.12 -14.91 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 114.435 1.272 . . . . 1.8999999999999999 114.435 177.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.6 -40.57 83.61 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.094 0.861 . . . . 1.98 113.198 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -40.17 91.3 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 117.741 -1.584 . . . . 3.46 111.663 171.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -39.07 91.59 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 124.053 0.941 . . . . 2.6600000000000001 111.353 -175.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -53.9 -58.52 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 123.982 0.913 . . . . 2.27 110.893 166.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -63.44 -36.68 84.53 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.946 -1.096 . . . . 1.8500000000000001 113.08 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.279 2.6 pt-20 -81.29 -13.02 58.89 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.822 0.849 . . . . 3.0800000000000001 112.222 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.515 ' C ' ' H ' ' A' ' 99' ' ' GLN . 0.4 OUTLIER -72.82 -35.17 67.24 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 125.082 1.353 . . . . 2.2400000000000002 113.232 165.094 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -71.54 16.62 0.1 Allowed 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 123.935 1.826 . . . . 3.5600000000000001 111.505 168.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.515 ' H ' ' C ' ' A' ' 97' ' ' GLN . 4.2 mm-40 -130.23 -72.07 0.58 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.068 1.747 . . . . 2.6499999999999999 109.184 174.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 53.95 -2.72 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.284 1 C-N-CA 131.932 4.093 . . . . 5.4800000000000004 116.43 171.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.446 ' H ' ' C ' ' A' ' 99' ' ' GLN . 47.7 t -162.06 28.37 0.12 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.411 1.484 . . . . 6.96 110.81 -165.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 31.3 t -173.89 97.13 0.1 Allowed 'General case' 0 C--O 1.236 0.375 0 C-N-CA 126.844 2.057 . . . . 8.2200000000000006 106.019 -171.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--O 1.251 1.17 0 C-N-CA 127.875 2.47 . . . . 11.6 111.913 -178.292 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 8.2 m . . . . . 0 CA--C 1.5 -0.955 0 N-CA-C 108.412 -0.959 . . . . 11.33 108.412 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -136.88 -15.71 1.53 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 118.206 -1.398 . . . . 8.3499999999999996 113.828 -125.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 27.6 t 158.9 -55.93 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 130.189 3.396 . . . . 5.3399999999999999 106.944 -168.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -54.51 137.6 42.54 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 115.459 -0.791 . . . . 3.3599999999999999 109.923 160.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.9 p -73.17 162.88 28.9 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.138 0.427 . . . . 1.8200000000000001 110.994 -175.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -60.14 -43.93 95.32 Favored 'General case' 0 C--O 1.221 -0.431 0 O-C-N 121.359 -0.838 . . . . 2.1000000000000001 111.196 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.87 -41.75 71.2 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.48 1.512 . . . . 2.0800000000000001 110.694 175.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -72.91 -54.81 7.73 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.421 1.088 . . . . 3.04 112.249 -175.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -56.27 -26.9 53.44 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.89 1.276 . . . . 5.5 112.239 168.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.73 -40.34 48.91 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 120.451 -1.406 . . . . 2.1000000000000001 112.608 169.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 37.3 t -58.81 -30.42 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 120.924 1.693 . . . . 2.0499999999999998 110.624 171.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 70.7 mt -58.22 -57.4 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 119.448 1.022 . . . . 2.0600000000000001 110.763 164.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 41.2 t -55.26 -38.56 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 125.656 1.582 . . . . 1.8300000000000001 114.617 177.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.7 mp -66.37 -33.96 76.88 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.408 -1.432 . . . . 2.0699999999999998 111.858 174.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 52.5 t -78.45 -33.59 17.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.157 0.583 . . . . 1.8799999999999999 110.768 -178.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -56.41 -51.58 67.85 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.797 0.839 . . . . 3.6000000000000001 111.563 164.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -52.65 -29.55 26.91 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.927 1.455 . . . . 3.6000000000000001 114.927 -177.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -82.37 -60.18 2.29 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.017 0.747 . . . . 3.4399999999999999 113.017 170.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -63.11 -29.3 70.69 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 119.01 -0.519 . . . . 2.9900000000000002 112.217 -166.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -51.31 -25.44 5.88 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.931 1.292 . . . . 3.0499999999999998 114.137 172.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -98.24 -9.41 25.62 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 115.083 1.512 . . . . 3.9100000000000001 115.083 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 16.8 m -101.46 -150.16 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 CA-C-N 119.818 1.19 . . . . 2.77 109.158 166.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 66.3 m -143.66 99.97 3.51 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 119.855 -1.778 . . . . 3.8500000000000001 111.261 168.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . 0.512 ' HE3' ' CZ ' ' B' ' 129' ' ' TYR . 44.1 tttp 64.55 -80.2 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 127.461 2.305 . . . . 5.7699999999999996 114.323 168.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . 0.512 ' CZ ' ' HE3' ' B' ' 128' ' ' LYS . 19.3 m-85 -110.46 -49.74 3.03 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.074 0.949 . . . . 6.8200000000000003 111.287 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 63.4 m 63.23 -61.82 0.14 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 127.513 2.325 . . . . 4.96 115.382 170.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 62.9 mt 69.26 -48.28 0.59 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 130.603 3.561 . . . . 7.46 114.124 168.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 7.2 p -153.97 -32.36 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 127.882 2.473 . . . . 5.2800000000000002 110.971 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -77.39 67.83 3.39 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.922 0.889 . . . . 8.6899999999999995 110.887 163.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -79.26 162.98 25.31 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.16 0.984 . . . . 10.130000000000001 112.736 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -122.6 -2.76 8.85 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.28 1.032 . . . . 11.77 112.994 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 19.9 tt -89.7 132.71 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.105 0.962 . . . . 4.2599999999999998 109.754 176.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 30.2 t -94.04 149.15 21.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.6 0.714 . . . . 2.8199999999999998 110.677 166.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . 0.533 ' HZ1' ' CG ' ' B' ' 170' ' ' ASP . 57.9 pttt -52.43 -20.56 2.92 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.772 1.229 . . . . 5.3099999999999996 113.975 164.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 92.8 p -81.56 -21.31 38.55 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.354 1.242 . . . . 2.73 114.354 169.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 14.0 m -78.06 -45.4 23.65 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.916 -1.115 . . . . 1.5 111.408 -175.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -47.07 -58.36 4.09 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.625 1.17 . . . . 3.7599999999999998 111.516 178.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 18.1 ptt85 -58.57 -14.98 9.44 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.438 1.495 . . . . 5.0499999999999998 113.652 -178.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -107.86 -31.01 8.19 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 114.706 1.373 . . . . 2.8399999999999999 114.706 -178.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 7.4 tmm? -52.52 -44.42 65.72 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.651 -0.499 . . . . 2.2599999999999998 109.651 156.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.5 mt -59.9 -22.34 62.25 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.931 1.692 . . . . 1.6000000000000001 114.182 173.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -94.65 -15.2 24.18 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.411 1.084 . . . . 2.4199999999999999 112.979 177.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.17 -41.54 5.11 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.91 1.078 . . . . 2.5499999999999998 113.91 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -100.24 -15.99 17.89 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.369 1.468 . . . . 3.1099999999999999 113.899 -171.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 96.9 mt -125.38 38.33 4.2 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.296 1.839 . . . . 3.5800000000000001 111.966 166.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -69.57 -17.73 63.58 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.827 1.417 . . . . 1.3 114.827 -172.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -88.93 -0.79 57.7 Favored 'General case' 0 CA--C 1.555 1.153 0 O-C-N 120.565 -1.334 . . . . 2.2599999999999998 112.375 -171.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 4.5 mmm -101.71 12.97 36.23 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.273 2.229 . . . . 3.0899999999999999 113.447 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 9.2 mp -96.71 128.64 43.85 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.734 2.014 . . . . 3.1699999999999999 111.412 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 33.0 t -112.23 -1.75 15.1 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.117 1.367 . . . . 5.4100000000000001 112.808 169.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -178.04 170.8 1.81 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 129.751 3.22 . . . . 4.5 106.917 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 m -33.24 -40.0 0.06 Allowed 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 125.133 1.373 . . . . 3.5899999999999999 111.915 148.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.09 -42.49 39.95 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 128.394 2.902 . . . . 1.9199999999999999 115.389 -171.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -58.35 -43.56 88.38 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 117.642 0.721 . . . . 3.4500000000000002 110.78 172.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 83.2 mtm-85 -69.68 -39.52 76.92 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 118.244 -0.884 . . . . 5.8600000000000003 112.467 172.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 17.2 mtmm -54.16 -29.58 46.12 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 121.35 1.886 . . . . 6.0599999999999996 112.299 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -75.29 -19.37 59.72 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 115.282 1.586 . . . . 1.8700000000000001 115.282 171.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -76.37 -54.29 6.96 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.141 1.376 . . . . 1.8400000000000001 110.395 161.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -66.43 -31.82 72.8 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.87 0.868 . . . . 2.0099999999999998 112.394 -169.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 6.0 ptmm? -56.17 -25.56 47.22 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.774 1.028 . . . . 4.4299999999999997 113.774 167.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.6 mt -84.54 -41.78 16.15 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.216 1.007 . . . . 1.8999999999999999 111.391 174.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 20.3 mm -54.57 -43.1 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.385 1.074 . . . . 1.78 111.233 -177.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -65.09 -27.87 69.06 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.861 1.264 . . . . 2.2000000000000002 113.68 176.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -85.21 -24.22 27.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.956 1.303 . . . . 4.5199999999999996 112.782 174.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 14.2 tp -66.88 -23.85 66.05 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.596 1.158 . . . . 4.8700000000000001 112.355 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . 0.533 ' CG ' ' HZ1' ' B' ' 138' ' ' LYS . 0.8 OUTLIER -55.46 -25.08 34.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.223 2.209 . . . . 3.1400000000000001 114.326 166.974 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.2 -9.08 59.04 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.601 0.963 . . . . 4.2599999999999998 113.601 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -130.61 -33.05 1.66 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.259 1.207 . . . . 3.8599999999999999 114.259 -166.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 22.4 m170 -114.21 74.76 0.89 Allowed 'General case' 0 CA--C 1.548 0.88 0 O-C-N 120.463 -1.398 . . . . 5.1799999999999997 114.749 -168.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -82.67 76.76 9.51 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.002 0.921 . . . . 4.0599999999999996 110.824 166.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.61 -41.5 1.2 Allowed Glycine 0 N--CA 1.478 1.46 0 C-N-CA 126.518 2.009 . . . . 3.0299999999999998 114.598 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -68.52 82.83 0.27 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 128.064 2.546 . . . . 9.7899999999999991 109.967 171.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 26.6 mm -72.41 136.62 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 O-C-N 120.877 -1.14 . . . . 3.7599999999999998 109.519 171.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 8.4 t -94.06 137.67 33.0 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.457 1.103 . . . . 2.3100000000000001 111.275 170.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -50.14 -54.49 20.36 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.487 1.115 . . . . 3.6499999999999999 110.28 171.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.65 -30.67 65.59 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.813 2.045 . . . . 3.4900000000000002 112.278 -170.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -74.29 -22.93 59.06 Favored 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 113.049 0.759 . . . . 5.9100000000000001 113.049 -177.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -58.63 -47.32 84.8 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 119.503 -1.998 . . . . 3.2799999999999998 110.471 165.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 19.0 t-105 -68.59 -37.61 79.97 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.144 -0.931 . . . . 0.91000000000000003 111.724 -173.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 82.3 p -63.09 -47.09 84.35 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 119.649 1.113 . . . . 3.4399999999999999 110.689 171.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.29 -37.71 81.36 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.087 -0.959 . . . . 1.8100000000000001 112.85 -178.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 39.6 mm -54.62 -41.89 57.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 CA-C-N 120.589 1.54 . . . . 1.9199999999999999 111.467 173.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.55 -26.31 73.69 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 123.684 0.659 . . . . 1.01 112.789 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -67.52 -19.99 71.38 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-N 118.097 0.949 . . . . 0.68999999999999995 113.326 177.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.8 mp -96.71 -46.47 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 CA-C-N 118.284 1.042 . . . . 2.0099999999999998 110.132 165.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 2.9 m -81.15 39.43 0.51 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.042 2.137 . . . . 2.3500000000000001 112.351 -175.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -108.97 -70.62 0.68 Allowed Glycine 0 CA--C 1.529 0.96 0 C-N-CA 126.149 1.833 . . . . 1.23 110.174 173.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -61.02 -43.39 30.36 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.057 2.505 . . . . 1.05 113.029 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 11.1 pt -75.15 -17.56 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 114.454 1.279 . . . . 1.8999999999999999 114.454 177.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -58.36 -42.51 87.12 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.548 1.067 . . . . 1.8899999999999999 113.588 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.29 -41.62 89.41 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.979 1.263 . . . . 3.6200000000000001 111.993 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -40.22 90.78 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 123.997 0.919 . . . . 2.8399999999999999 111.714 -176.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 88.0 mt -52.85 -63.09 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.591 0.756 . . . . 2.3100000000000001 110.041 168.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -59.09 -37.19 76.54 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.292 -0.88 . . . . 1.8100000000000001 112.906 -175.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.295 2.5 pt-20 -78.02 -18.29 56.05 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 112.385 0.513 . . . . 3.21 112.385 178.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . 0.429 ' C ' ' H ' ' B' ' 202' ' ' GLN . 0.4 OUTLIER -75.99 -35.02 59.75 Favored 'General case' 0 C--N 1.344 0.334 0 C-N-CA 125.392 1.477 . . . . 2.2400000000000002 114.611 169.052 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -65.19 -1.13 2.03 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 122.801 1.286 . . . . 2.98 111.736 171.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.466 ' C ' ' H ' ' B' ' 204' ' ' SER . 1.1 mt-30 -112.89 -70.16 0.82 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.001 1.721 . . . . 3.4199999999999999 109.597 177.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 50.18 1.63 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 131.695 3.998 . . . . 5.1100000000000003 116.413 177.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 204' ' ' SER . . . . . 0.466 ' H ' ' C ' ' B' ' 202' ' ' GLN . 44.5 t -150.47 31.08 0.66 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.297 1.839 . . . . 7.0499999999999998 110.247 -169.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 27.1 t -174.83 103.41 0.09 Allowed 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 126.68 1.992 . . . . 8.4700000000000006 105.758 -174.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 17.7 t . . . . . 0 C--O 1.249 1.068 0 C-N-CA 128.395 2.678 . . . . 11.789999999999999 111.082 172.565 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.3 m . . . . . 0 CA--C 1.502 -0.883 0 N-CA-C 108.841 -0.8 . . . . 10.92 108.841 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -130.19 -12.33 4.08 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 118.722 -1.191 . . . . 6.7800000000000002 113.669 -130.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.7 t 73.09 -18.25 0.37 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 127.825 2.45 . . . . 5.3899999999999997 115.858 166.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.465 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 50.8 m-85 -32.85 100.46 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 126.686 1.994 . . . . 3.2999999999999998 115.948 -172.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.6 p -65.5 158.27 27.37 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.164 0.585 . . . . 2.0299999999999998 109.975 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -60.5 -31.05 70.12 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 117.885 -1.055 . . . . 3.73 110.908 172.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.22 -41.3 85.94 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.057 1.299 . . . . 2.1099999999999999 111.278 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -55.99 9.87 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.886 0.874 . . . . 2.9199999999999999 110.722 178.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -45.05 -43.82 9.68 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.762 1.625 . . . . 5.4900000000000002 113.593 166.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.08 -45.86 83.54 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.553 1.141 . . . . 1.49 113.088 173.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.99 -41.06 87.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 120.248 1.385 . . . . 1.8100000000000001 110.608 173.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.6 mt -53.28 -49.7 51.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-N 119.187 0.903 . . . . 2.1699999999999999 111.331 166.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.4 t -65.6 -35.86 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 119.707 1.139 . . . . 1.8 112.783 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp -65.45 -41.78 93.09 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.862 -1.149 . . . . 2.0 111.338 172.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.0 t -67.4 -43.34 87.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 125.455 1.502 . . . . 1.8300000000000001 111.917 176.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -53.69 -51.96 61.58 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 119.119 0.872 . . . . 3.23 109.835 168.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.435 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 54.4 t30 -64.13 -23.11 67.2 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.035 1.124 . . . . 2.0699999999999998 114.035 -169.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -76.24 -61.1 2.06 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.7 0.8 . . . . 3.7799999999999998 112.335 168.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -67.49 -21.84 65.49 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.984 1.105 . . . . 2.9500000000000002 113.984 -170.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.435 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 1.6 ptmt -53.69 -21.94 8.01 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.342 1.428 . . . . 2.8700000000000001 112.975 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -89.98 8.14 33.93 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.453 1.901 . . . . 3.7200000000000002 115.023 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.0 m -141.66 171.56 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.136 1.374 . . . . 3.3300000000000001 110.885 173.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.454 ' CB ' ' HG ' ' A' ' 27' ' ' SER . 0.3 OUTLIER -85.05 -8.53 58.65 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-O 115.547 -2.168 . . . . 3.8999999999999999 116.24 -177.763 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.406 ' HE3' ' HA ' ' B' ' 199' ' ' GLU . 2.3 ttpm? 123.09 -67.0 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 130.23 3.412 . . . . 6.4500000000000002 113.778 177.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -94.97 8.88 41.44 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.326 1.45 . . . . 8.9600000000000009 113.569 -176.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.454 ' HG ' ' CB ' ' A' ' 24' ' ' SER . 2.2 p -115.4 37.95 3.39 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.054 -1.654 . . . . 5.2300000000000004 115.099 -152.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.5 mt -25.36 -42.49 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 129.189 2.996 . . . . 7.2199999999999998 117.412 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.1 t -150.07 60.19 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 126.703 2.001 . . . . 5.3300000000000001 109.658 175.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -124.88 -0.49 7.93 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.272 1.429 . . . . 8.4199999999999999 114.634 175.058 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 141.96 132.71 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 1 C-N-CA 132.267 4.227 . . . . 9.2200000000000006 108.89 169.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.0 pttm -174.95 -172.54 0.62 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.312 1.445 . . . . 6.9199999999999999 111.176 -158.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 16.3 pt -86.7 -178.37 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.968 1.707 . . . . 4.5899999999999999 113.87 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.2 m -125.72 156.82 38.77 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.711 2.004 . . . . 2.9700000000000002 109.523 171.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -58.07 -21.8 47.43 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 115.343 1.609 . . . . 3.1400000000000001 115.343 -164.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.4 m -47.85 -42.25 26.05 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 121.269 -0.894 . . . . 3.0600000000000001 113.304 165.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 m -74.36 -11.6 60.3 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.534 1.309 . . . . 2.3399999999999999 114.534 -172.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -69.82 -56.71 6.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 121.045 1.748 . . . . 3.5499999999999998 111.444 165.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -61.78 -26.04 67.84 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.466 0.543 . . . . 2.8199999999999998 112.466 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -71.52 -50.59 29.86 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.671 1.189 . . . . 3.8799999999999999 110.625 170.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -59.96 -43.04 95.3 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.886 1.674 . . . . 1.8300000000000001 112.733 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 31.8 mt -50.69 -36.86 38.06 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.907 1.283 . . . . 2.0499999999999998 112.434 168.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -83.88 -20.21 33.47 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 118.108 -0.949 . . . . 2.5600000000000001 112.771 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.52 -45.57 19.04 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.68 1.582 . . . . 3.8500000000000001 112.117 166.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -90.22 -41.07 11.8 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.926 1.084 . . . . 3.4700000000000002 113.926 -167.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.4 mt -107.0 28.68 7.78 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.216 1.007 . . . . 3.5800000000000001 112.803 -170.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -67.63 23.83 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 117.059 2.244 . . . . 1.99 117.059 -171.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.445 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 0.2 OUTLIER -127.65 -42.88 1.59 Allowed 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.267 -1.521 . . . . 2.6299999999999999 111.731 -178.372 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.9 ptp -77.54 -19.97 54.91 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.667 1.187 . . . . 2.77 113.555 164.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.1 tt -99.92 104.9 16.57 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.254 1.422 . . . . 3.2799999999999998 111.046 -175.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.3 t -71.63 109.28 5.45 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.581 -0.699 . . . . 5.5499999999999998 111.3 168.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 49.79 -88.39 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.68 1.992 . . . . 7.2599999999999998 114.062 136.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.3 p -130.89 -19.91 2.87 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.439 1.495 . . . . 4.3300000000000001 112.33 167.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.64 -41.44 99.59 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 119.976 1.262 . . . . 3.2200000000000002 112.081 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -82.88 -48.98 10.14 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 117.552 0.676 . . . . 3.5499999999999998 112.345 165.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -55.13 -37.13 66.52 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.901 1.445 . . . . 5.9000000000000004 114.901 -172.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -63.84 -31.58 72.81 Favored 'General case' 0 N--CA 1.479 1.024 0 O-C-N 120.883 -1.136 . . . . 4.5 114.015 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.77 -40.19 96.08 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 122.96 0.504 . . . . 3.2200000000000002 111.653 168.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.86 98.68 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.131 0.572 . . . . 1.9399999999999999 112.291 172.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -54.67 -29.66 53.27 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.256 1.022 . . . . 2.5800000000000001 112.626 174.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -24.72 59.92 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.177 -1.577 . . . . 7.0800000000000001 114.004 175.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 15.4 mt -65.82 -43.0 89.88 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 120.523 -0.471 . . . . 2.1699999999999999 110.973 163.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.5 mm -59.61 -48.32 87.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 123.205 0.602 . . . . 1.99 110.739 -177.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -59.32 -38.13 79.53 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.092 0.473 . . . . 2.3700000000000001 112.258 178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 -65.92 -30.46 71.05 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.782 0.833 . . . . 4.29 113.071 175.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.16 -30.69 22.28 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.351 1.46 . . . . 2.9100000000000001 111.827 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -64.87 -32.38 74.06 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.441 1.496 . . . . 3.1499999999999999 113.147 166.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.0 -23.31 66.55 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.122 1.156 . . . . 2.8900000000000001 114.122 170.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -122.71 -7.84 8.5 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.839 1.792 . . . . 2.4500000000000002 115.839 -167.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.35 117.97 13.05 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.302 1.865 . . . . 4.3499999999999996 112.757 -177.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -78.6 63.63 3.44 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.908 2.483 . . . . 4.04 111.926 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.78 7.87 62.6 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.344 0.974 . . . . 3.2799999999999998 114.228 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.8 mmt85 -70.12 175.16 4.72 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.268 1.427 . . . . 6.4100000000000001 111.957 176.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 25.0 mm -140.02 150.18 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 126.191 1.797 . . . . 3.2599999999999998 106.853 161.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.7 t -127.0 165.16 19.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.536 1.534 . . . . 1.9099999999999999 111.902 169.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -67.62 -51.78 46.14 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 122.54 1.162 . . . . 3.2599999999999998 111.93 175.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -25.02 67.39 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.422 2.289 . . . . 3.3999999999999999 113.914 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.6 -59.26 5.45 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.049 1.339 . . . . 3.46 111.888 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -58.06 -42.31 85.21 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.063 -1.023 . . . . 3.8399999999999999 111.466 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 20.9 t-105 -62.33 -48.27 80.55 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.922 -0.561 . . . . 0.70999999999999996 111.767 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.1 t -69.82 -32.75 71.35 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 117.637 -1.173 . . . . 2.7799999999999998 111.718 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.9 mt -66.93 -40.94 87.76 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 117.798 -1.096 . . . . 1.8200000000000001 112.553 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 12.1 mm -50.26 -44.58 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-N 120.174 1.352 . . . . 2.0 111.688 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.05 -19.13 50.3 Favored Glycine 0 CA--C 1.539 1.545 0 CA-C-O 119.459 -0.634 . . . . 0.63 114.579 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.45 -23.29 60.84 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 118.72 1.26 . . . . 0.59999999999999998 114.013 177.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -94.98 -44.97 13.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-N 119.446 1.623 . . . . 2.1600000000000001 109.647 165.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.3 m -83.44 35.43 0.5 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.055 2.542 . . . . 2.21 112.035 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -93.59 -78.9 1.42 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 125.009 1.29 . . . . 1.55 110.761 172.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.2 -41.27 16.86 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.885 2.39 . . . . 1.3500000000000001 112.263 -176.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -70.17 -12.95 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 113.761 1.023 . . . . 2.2599999999999998 113.761 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.78 -43.66 92.54 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.343 0.974 . . . . 2.0099999999999998 111.816 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -61.45 -34.23 75.07 Favored 'General case' 0 C--O 1.221 -0.397 0 O-C-N 120.442 -1.411 . . . . 3.8900000000000001 112.291 171.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 tt -66.88 -41.08 87.85 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.924 0.89 . . . . 2.21 111.271 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.2 mt -51.37 -62.58 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-O 121.642 0.734 . . . . 1.6799999999999999 109.541 162.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -60.41 -27.77 67.73 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.113 1.153 . . . . 1.9199999999999999 114.113 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.471 ' HA ' ' HE3' ' B' ' 128' ' ' LYS 0.305 3.9 pt-20 -89.45 -9.33 50.57 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.715 1.206 . . . . 3.1600000000000001 112.769 178.664 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.495 ' C ' ' H ' ' A' ' 99' ' ' GLN . 5.5 tp-100 -89.48 -30.51 18.23 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.882 1.673 . . . . 3.5099999999999998 111.826 169.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -63.99 6.27 0.18 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 126.849 2.059 . . . . 3.2999999999999998 113.314 165.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.495 ' H ' ' C ' ' A' ' 97' ' ' GLN . 10.2 mm-40 -133.09 -77.32 0.49 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 126.153 1.781 . . . . 2.3399999999999999 110.273 -173.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 58.2 -11.56 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.986 1 C-N-CA 131.934 4.094 . . . . 5.1299999999999999 116.253 167.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.448 ' H ' ' C ' ' A' ' 99' ' ' GLN . 27.7 t -111.36 5.01 19.45 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.469 1.108 . . . . 7.5300000000000002 113.656 -162.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 30.3 t -172.69 -15.73 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.793 1.637 . . . . 9.5399999999999991 114.0 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.464 ' OXT' ' HE2' ' B' ' 128' ' ' LYS . 4.7 t . . . . . 0 C--O 1.254 1.333 0 C-N-CA 129.236 3.015 . . . . 11.039999999999999 109.19 173.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 26.6 m . . . . . 0 CA--C 1.505 -0.757 0 N-CA-C 109.174 -0.676 . . . . 10.98 109.174 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -128.56 -12.28 4.94 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 118.54 -1.264 . . . . 6.6399999999999997 113.546 -131.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 7.1 t 71.45 -17.36 0.33 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.963 2.505 . . . . 5.0499999999999998 115.806 166.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.445 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 46.5 m-85 -32.21 96.54 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.416 1.886 . . . . 3.5899999999999999 115.554 -171.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 36.0 p -64.27 157.79 25.03 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.069 0.947 . . . . 2.1299999999999999 109.871 178.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -59.59 -33.98 72.15 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-O 117.108 -1.425 . . . . 3.7200000000000002 110.952 173.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.27 -43.29 95.29 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 120.641 1.564 . . . . 2.02 111.323 176.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -57.52 5.68 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.822 0.849 . . . . 2.9500000000000002 110.598 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -42.79 -44.25 4.34 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.37 1.868 . . . . 5.4900000000000002 114.278 164.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.27 -44.75 87.03 Favored 'General case' 0 C--O 1.223 -0.337 0 O-C-N 120.821 -1.175 . . . . 1.5600000000000001 112.586 174.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.3 -42.66 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.936 1.244 . . . . 1.8600000000000001 110.506 172.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 71.0 mt -53.03 -48.03 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.344 1.058 . . . . 1.9299999999999999 110.57 168.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.3 t -66.58 -35.09 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.396 1.078 . . . . 1.8400000000000001 112.82 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -67.87 -40.0 83.66 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.567 -1.333 . . . . 2.0 111.222 173.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 29.7 t -67.91 -38.48 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 126.036 1.734 . . . . 1.8700000000000001 111.993 175.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.93 -53.05 62.57 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.153 0.981 . . . . 3.5699999999999998 110.294 167.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -66.57 -7.34 19.52 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.214 1.561 . . . . 2.1099999999999999 115.214 -177.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -87.56 -65.43 1.02 Allowed 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.367 -0.833 . . . . 3.8500000000000001 111.972 160.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -69.69 -22.31 63.43 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.921 1.452 . . . . 2.9300000000000002 114.921 -166.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 10.4 ptmt -53.78 -22.34 9.25 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 121.265 1.848 . . . . 3.0299999999999998 113.436 177.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -84.39 7.82 18.3 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.641 1.976 . . . . 3.8500000000000001 114.907 176.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 30.9 m -139.59 170.38 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.989 1.715 . . . . 3.3999999999999999 110.161 170.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.77 -23.17 59.67 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 116.703 -1.617 . . . . 3.9199999999999999 114.89 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . 0.471 ' HE3' ' HA ' ' A' ' 96' ' ' GLU . 0.4 OUTLIER 148.38 -57.93 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.24 1 C-N-CA 132.059 4.144 . . . . 6.3899999999999997 112.515 -179.645 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -110.07 8.55 24.02 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.496 1.918 . . . . 8.9399999999999995 113.224 -172.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 4.8 m -82.96 30.97 0.43 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.607 1.706 . . . . 5.5899999999999999 115.607 -156.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 62.5 mt -35.97 -52.19 0.74 Allowed 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 128.064 2.546 . . . . 7.0700000000000003 115.792 -162.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 3.9 t -139.2 59.36 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-O 123.806 1.765 . . . . 5.4000000000000004 109.175 165.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -134.11 -2.55 2.85 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.448 1.899 . . . . 8.2200000000000006 114.727 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 143.02 123.81 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.844 1 C-N-CA 132.114 4.166 . . . . 9.0899999999999999 108.857 173.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -169.03 175.25 5.88 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.79 1.636 . . . . 7.0099999999999998 109.847 -164.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 18.9 pt -76.23 -178.39 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 N-CA-C 114.821 1.415 . . . . 4.3099999999999996 114.821 173.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 71.1 m -118.33 155.08 31.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.818 1.247 . . . . 3.0099999999999998 109.867 165.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -50.92 -36.01 36.25 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.17 1.388 . . . . 3.0099999999999998 114.144 -171.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 4.9 m -52.34 -17.41 1.16 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.811 2.044 . . . . 2.4500000000000002 115.43 174.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 1.4 m -75.43 -37.33 60.48 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.502 1.121 . . . . 2.4399999999999999 112.545 175.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -58.39 -49.74 76.16 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.277 1.031 . . . . 3.2400000000000002 111.948 -175.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -55.82 -29.2 59.39 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.455 1.102 . . . . 2.7599999999999998 113.77 175.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -86.69 -44.73 11.6 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.645 1.178 . . . . 3.8799999999999999 111.365 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 2.7 tmm? -52.67 -45.77 66.92 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.182 0.593 . . . . 1.72 111.641 167.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 21.3 mt -55.51 -52.51 63.45 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.624 1.57 . . . . 2.1800000000000002 112.869 170.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -61.09 -18.48 58.15 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.7 1.2 . . . . 2.4399999999999999 113.406 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.29 -44.14 5.25 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.848 1.055 . . . . 3.0800000000000001 113.848 177.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -79.42 -38.14 35.45 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.715 1.206 . . . . 3.5899999999999999 113.626 -178.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.7 mt -111.81 28.08 9.08 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.421 0.897 . . . . 3.52 113.421 -169.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -71.09 9.71 0.68 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 116.689 2.107 . . . . 1.51 116.689 -165.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . 0.465 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 0.5 OUTLIER -108.01 -32.13 7.68 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 120.041 -1.662 . . . . 2.7200000000000002 111.851 -173.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 21.1 ptp -83.01 -27.71 30.17 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.045 1.738 . . . . 2.8100000000000001 112.473 159.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 5.5 tt -94.79 97.49 10.08 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.089 1.356 . . . . 3.3599999999999999 110.749 -176.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 30.3 t -74.64 104.36 5.29 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.99 0.9 . . . . 5.5899999999999999 110.416 167.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 54.75 -100.01 0.1 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.802 1.241 . . . . 7.8899999999999997 112.809 138.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 41.5 p -130.75 14.29 5.36 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.86 1.664 . . . . 5.04 113.766 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -86.4 -64.7 1.44 Allowed Glycine 0 N--CA 1.466 0.663 0 N-CA-C 109.876 -1.29 . . . . 3.3399999999999999 109.876 160.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -67.2 -46.34 74.19 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 118.409 -0.805 . . . . 3.77 111.753 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -59.4 -22.91 62.11 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 120.691 1.587 . . . . 5.5800000000000001 114.95 -176.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp -52.28 -38.1 57.37 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.888 1.222 . . . . 5.1600000000000001 113.118 168.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -63.88 -48.03 78.27 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.824 0.45 . . . . 2.1299999999999999 110.91 172.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -56.62 -49.37 75.16 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.523 0.601 . . . . 2.0 111.693 176.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -66.31 -33.0 74.76 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.726 0.811 . . . . 2.3900000000000001 112.351 -175.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -47.25 82.04 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.004 -1.06 . . . . 7.8099999999999996 112.894 167.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.67 -47.8 76.12 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.044 0.84 . . . . 2.4199999999999999 111.019 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 38.9 mm -50.48 -51.64 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 123.404 0.682 . . . . 2.02 110.493 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -73.73 -31.03 63.16 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.322 0.582 . . . . 3.6400000000000001 112.265 -173.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 38.2 m-20 -62.42 -27.47 69.12 Favored 'General case' 0 CA--C 1.555 1.165 0 N-CA-C 112.548 0.573 . . . . 4.8799999999999999 112.548 169.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.47 -28.76 20.63 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.999 1.72 . . . . 3.0499999999999998 111.54 177.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -63.75 -28.97 70.24 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.741 -1.224 . . . . 2.98 113.309 164.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.27 -14.07 62.72 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 114.345 1.239 . . . . 2.9300000000000002 114.345 166.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -125.71 -13.3 6.47 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 116.628 2.084 . . . . 2.4100000000000001 116.628 -170.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -139.88 122.35 16.15 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 122.057 2.208 . . . . 4.5199999999999996 113.233 -174.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -79.07 66.06 4.41 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 127.514 2.325 . . . . 4.0999999999999996 112.137 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.1 5.57 66.17 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.731 1.157 . . . . 3.3199999999999998 114.75 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt85 -68.43 178.21 2.08 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.154 1.782 . . . . 6.4500000000000002 112.415 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 21.5 mm -137.6 151.83 26.49 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 126.84 2.056 . . . . 3.46 105.461 158.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 9.8 t -132.46 164.05 27.41 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.22 1.408 . . . . 2.1000000000000001 113.277 170.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -63.91 -55.46 22.52 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 122.881 1.324 . . . . 3.52 111.359 175.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -27.27 68.13 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.606 2.363 . . . . 3.5299999999999998 113.71 178.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -57.04 -60.39 3.65 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.995 1.318 . . . . 3.3900000000000001 111.153 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -55.42 -46.45 76.67 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.234 -0.916 . . . . 3.6600000000000001 111.477 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 23.4 t-105 -62.64 -47.29 84.37 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.967 -0.54 . . . . 0.71999999999999997 111.55 -177.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.5 t -70.7 -32.18 69.32 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 117.658 -1.163 . . . . 2.7599999999999998 111.664 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 46.1 mt -67.33 -40.51 85.9 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-O 117.24 -1.362 . . . . 1.8200000000000001 112.105 175.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 13.1 mm -49.03 -46.13 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 CA-C-N 120.691 1.587 . . . . 1.8799999999999999 111.901 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -60.98 -19.6 56.77 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 123.997 0.808 . . . . 0.68999999999999995 114.381 178.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -78.12 -18.37 76.68 Favored Glycine 0 CA--C 1.531 1.077 0 CA-C-N 118.687 1.244 . . . . 0.77000000000000002 113.54 174.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -101.61 -48.17 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-N 119.482 1.641 . . . . 2.0 109.976 166.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 25.7 m -80.45 68.58 6.68 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 127.038 2.135 . . . . 2.3500000000000001 109.45 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -129.67 -83.49 0.33 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.731 1.634 . . . . 1.26 110.961 177.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -61.89 -39.29 52.54 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 122.479 2.119 . . . . 1.45 111.656 178.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.95 -11.31 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 113.461 0.911 . . . . 2.3700000000000001 113.461 177.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.12 -42.87 83.78 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.534 1.061 . . . . 1.9099999999999999 111.293 177.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -61.42 -35.42 77.5 Favored 'General case' 0 C--O 1.22 -0.475 0 O-C-N 120.508 -1.37 . . . . 4.1799999999999997 112.262 169.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.85 -43.7 95.34 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.149 0.98 . . . . 2.3999999999999999 111.165 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 78.7 mt -50.17 -62.11 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-O 121.43 0.633 . . . . 1.6699999999999999 109.824 163.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -58.67 -31.06 67.84 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.865 1.061 . . . . 2.0899999999999999 113.865 -173.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . 0.406 ' HA ' ' HE3' ' A' ' 25' ' ' LYS 0.258 3.8 pt-20 -88.7 -12.28 42.79 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.691 1.196 . . . . 3.23 112.76 -179.416 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . 0.463 ' C ' ' H ' ' B' ' 202' ' ' GLN . 6.5 tp-100 -84.28 -34.19 23.83 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.308 1.443 . . . . 3.77 111.252 169.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -63.19 2.93 0.31 Allowed 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 126.421 1.889 . . . . 3.25 113.222 166.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.463 ' H ' ' C ' ' B' ' 200' ' ' GLN . 6.6 mm-40 -128.21 -72.48 0.62 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.92 1.688 . . . . 2.75 111.21 -176.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 56.6 -8.68 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.867 1 C-N-CA 132.14 4.176 . . . . 4.9500000000000002 116.513 170.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 204' ' ' SER . . . . . 0.437 ' H ' ' C ' ' B' ' 202' ' ' GLN . 31.1 t -126.03 1.6 7.26 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.183 1.179 . . . . 7.8399999999999999 114.183 -162.004 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 38.8 t -152.58 10.88 0.5 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.919 1.288 . . . . 9.6400000000000006 112.538 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 206' ' ' SER . . . . . 0.406 ' OXT' ' HE2' ' A' ' 25' ' ' LYS . 14.0 t . . . . . 0 C--O 1.252 1.232 0 C-N-CA 130.994 3.718 . . . . 11.24 109.64 -159.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.8 m . . . . . 0 N--CA 1.472 0.655 0 CA-C-O 118.819 -0.61 . . . . 10.1 110.228 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.414 ' CG ' ' H ' ' A' ' 4' ' ' CYS . 30.2 t70 -63.38 -134.69 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.366 0 O-C-N 124.431 1.082 . . . . 5.7999999999999998 109.408 135.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.414 ' H ' ' CG ' ' A' ' 3' ' ' ASP . 60.6 m -73.53 -33.96 64.99 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.245 -1.534 . . . . 4.2999999999999998 112.021 178.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -55.23 113.75 1.51 Allowed 'General case' 0 C--O 1.241 0.607 0 C-N-CA 123.747 0.819 . . . . 4.0700000000000003 112.861 -172.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.31 153.59 40.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.771 -0.826 . . . . 2.4300000000000002 108.771 -176.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -59.81 -43.31 94.56 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-O 119.125 -0.464 . . . . 2.0899999999999999 110.891 178.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.91 -44.44 94.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.086 1.754 . . . . 3.2799999999999998 111.639 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -71.15 -53.8 13.27 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 125.837 1.655 . . . . 3.1099999999999999 110.819 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -58.55 -27.5 64.63 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.107 -0.996 . . . . 6.0999999999999996 111.828 167.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.6 -37.39 70.97 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 119.474 -2.016 . . . . 1.5700000000000001 111.72 172.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 91.4 t -60.41 -37.46 74.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.84 1.655 . . . . 1.74 110.504 167.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 13.3 mt -55.23 -54.1 28.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 CA-C-N 120.335 1.425 . . . . 1.96 112.196 165.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.4 t -58.5 -44.36 88.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 119.633 1.106 . . . . 1.79 112.951 -179.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.6 mp -63.2 -42.32 99.31 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.58 1.082 . . . . 1.96 111.393 175.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.6 t -65.34 -41.3 90.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 123.819 0.848 . . . . 1.7 110.825 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.58 -43.08 99.51 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.396 0.544 . . . . 3.1499999999999999 112.161 166.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.57 -23.76 64.9 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.704 -1.247 . . . . 3.9100000000000001 113.556 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -75.43 -72.83 0.28 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.907 0.883 . . . . 2.9900000000000002 112.455 158.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.428 ' HH ' HD23 ' A' ' 28' ' ' LEU . 42.7 m-85 -58.95 -26.65 64.6 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.39 1.626 . . . . 3.52 115.39 -167.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -47.45 -32.66 5.3 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.986 1.266 . . . . 3.6600000000000001 112.555 173.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -93.11 -19.22 21.72 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.257 1.823 . . . . 3.7000000000000002 115.219 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.1 t -88.62 51.49 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 CA-C-N 120.455 1.479 . . . . 3.3100000000000001 110.109 -168.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.5 -69.62 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.665 1.986 . . . . 4.5800000000000001 111.197 -152.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tppm? 176.03 -47.43 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 129.362 3.065 . . . . 9.4700000000000006 111.495 176.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.465 ' HH ' ' HB3' ' B' ' 202' ' ' GLN . 86.0 m-85 -111.87 10.51 20.72 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.043 1.337 . . . . 8.4000000000000004 113.105 -171.007 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.2 t -112.99 166.98 10.9 Favored 'General case' 0 N--CA 1.466 0.327 0 O-C-N 120.868 -1.145 . . . . 5.7300000000000004 112.684 -175.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.428 HD23 ' HH ' ' A' ' 20' ' ' TYR . 2.6 mt -122.23 -72.01 0.7 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 127.316 2.246 . . . . 8.7799999999999994 107.723 169.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.406 HG22 ' H ' ' A' ' 74' ' ' ILE . 6.4 p -89.59 -38.43 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 N-CA-C 114.116 1.154 . . . . 5.7199999999999998 114.116 -164.309 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -92.96 121.57 34.44 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.504 -0.747 . . . . 8.7899999999999991 110.165 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.6 m120 78.93 40.39 0.11 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 125.343 1.457 . . . . 8.5299999999999994 112.01 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.6 175.12 10.67 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.0 1.72 . . . . 8.6300000000000008 114.259 -175.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.0 pt -79.18 166.07 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 N-CA-C 116.032 1.864 . . . . 3.0600000000000001 116.032 -174.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.4 t -77.67 137.51 38.56 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.41 -1.431 . . . . 3.3999999999999999 110.068 164.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mttp -60.7 -21.86 63.34 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 121.063 -1.023 . . . . 3.4500000000000002 112.161 172.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.4 p -67.66 -32.95 73.99 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 120.492 -1.38 . . . . 2.3300000000000001 113.427 171.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.5 m -63.59 -39.68 94.99 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.593 1.088 . . . . 1.3300000000000001 111.543 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 25.9 t80 -52.1 -60.47 3.16 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.816 0.846 . . . . 3.3599999999999999 111.733 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -61.88 -28.68 69.67 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.458 0.54 . . . . 3.71 112.458 -176.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -83.79 -42.01 16.95 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.288 0.566 . . . . 2.8399999999999999 112.098 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 15.7 tmm? -58.58 -37.48 75.87 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.681 -1.262 . . . . 2.0699999999999998 111.099 170.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.6 mt -69.56 -8.03 43.65 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.302 1.593 . . . . 2.1200000000000001 115.302 167.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -92.14 -7.72 47.69 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 120.932 -1.105 . . . . 3.1000000000000001 113.405 163.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -62.84 1.51 Allowed 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.404 1.261 . . . . 2.3100000000000001 114.404 174.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -82.14 -4.61 57.32 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 119.338 -2.101 . . . . 2.6600000000000001 114.011 -168.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.86 24.81 5.0 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.802 2.041 . . . . 2.54 111.794 175.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -74.87 -26.76 59.91 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 115.418 1.636 . . . . 2.0899999999999999 115.418 -164.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 16.8 m80 -70.02 -20.54 63.26 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.472 1.487 . . . . 4.7000000000000002 111.072 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.5 tpp -70.72 3.98 2.81 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.28 1.432 . . . . 2.8799999999999999 114.323 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.1 mp -85.35 119.37 25.64 Favored 'General case' 0 C--O 1.225 -0.23 0 O-C-N 120.734 -1.229 . . . . 3.71 110.27 174.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.7 t -110.08 5.45 22.11 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 114.911 -1.041 . . . . 5.2800000000000002 112.552 175.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 t70 164.94 158.85 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 129.992 3.317 . . . . 4.9800000000000004 109.492 -177.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -25.08 -48.5 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 129.959 3.304 . . . . 4.2999999999999998 114.206 157.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.18 -33.61 75.88 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 125.545 1.545 . . . . 2.5099999999999998 113.515 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 -71.35 -23.71 61.97 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.074 0.937 . . . . 4.2999999999999998 112.929 177.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.436 ' CZ ' ' HA ' ' A' ' 56' ' ' ARG . 0.7 OUTLIER -81.39 -45.34 16.24 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-N 119.301 0.955 . . . . 8.0500000000000007 112.487 164.213 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.8 mmtm -55.24 -34.57 64.11 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.906 0.776 . . . . 4.1600000000000001 112.892 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.27 -27.58 36.11 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.442 1.275 . . . . 1.9299999999999999 114.442 172.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.38 -43.41 50.37 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 119.149 0.886 . . . . 1.95 111.62 171.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -60.45 -36.63 78.69 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.279 1.432 . . . . 2.8500000000000001 112.771 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -58.19 -30.21 66.26 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.514 0.931 . . . . 4.2300000000000004 113.514 173.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.9 mt -78.06 -42.18 33.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 118.415 -0.802 . . . . 1.8300000000000001 111.425 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.7 mm -60.73 -43.65 95.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 118.951 0.796 . . . . 2.2000000000000002 110.373 -175.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -62.09 -28.72 69.81 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.536 0.939 . . . . 2.77 113.536 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.6 m-20 -81.64 -44.63 16.92 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.283 1.433 . . . . 3.96 113.01 175.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.87 -30.19 26.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.612 1.165 . . . . 3.1299999999999999 111.703 -171.07 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -71.5 -22.93 61.73 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.914 1.079 . . . . 2.77 113.914 -177.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.55 -2.4 3.4 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 113.88 1.067 . . . . 3.0600000000000001 113.88 164.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -138.4 -173.31 3.5 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 127.514 2.326 . . . . 3.8500000000000001 110.287 -176.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 7.2 m80 55.52 45.34 25.22 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.97 1.47 . . . . 4.6699999999999999 114.97 158.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.45 ' C ' ' H ' ' A' ' 73' ' ' ARG . 0.3 OUTLIER -134.09 155.46 50.01 Favored 'General case' 0 C--O 1.232 0.158 0 O-C-N 121.378 -0.826 . . . . 6.6799999999999997 112.592 166.657 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.56 -18.9 0.41 Allowed Glycine 0 CA--C 1.538 1.515 0 CA-C-O 118.918 -0.934 . . . . 5.1900000000000004 113.392 -161.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.45 ' H ' ' C ' ' A' ' 71' ' ' ASP . 87.5 mmt-85 -141.38 149.83 41.61 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 128.359 2.664 . . . . 5.3499999999999996 110.42 172.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.406 ' H ' HG22 ' A' ' 29' ' ' VAL . 4.4 mm -138.02 148.16 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.296 1.839 . . . . 4.1399999999999997 109.83 173.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.7 m -117.39 144.44 44.96 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.148 1.779 . . . . 2.4300000000000002 108.681 177.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -59.37 -36.67 76.19 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.773 1.273 . . . . 3.1699999999999999 112.112 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.83 -20.54 65.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.512 2.725 . . . . 3.02 114.488 177.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -56.8 -58.91 6.05 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.888 1.222 . . . . 3.3199999999999998 109.888 171.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -58.79 -44.39 90.73 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.343 -0.848 . . . . 3.5499999999999998 112.035 -175.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.6 t-105 -62.07 -47.66 83.67 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 118.561 -0.733 . . . . 0.69999999999999996 112.138 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.2 t -70.3 -28.14 64.95 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.446 1.021 . . . . 2.8799999999999999 112.124 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 57.9 mt -68.04 -40.96 82.75 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 117.631 -1.176 . . . . 1.8100000000000001 111.75 172.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 25.6 mm -54.76 -42.03 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 CA-C-N 121.545 1.975 . . . . 1.76 111.977 176.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -65.38 -19.39 66.49 Favored Glycine 0 N--CA 1.472 1.041 0 C-N-CA 124.111 0.862 . . . . 0.66000000000000003 114.149 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.09 -22.29 63.62 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-N 118.307 1.054 . . . . 0.66000000000000003 113.706 177.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.1 mp -90.42 -40.82 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 118.829 1.314 . . . . 2.04 109.955 163.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.3 m -80.75 80.61 7.19 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.452 1.501 . . . . 1.78 109.074 -175.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -153.98 -75.61 0.02 OUTLIER Glycine 0 CA--C 1.532 1.132 0 C-N-CA 125.752 1.644 . . . . 1.0700000000000001 112.861 -174.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -62.37 -45.77 14.03 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.74 2.293 . . . . 1.0800000000000001 111.641 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 pt -72.87 -16.37 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 114.839 1.422 . . . . 2.6000000000000001 114.839 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -50.51 -58.53 5.56 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.792 1.633 . . . . 1.97 112.715 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -60.69 -40.23 91.4 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.112 -0.992 . . . . 3.79 112.466 176.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.3 tt -58.63 -47.15 85.35 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 124.424 1.09 . . . . 2.3100000000000001 110.579 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 42.4 mt -47.7 -58.49 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.792 1.237 . . . . 2.3799999999999999 111.117 174.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -70.55 -34.65 72.49 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.57 -0.706 . . . . 2.8999999999999999 112.099 -175.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.284 4.3 pt-20 -77.15 -24.19 51.57 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.636 -0.665 . . . . 2.9100000000000001 111.876 -175.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -59.0 -58.35 9.04 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.262 1.825 . . . . 2.1200000000000001 112.438 164.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -71.62 -12.54 61.4 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.024 0.829 . . . . 3.52 112.431 -171.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -79.4 -54.3 6.07 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.209 -0.932 . . . . 2.1600000000000001 111.146 163.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.76 -16.18 37.43 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.027 1.121 . . . . 4.75 114.027 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 29.0 t -125.06 31.29 5.65 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.594 2.357 . . . . 7.1299999999999999 111.625 171.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.7 t -71.0 0.56 7.2 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 115.255 1.576 . . . . 10.369999999999999 115.255 -176.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 41.9 t . . . . . 0 C--O 1.25 1.122 0 C-N-CA 128.866 2.866 . . . . 13.07 109.842 -174.078 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 68.9 m . . . . . 0 N--CA 1.472 0.67 0 CA-C-O 118.455 -0.783 . . . . 10.210000000000001 110.049 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -71.56 -129.61 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.259 0 O-C-N 124.815 1.322 . . . . 5.96 108.729 137.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 74.7 m -70.99 -42.69 69.32 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.222 1.374 . . . . 4.46 114.328 -173.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -57.88 123.62 16.43 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.023 -1.048 . . . . 3.4700000000000002 112.664 -174.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.17 156.61 37.18 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.712 0.805 . . . . 2.73 109.774 -173.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -63.03 -39.85 95.98 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-O 117.78 -1.105 . . . . 2.4900000000000002 111.341 175.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.16 -47.37 81.35 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.784 1.278 . . . . 2.0699999999999998 109.895 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.08 -56.1 7.78 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 126.57 1.948 . . . . 2.8399999999999999 111.593 -173.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -57.92 -29.87 65.47 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 120.75 -1.219 . . . . 5.4000000000000004 112.238 169.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.43 -40.81 77.01 Favored 'General case' 0 C--O 1.224 -0.251 0 O-C-N 119.826 -1.796 . . . . 1.54 111.992 169.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 53.2 t -59.65 -31.93 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.762 1.619 . . . . 1.8400000000000001 111.162 171.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 35.2 mt -60.78 -54.37 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 CA-C-N 119.859 1.209 . . . . 1.8899999999999999 110.872 166.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.24 -36.92 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.479 1.112 . . . . 1.73 113.268 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.83 -44.76 76.48 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.474 1.034 . . . . 1.9299999999999999 111.39 173.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.4 t -64.12 -39.44 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.947 0.899 . . . . 1.5700000000000001 111.406 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -69.9 -38.15 76.21 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.112 0.782 . . . . 3.3700000000000001 113.112 170.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -59.31 -23.07 62.14 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.582 -1.324 . . . . 3.6000000000000001 113.017 173.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -81.44 -68.82 0.66 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.671 0.788 . . . . 3.1899999999999999 112.704 163.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -60.24 -25.75 65.9 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.892 1.441 . . . . 3.4500000000000002 114.892 -168.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -47.87 -33.19 7.13 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.922 1.237 . . . . 3.71 112.925 172.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -89.47 -16.82 29.94 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.862 1.43 . . . . 3.48 114.862 177.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 5.5 t -90.25 51.25 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-O 123.235 1.493 . . . . 3.1899999999999999 109.914 -167.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.3 t 65.22 -68.0 0.12 Allowed 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 128.25 2.62 . . . . 4.7999999999999998 111.87 -164.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -178.41 -43.54 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 127.185 2.194 . . . . 9.5099999999999998 113.449 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -132.59 14.74 4.45 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.877 1.271 . . . . 8.1899999999999995 112.878 -171.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 3.1 t -108.79 175.69 5.37 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 120.693 -1.254 . . . . 5.8399999999999999 113.867 -170.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 18.5 mt -134.25 -72.17 0.49 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 127.68 2.392 . . . . 9.0199999999999996 107.095 171.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 5.2 p -94.74 -37.85 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 113.889 1.07 . . . . 5.6600000000000001 113.889 -163.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 27.9 ttpt -89.94 119.46 30.33 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.577 -0.702 . . . . 8.8100000000000005 109.494 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 14.0 m120 76.77 43.89 0.12 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.348 1.459 . . . . 8.4499999999999993 111.914 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.84 176.47 7.05 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 125.707 1.603 . . . . 8.4800000000000004 114.537 -177.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 19.7 pt -83.99 175.96 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 115.292 1.59 . . . . 3.02 115.292 -173.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 29.8 t -94.29 137.88 32.93 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.469 -1.395 . . . . 3.27 109.97 164.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 23.0 mttp -68.78 -17.07 63.97 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.732 -1.23 . . . . 3.6899999999999999 111.469 171.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 10.0 p -65.53 -27.68 68.63 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.589 -1.319 . . . . 2.2599999999999998 113.116 165.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 12.6 m -77.94 -39.29 43.2 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.364 0.984 . . . . 1.48 111.545 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . 0.412 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 47.7 t80 -47.58 -57.48 5.39 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.008 0.923 . . . . 3.46 111.171 173.125 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.3 ptt180 -62.12 -26.73 68.47 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.361 0.874 . . . . 3.71 113.361 -176.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -87.82 -43.68 11.66 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.425 1.09 . . . . 2.4399999999999999 111.941 -176.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.46 -41.41 69.45 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.393 1.477 . . . . 2.2200000000000002 111.245 170.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 71.2 mt -71.02 -4.3 24.17 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.54 1.936 . . . . 2.4900000000000002 115.183 171.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -98.92 -10.09 23.27 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.325 1.45 . . . . 2.96 112.725 165.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.19 -57.31 2.09 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.867 1.267 . . . . 2.1800000000000002 113.658 174.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -86.76 -6.03 58.94 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.505 -1.372 . . . . 2.7799999999999998 114.044 -169.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.35 14.85 8.3 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.784 2.034 . . . . 2.6499999999999999 112.618 176.029 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -66.87 -26.87 67.1 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.264 1.579 . . . . 1.9199999999999999 115.264 -163.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -70.86 -14.21 62.32 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.182 1.355 . . . . 4.5300000000000002 112.304 178.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.6 tpp -80.25 5.37 14.82 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.339 1.455 . . . . 2.9500000000000002 113.731 174.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.9 mp -91.49 132.04 36.53 Favored 'General case' 0 C--O 1.227 -0.122 0 O-C-N 120.678 -1.264 . . . . 3.3500000000000001 109.404 177.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 20.1 m -140.4 16.88 2.39 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.165 -0.959 . . . . 5.21 112.118 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 18.7 t70 172.13 158.57 0.1 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 129.4 3.08 . . . . 5.4199999999999999 109.762 173.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 3.7 m -25.2 -52.87 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 129.498 3.119 . . . . 5.0300000000000002 113.326 156.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.0 -33.5 69.25 Favored Glycine 0 CA--C 1.525 0.674 0 C-N-CA 124.817 1.199 . . . . 2.9199999999999999 113.262 -175.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -70.92 -23.83 62.33 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 118.516 1.158 . . . . 4.1299999999999999 113.516 -178.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -84.4 -50.05 8.14 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.084 0.857 . . . . 8.5299999999999994 112.62 164.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -54.33 -34.46 61.1 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 119.007 0.821 . . . . 4.0899999999999999 112.552 -178.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -53.62 -29.44 37.95 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.41 1.263 . . . . 1.8200000000000001 114.41 173.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -74.12 -40.34 62.72 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.224 0.92 . . . . 1.8600000000000001 112.274 171.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -70.13 -27.63 64.71 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.292 1.037 . . . . 1.9199999999999999 112.876 -177.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 23.4 mtmt -60.05 -27.82 67.26 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 121.138 -0.976 . . . . 4.1699999999999999 113.274 168.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 6.5 mt -78.14 -40.89 36.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.702 -0.681 . . . . 1.8 110.998 173.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 19.1 mm -61.06 -44.69 98.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 118.393 0.542 . . . . 2.3100000000000001 110.926 -178.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -61.94 -27.66 68.99 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.491 0.923 . . . . 3.0899999999999999 113.491 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 m-20 -83.2 -45.23 14.12 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.158 1.383 . . . . 3.9500000000000002 113.092 174.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.72 -31.34 12.72 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.311 1.044 . . . . 3.8799999999999999 112.673 -166.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -79.83 -8.4 59.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.703 1.201 . . . . 3.4300000000000002 112.966 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -74.97 -7.13 52.73 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.894 1.278 . . . . 3.3300000000000001 113.484 159.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -134.48 -173.41 3.28 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.439 2.296 . . . . 4.0099999999999998 110.514 -178.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 57.6 73.08 0.48 Allowed 'General case' 0 CA--C 1.552 1.034 0 CA-C-O 122.809 1.29 . . . . 4.7199999999999998 113.269 164.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . 0.472 ' C ' ' H ' ' B' ' 176' ' ' ARG . 1.1 t0 -155.81 159.23 39.23 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.791 1.237 . . . . 6.0999999999999996 110.899 172.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 69.01 -27.43 0.3 Allowed Glycine 0 CA--C 1.534 1.221 0 C-N-CA 124.381 0.991 . . . . 5.6500000000000004 112.337 -160.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . 0.472 ' H ' ' C ' ' B' ' 174' ' ' ASP . 81.9 mmt-85 -134.58 149.65 50.63 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.027 2.531 . . . . 5.6299999999999999 110.302 167.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 26.2 mm -140.3 152.24 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.893 2.077 . . . . 4.6299999999999999 107.315 172.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.4 m -117.38 144.01 45.39 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.503 1.521 . . . . 2.46 109.501 -177.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -58.91 -38.93 80.02 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 122.986 1.374 . . . . 3.0699999999999998 111.937 177.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -63.5 -20.98 66.05 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.305 2.642 . . . . 2.96 114.346 175.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -57.5 -55.48 34.21 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.919 1.236 . . . . 2.9700000000000002 109.713 171.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -55.39 -51.24 67.47 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.838 -0.539 . . . . 3.6499999999999999 111.507 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.3 t-105 -61.05 -45.58 94.19 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 118.927 -0.559 . . . . 0.68999999999999995 112.351 -178.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.7 t -72.12 -27.53 62.68 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 117.81 -1.091 . . . . 2.6200000000000001 112.343 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . 0.412 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 74.4 mt -65.21 -44.71 87.46 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.769 1.168 . . . . 1.8700000000000001 111.535 168.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 36.8 mm -52.89 -38.55 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 CA-C-N 121.578 1.99 . . . . 2.1699999999999999 113.417 -177.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.2 -18.96 67.77 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 123.928 0.775 . . . . 0.72999999999999998 113.924 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -77.7 -25.16 63.31 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 118.522 1.161 . . . . 0.81000000000000005 113.321 176.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -87.55 -43.06 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 118.44 1.12 . . . . 2.0 110.238 164.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 8.0 m -86.41 86.04 7.33 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.912 1.285 . . . . 1.8100000000000001 109.177 -170.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -160.07 -74.37 0.02 OUTLIER Glycine 0 CA--C 1.533 1.206 0 C-N-CA 126.259 1.885 . . . . 1.1000000000000001 113.18 -171.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.59 -45.59 17.19 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.917 2.411 . . . . 1.0700000000000001 111.751 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.5 pt -71.82 -19.31 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 116.874 -1.536 . . . . 2.6099999999999999 114.533 172.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -46.79 -58.91 3.43 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 121.71 2.05 . . . . 1.98 112.902 178.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.13 -40.96 87.08 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.42 -1.425 . . . . 4.1100000000000003 112.583 177.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.2 tt -61.01 -46.67 89.8 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 118.465 0.575 . . . . 2.4399999999999999 110.334 -178.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 49.7 mt -49.36 -48.21 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 126.141 1.776 . . . . 2.5699999999999998 111.903 175.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -76.72 -42.78 40.02 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.254 -0.579 . . . . 2.9100000000000001 111.601 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -76.13 -21.64 56.38 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.888 -0.508 . . . . 2.8900000000000001 111.896 -169.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -50.74 -59.76 3.75 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 126.516 1.926 . . . . 2.5499999999999998 112.888 162.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -75.56 0.75 16.3 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 122.196 0.998 . . . . 3.4199999999999999 111.631 -170.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.465 ' HB3' ' HH ' ' A' ' 26' ' ' TYR . 16.5 mm-40 -98.09 -53.91 3.23 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.715 1.606 . . . . 2.9199999999999999 110.257 165.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.93 -14.28 45.08 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.563 0.949 . . . . 5.1299999999999999 113.563 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 34.5 t -125.24 28.67 6.28 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 127.713 2.405 . . . . 6.8600000000000003 112.079 171.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 26.2 t -73.76 -2.88 25.25 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 115.4 1.63 . . . . 10.19 115.4 -176.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 44.7 t . . . . . 0 C--O 1.254 1.322 0 C-N-CA 128.751 2.82 . . . . 12.720000000000001 110.946 -176.649 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 p . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 118.968 -0.539 . . . . 12.529999999999999 110.343 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -91.4 -43.2 9.88 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.989 1.716 . . . . 8.9299999999999997 111.911 167.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.9 t 177.42 -38.35 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 129.21 3.004 . . . . 4.9500000000000002 109.577 -165.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -68.48 119.28 12.7 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 108.121 -1.066 . . . . 3.8599999999999999 108.121 162.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 70.0 p -59.6 141.18 55.5 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 118.956 0.798 . . . . 2.1000000000000001 110.751 -170.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -65.39 -21.76 66.71 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 117.992 -1.004 . . . . 3.3799999999999999 112.33 -175.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -47.92 64.69 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.019 0.827 . . . . 1.8300000000000001 110.912 169.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -69.64 -52.21 27.9 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.863 0.756 . . . . 3.1299999999999999 110.783 -178.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -44.57 -45.94 9.71 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.193 1.397 . . . . 5.2000000000000002 114.01 164.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.0 -48.07 80.4 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 118.05 -0.976 . . . . 1.52 112.321 174.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 93.8 t -58.93 -35.52 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 120.061 1.3 . . . . 1.8200000000000001 111.296 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.0 mt -54.13 -46.77 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 CA-C-N 120.066 1.303 . . . . 1.8200000000000001 112.312 165.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 53.9 t -71.62 -42.01 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 120.459 -1.4 . . . . 1.8400000000000001 112.938 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.19 -30.49 68.25 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.886 -1.134 . . . . 1.8999999999999999 111.052 174.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.3 t -73.49 -48.74 40.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-O 117.038 -1.458 . . . . 1.8400000000000001 111.799 172.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -38.54 81.97 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 121.416 1.916 . . . . 3.4100000000000001 112.949 176.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -64.88 -32.64 74.44 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.786 1.032 . . . . 2.3100000000000001 113.786 -176.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -65.63 -57.51 7.94 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.69 -0.631 . . . . 3.7200000000000002 110.713 167.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -68.97 -24.7 64.28 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.927 1.084 . . . . 2.9700000000000002 113.927 -170.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.421 ' HZ3' ' CD ' ' A' ' 45' ' ' GLU . 36.5 pttt -66.71 -24.8 66.29 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 121.27 1.85 . . . . 3.3999999999999999 112.661 168.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -100.33 10.7 40.85 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.053 1.741 . . . . 4.2000000000000002 114.433 172.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 34.1 m -140.9 -148.55 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 125.626 1.57 . . . . 3.7200000000000002 108.207 164.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.5 t 74.99 154.56 0.15 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.058 1.743 . . . . 6.5499999999999998 111.011 169.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 11.7 ttmm 72.42 -51.77 0.7 Allowed 'General case' 0 CA--C 1.557 1.228 0 N-CA-C 115.259 1.577 . . . . 7.4000000000000004 115.259 160.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -76.1 73.62 2.96 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 127.87 2.468 . . . . 13.57 111.737 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.1 t 83.61 170.19 0.09 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.352 2.261 . . . . 8.7899999999999991 112.924 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.91 -35.61 75.24 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.366 1.066 . . . . 10.220000000000001 112.514 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.3 p -165.18 -54.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 125.278 1.431 . . . . 4.29 112.072 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.8 mmmt -58.31 -19.65 36.58 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 117.031 2.234 . . . . 14.17 117.031 -163.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -117.6 12.47 14.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.48 1.112 . . . . 7.9199999999999999 113.548 -173.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -73.11 -39.23 65.95 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.506 1.299 . . . . 11.16 114.506 -172.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.5 tt -152.3 170.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 125.162 1.385 . . . . 4.4800000000000004 108.986 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.0 m -114.27 142.15 46.66 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 107.77 -1.196 . . . . 3.4500000000000002 107.77 148.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.5 mttp -63.31 -19.58 64.73 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.614 -1.304 . . . . 3.9900000000000002 113.143 -168.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 5.3 p -49.97 -20.15 0.87 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.442 2.297 . . . . 2.5299999999999998 115.877 163.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 m -92.48 -18.34 23.33 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.565 1.691 . . . . 1.96 115.565 170.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -60.47 -47.16 87.36 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 118.592 -2.567 . . . . 3.54 111.296 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -58.04 -20.77 41.64 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.91 1.684 . . . . 3.1000000000000001 114.344 170.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.65 -49.13 6.25 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 126.591 1.956 . . . . 3.7999999999999998 108.853 -171.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 1.2 tmm? -48.67 -49.89 35.56 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.413 1.485 . . . . 1.98 111.295 163.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.4 mt -59.98 -9.96 3.64 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 115.627 1.714 . . . . 2.1299999999999999 115.627 172.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -112.23 -16.87 12.9 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.551 1.54 . . . . 2.8399999999999999 112.589 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.8 -42.61 11.8 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.999 0.818 . . . . 3.9199999999999999 112.837 166.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.421 ' CD ' ' HZ3' ' A' ' 21' ' ' LYS . 22.1 mm-40 -84.76 -53.16 5.54 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.099 1.36 . . . . 3.0 111.746 -174.48 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.3 mt -96.14 39.82 1.14 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.769 1.228 . . . . 3.6499999999999999 112.334 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -76.41 -12.15 60.01 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.838 1.421 . . . . 1.5800000000000001 114.838 -169.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -88.19 -22.45 24.01 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.814 1.188 . . . . 2.2999999999999998 111.318 178.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.3 tpp -63.81 -6.87 6.44 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 128.054 2.541 . . . . 3.4399999999999999 114.336 172.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.2 mp -100.55 -179.9 4.23 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 128.393 2.677 . . . . 3.5600000000000001 113.754 -168.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.8 m -177.28 -101.19 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 129.086 2.954 . . . . 4.8300000000000001 107.148 175.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.59 17.3 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 128.202 2.601 . . . . 4.6699999999999999 115.066 -171.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.6 m 68.53 -1.85 1.8 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.425 2.29 . . . . 4.7999999999999998 111.316 -152.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.36 -47.26 69.51 Favored Glycine 0 N--CA 1.471 0.972 0 C-N-CA 125.119 1.342 . . . . 2.6600000000000001 113.874 -165.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -59.58 -51.83 68.14 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 117.699 0.749 . . . . 4.71 112.17 174.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -55.34 -28.9 56.83 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.584 1.327 . . . . 5.9400000000000004 114.584 171.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -55.18 -39.46 69.59 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 122.567 2.439 . . . . 4.6500000000000004 111.984 173.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.34 -12.06 60.97 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.078 1.51 . . . . 2.2400000000000002 115.078 174.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.26 -52.25 6.38 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.598 1.159 . . . . 2.25 112.284 163.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.92 -30.87 71.88 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.685 0.794 . . . . 2.71 111.758 -175.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.0 ptmm? -60.91 -27.4 68.16 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.999 1.111 . . . . 4.3499999999999996 113.999 171.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.3 mt -83.39 -32.49 26.15 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.227 0.611 . . . . 2.29 112.297 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.1 mm -53.6 -55.54 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.719 1.207 . . . . 2.2999999999999998 110.334 178.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -62.69 -39.4 93.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.227 1.011 . . . . 4.5999999999999996 112.531 -177.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.24 -28.97 56.99 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.775 1.23 . . . . 4.4100000000000001 113.767 171.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.5 mt -104.27 -26.4 12.5 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.763 1.394 . . . . 3.6299999999999999 114.763 177.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -66.39 -15.25 63.15 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.55 1.068 . . . . 3.6200000000000001 111.821 165.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.32 -27.32 59.22 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 115.07 1.507 . . . . 3.4700000000000002 115.07 160.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -109.62 -20.39 12.86 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.625 1.713 . . . . 2.5 115.625 -168.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -139.15 124.84 19.54 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.584 -1.322 . . . . 4.6299999999999999 113.541 -166.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -77.59 17.96 0.48 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.202 1.801 . . . . 4.7300000000000004 115.422 -170.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.76 5.28 66.69 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 124.08 0.848 . . . . 2.98 112.658 -159.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.23 134.73 57.34 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.408 1.104 . . . . 5.8099999999999996 109.204 146.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 34.8 mm -150.39 115.69 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 127.375 2.27 . . . . 3.0899999999999999 107.97 -176.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.8 t -95.8 -172.38 2.58 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.731 1.612 . . . . 3.0699999999999998 111.609 167.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -78.24 -40.45 37.23 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.474 1.11 . . . . 3.48 112.034 170.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.75 -32.28 73.73 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.847 2.459 . . . . 3.1899999999999999 112.981 -168.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -58.59 -50.97 71.85 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 124.786 1.235 . . . . 4.0800000000000001 110.49 176.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -57.41 -49.66 75.48 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.588 -0.695 . . . . 4.0999999999999996 112.489 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 14.0 t-105 -61.83 -39.73 92.82 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 118.779 0.718 . . . . 0.95999999999999996 111.778 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.0 m -59.64 -47.12 86.86 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.283 1.433 . . . . 3.1699999999999999 111.082 174.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.86 -48.57 79.92 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.123 -0.941 . . . . 2.1499999999999999 111.976 178.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.3 mm -55.09 -34.68 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 120.506 1.503 . . . . 2.23 112.84 -170.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -69.6 -21.21 76.2 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.072 0.844 . . . . 0.70999999999999996 113.753 177.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.47 -23.74 77.33 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.394 0.997 . . . . 0.73999999999999999 113.081 173.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.1 mp -89.74 -48.5 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.219 1.01 . . . . 2.48 110.344 163.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.9 m -82.7 67.2 8.66 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 126.096 1.758 . . . . 2.0 108.974 -173.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -146.69 -77.33 0.02 OUTLIER Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.596 1.569 . . . . 1.2 112.103 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -60.99 -40.66 50.43 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.545 2.83 . . . . 1.24 114.181 -170.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.7 pt -86.57 -14.91 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 119.455 1.025 . . . . 2.8199999999999998 113.146 173.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.48 -35.77 80.39 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.352 0.978 . . . . 2.5899999999999999 113.155 -172.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -55.33 -44.69 76.09 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.094 -1.004 . . . . 3.2400000000000002 112.75 167.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.6 tt -60.7 -36.57 79.13 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.247 1.019 . . . . 2.2799999999999998 111.222 -178.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.2 mt -50.39 -61.09 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 123.79 0.836 . . . . 1.96 110.151 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.1 t60 -62.16 -35.36 78.55 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.245 -0.91 . . . . 1.8999999999999999 112.846 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -70.11 -23.07 62.97 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 122.986 0.514 . . . . 3.77 111.018 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -81.05 -30.28 34.84 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.228 1.411 . . . . 2.71 113.944 171.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -67.8 3.89 1.32 Allowed 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 120.292 1.405 . . . . 2.8300000000000001 112.182 166.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -118.58 -79.89 0.6 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.705 1.602 . . . . 2.1699999999999999 111.08 170.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 56.65 3.97 0.14 Allowed 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 129.864 3.266 . . . . 5.1100000000000003 115.536 172.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 58.0 m -165.26 49.63 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.933 2.093 . . . . 6.7699999999999996 108.385 -172.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 58.5 m -141.66 8.5 1.95 Allowed 'General case' 0 N--CA 1.482 1.15 0 O-C-N 120.022 -1.674 . . . . 9.2400000000000002 114.992 173.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 C--O 1.246 0.913 0 C-N-CA 131.067 3.747 . . . . 10.81 107.963 176.844 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 72.6 m . . . . . 0 N--CA 1.474 0.734 0 CA-C-O 118.741 -0.647 . . . . 12.07 110.594 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -66.97 -133.06 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 O-C-N 124.659 1.224 . . . . 8.0399999999999991 109.743 138.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 42.2 t -77.49 -38.93 48.01 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.215 -1.553 . . . . 3.8599999999999999 112.313 -172.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.65 111.66 1.34 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.162 0.985 . . . . 4.0199999999999996 110.989 178.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 77.4 p -54.01 139.85 33.2 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.863 1.21 . . . . 2.0499999999999998 110.018 -171.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -60.41 -36.67 78.68 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-O 116.433 -1.746 . . . . 3.73 109.514 -176.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.92 -50.56 66.13 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.61 1.55 . . . . 1.8700000000000001 111.364 174.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -68.02 -50.56 54.66 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.856 0.753 . . . . 3.0 111.737 -177.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -49.72 -40.93 42.31 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.705 -1.247 . . . . 5.4800000000000004 113.831 168.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.91 -40.53 75.53 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 124.971 1.308 . . . . 1.6299999999999999 111.766 177.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 95.6 t -60.79 -42.56 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 120.018 1.281 . . . . 2.04 110.719 168.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 21.0 mt -52.46 -45.38 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 CA-C-N 120.436 1.471 . . . . 1.79 111.934 168.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 22.4 t -68.62 -38.63 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 O-C-N 120.885 -1.134 . . . . 1.6000000000000001 113.232 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -58.02 -35.41 71.23 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.979 -1.076 . . . . 2.0499999999999998 111.536 170.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 93.9 t -74.71 -44.67 46.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 117.575 -1.203 . . . . 1.96 111.042 -178.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.51 -37.94 85.55 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 120.551 1.523 . . . . 3.71 112.719 174.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -65.28 -33.24 75.52 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.833 1.049 . . . . 2.25 113.833 -176.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -66.77 -55.57 14.37 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 121.266 -0.896 . . . . 3.4900000000000002 110.843 168.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -68.55 -24.21 64.6 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.791 1.034 . . . . 2.98 113.791 -171.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . 0.408 ' HZ3' ' CD ' ' B' ' 148' ' ' GLU . 36.7 pttt -69.18 -20.77 64.0 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.925 1.693 . . . . 3.2999999999999998 113.264 168.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -98.75 -0.02 43.57 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.828 1.651 . . . . 3.8999999999999999 115.001 170.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.7 m -135.25 -145.3 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 126.118 1.767 . . . . 3.6400000000000001 109.45 171.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 3.7 t 71.63 162.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.892 1.677 . . . . 6.7199999999999998 112.413 172.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.9 ttmm 68.13 -55.6 0.5 Allowed 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 116.989 2.218 . . . . 7.21 116.989 158.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -75.59 87.75 2.7 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.916 2.487 . . . . 13.470000000000001 111.955 -174.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 9.3 t 75.62 -179.32 0.16 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.524 1.53 . . . . 8.8100000000000005 112.52 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 97.5 mt -63.75 -40.03 95.71 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.03 -1.044 . . . . 10.32 111.082 175.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 5.9 p -168.4 -55.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.503 1.297 . . . . 4.3799999999999999 114.503 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -62.05 -14.19 33.62 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.709 2.114 . . . . 14.08 116.709 -165.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -101.64 -0.81 34.07 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.442 1.497 . . . . 8.2799999999999994 112.863 -178.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -78.7 -46.32 19.3 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.997 1.48 . . . . 11.029999999999999 114.997 -164.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.3 tt -151.04 143.69 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 CA-C-N 119.113 0.87 . . . . 4.3799999999999999 110.928 -173.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 60.3 m -92.08 138.54 31.45 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.679 -0.859 . . . . 3.7400000000000002 108.679 167.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -53.86 -26.02 22.6 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 120.532 -1.355 . . . . 3.98 114.259 -175.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 20.0 p -71.23 -8.65 55.0 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.811 2.044 . . . . 2.3799999999999999 116.057 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 2.2 m -80.59 -42.7 21.83 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.988 1.267 . . . . 2.6600000000000001 112.459 -172.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -57.91 -49.06 78.03 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.661 1.184 . . . . 3.1499999999999999 112.011 -176.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -54.39 -20.69 7.88 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.162 1.171 . . . . 2.8199999999999998 114.162 173.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -105.39 -34.56 7.8 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.981 0.912 . . . . 2.4500000000000002 113.261 -173.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.6 tmm? -49.91 -49.96 47.96 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.554 1.142 . . . . 1.96 110.697 158.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 77.1 mt -57.05 -11.24 1.44 Allowed 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.813 1.783 . . . . 2.1400000000000001 115.813 168.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -106.35 -14.62 15.05 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 120.351 1.432 . . . . 2.5 112.42 177.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.96 -38.27 6.67 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.201 1.4 . . . . 2.4900000000000002 113.387 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.408 ' CD ' ' HZ3' ' B' ' 124' ' ' LYS . 42.9 mm-40 -77.68 -57.3 3.89 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.677 1.191 . . . . 3.2200000000000002 109.65 173.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.6 mt -91.95 42.3 1.1 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.26 1.024 . . . . 3.5699999999999998 111.643 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -71.76 -9.36 58.17 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.198 1.184 . . . . 2.0699999999999998 114.198 -172.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -92.98 -31.76 14.78 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.541 1.064 . . . . 2.1299999999999999 111.491 179.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 22.2 tpp -56.76 -1.73 0.07 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 128.897 2.879 . . . . 3.3399999999999999 115.933 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.7 mp -100.43 -173.98 2.54 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.638 2.375 . . . . 3.5899999999999999 114.427 -166.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 16.6 m -176.25 -104.98 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 129.824 3.25 . . . . 4.5199999999999996 107.393 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.44 12.73 0.06 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 128.068 2.547 . . . . 5.04 115.511 -171.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 67.64 13.81 9.36 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.992 1.717 . . . . 5.4299999999999997 110.444 -134.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.19 -48.01 85.88 Favored Glycine 0 N--CA 1.473 1.155 0 C-N-CA 126.089 1.804 . . . . 3.3799999999999999 115.854 -161.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -66.33 -48.65 69.59 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.611 1.205 . . . . 4.5899999999999999 111.42 174.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.0 ttt-85 -53.54 -28.22 30.32 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.664 1.357 . . . . 5.6699999999999999 114.664 175.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 55.9 mmtt -53.78 -36.17 62.11 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 122.247 2.294 . . . . 6.3799999999999999 111.535 173.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.44 -11.59 59.86 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.284 1.587 . . . . 2.1000000000000001 115.284 175.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -81.14 -51.58 8.3 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.274 1.03 . . . . 2.1899999999999999 111.616 164.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.18 -33.76 75.14 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.816 0.446 . . . . 2.6299999999999999 111.737 -173.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 7.6 ptmm? -58.11 -28.38 64.58 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.386 1.254 . . . . 4.3799999999999999 114.386 172.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 30.0 mt -79.09 -33.04 44.79 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.875 -0.516 . . . . 2.1699999999999999 112.163 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.4 mm -64.0 -52.19 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 123.686 0.794 . . . . 2.3300000000000001 109.372 -174.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -60.45 -38.01 82.8 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.828 1.251 . . . . 4.5199999999999996 112.251 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.02 -33.69 72.34 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.434 1.094 . . . . 4.1200000000000001 112.774 172.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.02 -21.57 19.66 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.193 -0.942 . . . . 4.5599999999999996 112.401 -177.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -65.21 -19.62 66.06 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.16 1.384 . . . . 2.7400000000000002 113.519 166.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -73.06 -24.17 60.65 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.012 1.115 . . . . 2.73 114.012 162.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 -116.71 -10.37 11.13 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.88 1.808 . . . . 2.2799999999999998 115.88 -165.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.51 138.11 24.58 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 121.326 1.876 . . . . 4.4900000000000002 114.76 -173.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -87.4 1.15 54.2 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.416 1.635 . . . . 4.3899999999999997 115.416 -172.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 97.27 9.84 54.99 Favored Glycine 0 CA--C 1.533 1.194 0 O-C-N 121.201 -0.937 . . . . 2.8399999999999999 112.907 -161.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.4 153.81 42.82 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 119.064 -1.054 . . . . 5.6600000000000001 109.044 131.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 36.2 mm -152.74 140.58 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 128.814 2.846 . . . . 3.48 106.32 178.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 3.7 t -106.2 167.51 9.76 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 119.849 1.204 . . . . 3.2200000000000002 112.431 163.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -57.51 -44.35 84.96 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.502 1.144 . . . . 3.5099999999999998 112.144 172.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -29.72 70.68 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.448 2.699 . . . . 3.52 112.248 -171.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.98 -46.38 81.73 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.024 0.93 . . . . 3.8300000000000001 111.024 178.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -57.57 -47.62 81.59 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.256 0.935 . . . . 3.8700000000000001 111.859 175.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.4 t-105 -60.06 -46.12 90.6 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.541 0.609 . . . . 0.93000000000000005 111.354 178.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 89.9 m -57.07 -46.09 82.76 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.968 1.307 . . . . 3.3900000000000001 110.766 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 71.9 mt -65.86 -40.67 91.89 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 117.056 -1.449 . . . . 2.1600000000000001 112.603 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 25.3 mm -53.23 -39.24 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 CA-C-N 121.02 1.736 . . . . 2.0499999999999998 112.261 -177.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.77 -18.63 62.04 Favored Glycine 0 CA--C 1.535 1.332 0 CA-C-N 119.446 1.021 . . . . 0.62 114.034 176.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -77.78 -20.75 73.14 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-N 118.721 1.26 . . . . 0.84999999999999998 113.623 175.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.1 mp -94.44 -45.29 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.394 1.078 . . . . 2.8199999999999998 110.666 166.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 23.8 m -82.16 80.01 8.5 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 125.937 1.695 . . . . 2.0 107.727 -177.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -155.9 -78.98 0.02 OUTLIER Glycine 0 CA--C 1.531 1.067 0 CA-C-O 118.656 -1.08 . . . . 1.28 113.138 -174.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.09 -40.08 35.7 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.337 2.691 . . . . 1.2 113.268 -172.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 18.9 pt -88.25 -14.69 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 N-CA-C 113.62 0.97 . . . . 2.8599999999999999 113.62 171.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -58.07 -39.56 78.81 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.926 1.239 . . . . 2.5 113.19 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -57.81 -45.61 85.85 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 120.617 -1.302 . . . . 3.5800000000000001 112.631 168.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.8 tt -59.2 -38.25 79.44 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 124.186 0.994 . . . . 2.1899999999999999 111.337 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 76.9 mt -49.59 -61.71 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 118.742 0.701 . . . . 2.0499999999999998 110.281 167.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -59.02 -34.95 72.48 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 120.928 -1.108 . . . . 2.1000000000000001 113.331 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -70.24 -26.34 63.79 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.529 0.732 . . . . 3.6499999999999999 111.204 177.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -77.4 -32.48 54.82 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 117.569 -1.205 . . . . 2.6000000000000001 113.596 172.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -70.58 5.59 1.79 Allowed 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 120.288 1.404 . . . . 2.6899999999999999 112.391 169.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.415 ' C ' ' H ' ' B' ' 204' ' ' SER . 4.3 mm-40 -114.08 -74.48 0.62 Allowed 'General case' 0 CA--C 1.534 0.335 0 O-C-N 120.223 -1.548 . . . . 2.4500000000000002 110.741 166.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.89 1.47 0.2 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 129.981 3.313 . . . . 4.96 115.759 168.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 204' ' ' SER . . . . . 0.415 ' H ' ' C ' ' B' ' 202' ' ' GLN . 28.7 m -165.86 60.15 0.11 Allowed 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 129.173 2.989 . . . . 6.8499999999999996 107.243 178.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 33.5 m -141.61 22.07 2.16 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 120.249 -1.532 . . . . 9.3100000000000005 112.751 174.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 47.1 m . . . . . 0 N--CA 1.476 0.846 1 C-N-CA 134.608 5.163 . . . . 10.859999999999999 107.127 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 106.512 -1.662 . . . . 10.949999999999999 106.512 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.22 -58.45 3.76 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 128.92 2.888 . . . . 10.039999999999999 111.199 -176.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 20.2 m 76.99 3.14 3.32 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 127.03 2.132 . . . . 4.2599999999999998 115.477 163.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 109.21 100.09 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.308 1 C-N-CA 131.911 4.084 . . . . 3.7599999999999998 106.967 -163.315 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.6 p -67.4 148.3 51.77 Favored 'General case' 0 N--CA 1.481 1.125 0 O-C-N 121.539 -0.726 . . . . 1.9199999999999999 109.804 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -64.82 -19.26 65.76 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-O 118.015 -0.993 . . . . 2.6400000000000001 113.251 176.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.39 -53.96 35.68 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 121.439 1.927 . . . . 2.1800000000000002 109.011 172.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -63.65 -52.91 58.67 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.36 1.064 . . . . 3.2799999999999998 109.666 -179.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.3 tptt -60.54 -30.64 69.88 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 120.756 -1.215 . . . . 6.9100000000000001 113.497 174.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.02 -37.81 78.86 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 119.758 -1.839 . . . . 1.55 113.076 170.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 71.8 t -56.03 -46.76 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.688 1.131 . . . . 1.7 110.062 164.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.8 mt -54.14 -52.25 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.977 1.262 . . . . 1.8400000000000001 111.683 172.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.5 t -60.36 -39.16 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.764 1.166 . . . . 1.98 112.262 -177.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mp -68.76 -34.1 75.02 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.328 -0.857 . . . . 2.1200000000000001 113.058 173.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.3 t -75.25 -42.24 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.156 0.982 . . . . 1.76 111.391 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -63.32 -37.73 88.38 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.893 0.769 . . . . 3.7200000000000002 111.572 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -55.26 -26.73 41.81 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 114.223 1.194 . . . . 2.0499999999999998 114.223 175.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -87.87 -60.14 2.05 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.292 1.037 . . . . 3.71 112.282 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -60.5 -28.45 68.38 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-O 118.824 -0.608 . . . . 2.9199999999999999 112.442 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -54.86 -19.67 7.06 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 119.888 -1.758 . . . . 3.75 114.465 172.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -93.31 10.08 33.56 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 114.933 1.457 . . . . 3.6600000000000001 114.933 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.48 ' CG1' ' H ' ' A' ' 32' ' ' LYS . 30.7 m -113.46 135.03 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 120.482 1.492 . . . . 4.1900000000000004 109.526 162.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.1 m -75.08 -42.39 56.85 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.984 1.476 . . . . 5.5999999999999996 114.984 -156.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.49 ' HZ2' ' C ' ' B' ' 206' ' ' SER . 3.6 tmtm? -174.16 -26.83 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.979 1.712 . . . . 7.6200000000000001 113.205 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -136.73 142.72 43.08 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.405 1.482 . . . . 11.07 110.643 175.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 65.7 m -120.23 135.58 54.94 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.888 0.875 . . . . 5.29 111.204 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.3 mt -88.89 32.75 0.8 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.402 1.881 . . . . 10.73 112.987 -174.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 160.34 -163.51 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.115 1 C-N-CA 135.316 5.446 . . . . 6.4199999999999999 105.623 -164.382 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HE3' ' HB2' ' A' ' 76' ' ' PHE . 2.5 mmmt -58.75 -44.08 90.46 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 119.738 -1.851 . . . . 17.289999999999999 112.479 166.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -151.03 168.31 24.98 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.995 1.725 . . . . 13.220000000000001 115.421 -175.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.48 ' H ' ' CG1' ' A' ' 23' ' ' VAL . 32.2 tttm -150.81 44.94 0.84 Allowed 'General case' 0 CA--C 1.549 0.938 0 O-C-N 120.604 -1.31 . . . . 7.0300000000000002 114.213 175.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 7.0 pt -64.7 173.24 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.722 0.809 . . . . 4.3399999999999999 111.448 165.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.0 p -111.86 148.99 32.47 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.588 -1.32 . . . . 4.6299999999999999 113.337 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.409 ' HE3' ' CG ' ' A' ' 70' ' ' HIS . 21.1 mttp -64.3 -32.24 73.76 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.624 -0.672 . . . . 3.4399999999999999 111.998 174.037 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 p -69.84 -38.84 76.64 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.508 1.123 . . . . 2.6899999999999999 113.417 179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.4 m -76.23 -34.71 59.22 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 117.831 -1.081 . . . . 1.9399999999999999 113.064 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -53.97 -52.75 59.69 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.881 1.673 . . . . 3.29 112.448 -177.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -61.42 -25.33 67.13 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.274 0.842 . . . . 2.7999999999999998 113.274 177.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -89.37 -51.2 5.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.419 1.487 . . . . 3.1800000000000002 110.293 -170.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 11.2 tmm? -48.39 -41.13 28.08 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.352 1.461 . . . . 2.27 111.965 163.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.9 mt -58.54 -32.05 68.52 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.788 1.403 . . . . 2.0 114.788 173.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -92.02 -3.34 55.95 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.587 1.54 . . . . 2.75 113.418 177.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.96 -65.22 0.99 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.356 1.063 . . . . 2.8900000000000001 111.614 164.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -75.29 -18.53 60.03 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.849 -1.157 . . . . 2.5099999999999998 112.78 -169.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.93 16.8 19.32 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.906 1.282 . . . . 3.1400000000000001 113.605 177.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -49.95 -34.49 20.87 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 114.642 1.349 . . . . 1.77 114.642 -175.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.425 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 53.9 m-70 -69.16 -21.17 64.01 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.848 1.425 . . . . 2.0 114.848 -175.566 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 52.1 mtm -114.44 -15.44 12.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.91 0.884 . . . . 3.3700000000000001 112.981 169.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 tt -74.61 68.49 1.65 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 123.294 1.521 . . . . 3.4500000000000002 110.361 163.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.4 t -94.83 -70.5 0.71 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 126.052 1.741 . . . . 3.9199999999999999 108.767 171.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -77.23 138.51 39.47 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.5 0.667 . . . . 7.0300000000000002 112.019 -165.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.2 m -50.06 -29.61 9.19 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.968 1.307 . . . . 5.1699999999999999 112.776 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.64 -48.2 85.86 Favored Glycine 0 CA--C 1.532 1.101 0 CA-C-O 118.648 -1.084 . . . . 3.4100000000000001 113.087 175.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -51.31 -60.5 3.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.559 1.143 . . . . 4.21 110.062 172.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -67.1 -37.74 84.47 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 113.57 0.952 . . . . 5.3399999999999999 113.57 -171.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.74 -40.01 88.15 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 117.581 -1.199 . . . . 5.2999999999999998 113.541 176.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -53.48 -49.4 67.56 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 127.093 2.746 . . . . 2.25 110.76 174.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.66 -54.45 33.18 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.786 1.634 . . . . 2.1600000000000001 113.15 171.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.81 -29.0 69.87 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-O 118.493 -0.765 . . . . 2.0899999999999999 112.799 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt -61.0 -33.26 72.97 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-N 121.113 1.779 . . . . 3.9199999999999999 112.742 171.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.4 mt -68.78 -38.03 79.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.55 -0.295 . . . . 1.76 110.682 -178.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 23.3 mm -56.44 -53.61 38.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 125.326 1.45 . . . . 2.3100000000000001 111.76 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -67.34 -37.23 82.94 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.157 0.983 . . . . 2.23 111.678 178.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -63.29 -33.73 76.14 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.025 0.379 . . . . 3.6499999999999999 112.025 173.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 14.0 tp -78.37 -20.57 50.97 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 120.867 -1.146 . . . . 4.9800000000000004 112.1 -177.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -56.56 -25.68 52.9 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.922 0.889 . . . . 3.4300000000000002 113.127 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.91 -2.96 49.72 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 115.656 1.724 . . . . 3.0600000000000001 115.656 172.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -130.03 19.9 5.44 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.956 1.253 . . . . 3.2799999999999998 114.154 -166.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.409 ' CG ' ' HE3' ' A' ' 35' ' ' LYS . 21.9 t60 -146.25 92.21 2.15 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.235 -1.541 . . . . 7.7999999999999998 113.643 -157.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -73.54 36.0 0.09 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 127.026 2.13 . . . . 5.0700000000000003 113.089 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.79 10.2 84.95 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 126.569 2.033 . . . . 2.8799999999999999 113.672 -169.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -107.03 158.88 16.71 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.805 2.442 . . . . 5.6799999999999997 111.12 -172.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.4 mm -130.95 138.16 54.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 108.473 -0.936 . . . . 3.02 108.473 161.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.2 t -73.46 -129.05 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 127.68 2.392 . . . . 2.8700000000000001 109.999 170.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.438 ' HB2' ' HE3' ' A' ' 30' ' ' LYS . 84.8 t80 -133.19 -44.15 0.85 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 120.143 -1.598 . . . . 3.29 110.242 164.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -64.76 -20.14 66.19 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.95 1.093 . . . . 4.54 113.95 -176.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -53.2 -56.28 17.65 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.642 1.177 . . . . 3.73 112.043 173.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -58.12 -45.79 86.71 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.283 0.947 . . . . 3.77 112.151 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.5 t-105 -65.3 -40.9 94.41 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.613 0.765 . . . . 0.75 111.981 -178.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.8 m -59.71 -46.02 90.36 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.577 1.951 . . . . 3.0499999999999998 111.676 171.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.5 mt -56.8 -42.82 80.17 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.751 0.705 . . . . 1.8999999999999999 111.639 176.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.8 mm -52.67 -40.65 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 CA-C-N 119.749 1.159 . . . . 1.7 112.582 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.54 -24.96 72.65 Favored Glycine 0 N--CA 1.476 1.329 0 C-N-CA 124.557 1.075 . . . . 0.58999999999999997 113.559 177.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -71.34 -23.22 78.31 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 121.445 -1.032 . . . . 0.57999999999999996 113.447 176.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -90.13 -45.04 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 118.616 1.208 . . . . 1.99 110.568 162.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.6 m -85.72 64.67 8.75 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 127.821 2.448 . . . . 1.6000000000000001 108.883 -172.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -144.02 -60.73 0.02 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.201 1.382 . . . . 1.25 111.742 -177.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -66.21 -72.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.991 3.127 . . . . 1.1000000000000001 110.647 165.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.4 pp -66.91 -14.11 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.483 1.038 . . . . 2.29 113.666 -170.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.0 -33.94 74.03 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.67 0.989 . . . . 2.0899999999999999 113.67 -177.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -42.15 95.09 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.871 -1.143 . . . . 3.6699999999999999 112.523 170.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.2 tt -56.52 -39.21 72.95 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 124.456 1.102 . . . . 2.3399999999999999 110.516 -173.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 22.2 mt -45.39 -62.8 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.675 1.59 . . . . 1.9299999999999999 111.837 169.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -69.31 -29.38 67.21 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.687 0.795 . . . . 1.76 112.515 -175.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.264 2.5 pt-20 -83.35 -16.89 44.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.112 0.869 . . . . 2.96 112.421 177.155 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.449 ' C ' ' H ' ' A' ' 99' ' ' GLN . 4.5 mm100 -83.32 -42.11 17.49 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 115.205 1.557 . . . . 2.3599999999999999 115.205 173.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -69.83 4.28 2.09 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 123.512 1.625 . . . . 2.3999999999999999 112.028 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.482 ' C ' ' H ' ' A' ' 101' ' ' SER . 13.8 mm-40 -125.09 -70.2 0.76 Allowed 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 127.722 2.409 . . . . 3.1299999999999999 109.7 176.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 54.33 -6.32 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.13 1 C-N-CA 132.227 4.211 . . . . 4.7000000000000002 116.055 176.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.482 ' H ' ' C ' ' A' ' 99' ' ' GLN . 22.6 t -132.04 11.19 4.65 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.936 0.894 . . . . 6.8300000000000001 113.253 -161.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.0 t -79.31 -42.36 25.92 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.417 0.895 . . . . 8.8399999999999999 113.417 176.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 17.1 t . . . . . 0 C--O 1.253 1.24 0 C-N-CA 124.298 1.039 . . . . 11.44 112.386 -149.24 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 106.431 -1.692 . . . . 10.93 106.431 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.61 -58.87 3.11 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.493 2.717 . . . . 9.8900000000000006 111.24 -174.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 15.3 m 75.72 7.82 3.76 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.848 2.059 . . . . 4.3099999999999996 115.226 163.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.425 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 17.4 m-85 102.64 101.4 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.401 1 C-N-CA 131.869 4.068 . . . . 3.8199999999999998 107.826 -162.662 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.8 p -70.2 147.62 49.6 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 118.833 0.742 . . . . 1.96 109.478 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -64.8 -18.77 65.39 Favored 'General case' 0 C--O 1.213 -0.831 0 N-CA-C 113.549 0.944 . . . . 2.9500000000000002 113.549 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.94 -54.36 27.34 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 121.072 1.76 . . . . 2.1699999999999999 108.843 172.245 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -62.84 -52.15 64.25 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.801 1.241 . . . . 3.2200000000000002 110.429 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 25.2 tptt -60.79 -29.93 69.74 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.543 0.942 . . . . 7.6500000000000004 113.543 173.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.3 -37.5 77.82 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.045 -1.659 . . . . 1.5800000000000001 112.858 170.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 91.3 t -57.61 -45.37 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-N 119.964 1.256 . . . . 1.72 109.58 166.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 6.9 mt -53.84 -53.86 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.252 0.933 . . . . 2.04 111.455 171.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 18.4 t -58.21 -42.85 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 119.532 1.06 . . . . 1.9299999999999999 111.864 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 4.4 mp -66.25 -41.82 89.42 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.296 -0.877 . . . . 2.0499999999999998 112.731 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 50.2 t -67.43 -40.88 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.85 0.86 . . . . 1.77 111.328 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 59.9 tt0 -65.44 -39.79 92.48 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 118.718 0.69 . . . . 3.7000000000000002 112.42 171.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -60.25 -19.45 54.75 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.173 1.351 . . . . 2.4399999999999999 114.123 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -91.2 -60.66 1.84 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.989 1.316 . . . . 3.3900000000000001 112.522 170.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -59.13 -27.5 65.66 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.104 0.866 . . . . 2.9700000000000002 113.135 -176.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -49.11 -19.37 0.43 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.383 1.623 . . . . 3.7799999999999998 115.383 177.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -83.55 -13.29 54.79 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 116.077 1.88 . . . . 3.5600000000000001 116.077 174.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 6.9 m -75.62 131.78 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 121.187 1.812 . . . . 5.5099999999999998 109.527 174.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 3.0 m -82.47 -32.88 28.66 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.216 1.561 . . . . 5.3300000000000001 115.216 -158.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? 169.4 -25.77 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 130.778 3.631 . . . . 8.5899999999999999 112.029 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -135.08 156.59 48.76 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.953 2.101 . . . . 11.869999999999999 110.808 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 20.2 m -140.56 128.64 22.15 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.782 -0.574 . . . . 5.2999999999999998 110.723 -165.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 36.1 mt -94.86 4.37 53.9 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.046 1.338 . . . . 10.609999999999999 113.788 -171.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 176.42 179.26 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.721 1 C-N-CA 133.015 4.526 . . . . 6.0700000000000003 106.723 -166.494 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 7.0 mmmt -55.04 -38.73 68.36 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 116.868 -1.539 . . . . 17.280000000000001 113.891 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -148.73 175.09 11.51 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.328 1.451 . . . . 13.460000000000001 111.333 166.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 51.7 tttm -154.31 61.55 0.69 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.366 -1.458 . . . . 6.7999999999999998 112.717 169.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 10.0 pt -76.59 -177.24 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.098 0.559 . . . . 4.0700000000000003 110.818 167.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 79.5 p -116.42 141.23 48.44 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.012 -1.055 . . . . 4.3399999999999999 113.08 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 11.9 mttp -53.7 -28.42 33.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.133 1.373 . . . . 3.2400000000000002 112.925 173.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 9.5 p -72.94 -34.3 66.47 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.937 1.295 . . . . 2.9700000000000002 113.982 176.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 45.4 t -82.43 -43.23 17.55 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 117.799 -1.096 . . . . 3.1600000000000001 113.335 -169.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -54.72 -48.42 72.55 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.939 1.699 . . . . 3.2400000000000002 112.566 -176.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -60.36 -27.21 67.21 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.504 0.927 . . . . 3.0699999999999998 113.504 176.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -92.94 -50.28 5.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.836 1.654 . . . . 3.1299999999999999 111.266 -170.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 10.7 tmm? -51.27 -39.84 57.61 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.724 1.21 . . . . 2.1200000000000001 111.575 167.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.0 mt -54.47 -36.99 64.7 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.481 1.289 . . . . 2.2599999999999998 114.481 174.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.84 -4.8 59.22 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.926 1.239 . . . . 2.6800000000000002 113.467 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.28 -61.21 1.56 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.227 1.011 . . . . 2.7799999999999998 111.505 163.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.27 -18.22 46.68 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.878 1.671 . . . . 2.7400000000000002 112.775 -164.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.25 20.56 13.1 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 126.319 1.848 . . . . 3.0600000000000001 113.147 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -51.8 -33.04 33.82 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.946 1.462 . . . . 1.6599999999999999 114.946 -173.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -69.24 -26.34 64.74 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.826 1.047 . . . . 2.04 113.826 -174.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 53.3 mtm -109.71 -14.47 14.33 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.026 0.93 . . . . 3.5299999999999998 112.702 171.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.09 65.0 1.09 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 122.919 1.342 . . . . 3.2400000000000002 111.037 163.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 3.5 t -88.63 -67.47 0.83 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.245 -1.343 . . . . 3.9900000000000002 108.853 170.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -80.79 139.23 36.15 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.61 0.719 . . . . 7.2599999999999998 112.185 -161.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 51.1 m -49.13 -31.99 9.16 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.867 1.267 . . . . 5.1799999999999997 112.303 173.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.58 -50.72 64.45 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.855 -0.97 . . . . 3.4700000000000002 112.802 176.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -49.31 -60.92 2.4 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.539 1.136 . . . . 4.2599999999999998 110.634 171.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -69.58 -35.74 75.63 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.716 1.006 . . . . 5.2300000000000004 113.716 -170.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.0 -40.17 90.9 Favored 'General case' 0 CA--C 1.511 -0.542 0 O-C-N 120.454 -1.404 . . . . 5.3399999999999999 112.946 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -50.47 -51.45 46.9 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 126.593 2.433 . . . . 2.2400000000000002 110.551 174.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -48.9 -56.43 8.82 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.144 0.978 . . . . 1.74 112.554 173.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.48 -34.61 71.09 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.868 0.867 . . . . 1.8999999999999999 112.738 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -59.82 -34.13 72.67 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 120.628 1.558 . . . . 4.0099999999999998 113.231 172.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.2 mt -68.93 -34.0 74.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.35 -0.387 . . . . 1.8400000000000001 111.55 -178.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 23.3 mm -64.31 -48.7 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 123.515 0.726 . . . . 1.99 110.876 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -68.77 -34.83 76.23 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.413 1.085 . . . . 2.2000000000000002 112.059 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 28.8 m-20 -62.33 -43.19 99.41 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 120.569 0.223 . . . . 3.8300000000000001 111.343 169.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 12.4 tp -67.34 -19.97 65.52 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 120.865 -1.147 . . . . 4.75 112.671 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.35 -26.3 64.94 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.77 0.656 . . . . 3.7400000000000002 112.77 176.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.76 -5.11 56.7 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.318 1.599 . . . . 3.1400000000000001 115.318 171.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -120.39 12.88 11.76 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.049 1.34 . . . . 3.2200000000000002 114.103 -167.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -143.35 90.57 2.18 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 120.377 -1.452 . . . . 7.7300000000000004 114.196 -153.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -72.58 39.39 0.08 Allowed 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 126.446 1.898 . . . . 5.2800000000000002 113.207 173.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 69.73 6.34 55.07 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 125.99 1.757 . . . . 2.5600000000000001 114.103 -171.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -96.64 163.23 13.11 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.602 1.961 . . . . 5.3700000000000001 110.875 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 19.2 mm -129.32 143.82 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 107.769 -1.197 . . . . 3.1600000000000001 107.769 157.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 22.1 t -75.2 -138.18 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.953 2.101 . . . . 2.54 110.728 171.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -125.14 -46.26 1.81 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 119.865 -1.772 . . . . 3.23 110.514 161.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -62.04 -19.89 63.37 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.44 1.274 . . . . 4.46 114.44 -178.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -52.15 -52.86 49.14 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.275 1.03 . . . . 3.4199999999999999 111.996 172.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -62.62 -45.53 92.44 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.917 -1.114 . . . . 4.5300000000000002 111.554 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.0 t-105 -62.43 -44.64 95.94 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.517 0.727 . . . . 0.81000000000000005 112.306 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 58.4 m -55.68 -50.9 69.03 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.778 1.631 . . . . 3.0 110.956 170.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 81.9 mt -60.35 -33.23 72.12 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.194 -0.908 . . . . 1.79 112.967 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 29.3 mm -55.49 -42.47 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 CA-C-N 120.564 1.529 . . . . 1.95 111.807 174.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.37 -24.72 73.68 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.745 1.164 . . . . 0.64000000000000001 113.651 178.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.02 -19.77 77.38 Favored Glycine 0 CA--C 1.536 1.353 0 O-C-N 121.269 -1.136 . . . . 0.68999999999999995 113.566 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 5.0 mp -93.74 -47.37 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 118.421 1.111 . . . . 1.8899999999999999 110.63 160.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.4 m -83.63 62.73 7.02 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 128.425 2.69 . . . . 1.6399999999999999 109.174 -173.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -142.29 -60.77 0.03 OUTLIER Glycine 0 CA--C 1.528 0.9 0 C-N-CA 125.695 1.617 . . . . 1.23 111.301 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -64.3 -73.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 124.146 3.23 . . . . 1.2 111.048 165.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.4 pp -66.37 -14.58 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 119.708 1.14 . . . . 2.3199999999999998 113.805 -169.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.63 -32.49 73.53 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.639 1.176 . . . . 2.1800000000000002 114.08 -176.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -44.93 91.43 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.603 -1.311 . . . . 3.7799999999999998 112.537 168.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.1 tt -57.48 -36.51 71.58 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.414 1.086 . . . . 2.4100000000000001 111.325 -172.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 29.2 mt -45.44 -63.05 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.872 1.669 . . . . 1.9399999999999999 110.997 170.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -65.63 -35.4 80.7 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.607 0.763 . . . . 1.8100000000000001 111.91 -176.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.297 2.2 pt-20 -76.91 -20.25 56.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.544 1.066 . . . . 3.0800000000000001 112.51 177.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . 0.448 ' C ' ' H ' ' B' ' 202' ' ' GLN . 5.2 mm100 -80.76 -42.75 21.28 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 115.329 1.604 . . . . 2.4700000000000002 115.329 174.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -70.44 6.18 1.49 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 123.609 1.671 . . . . 2.5 112.385 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.472 ' C ' ' H ' ' B' ' 204' ' ' SER . 12.1 mm-40 -125.36 -68.44 0.84 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.506 2.322 . . . . 3.0 110.407 176.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.295 11.3 pt20 53.34 -4.41 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.879 1 C-N-CA 131.944 4.097 . . . . 4.5599999999999996 115.681 -177.79 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 204' ' ' SER . . . . . 0.472 ' H ' ' C ' ' B' ' 202' ' ' GLN . 28.0 t -112.79 18.21 18.41 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.508 1.923 . . . . 7.5899999999999999 112.657 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 3.9 t -70.61 -35.93 73.25 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.955 1.465 . . . . 9.3399999999999999 114.955 -173.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 206' ' ' SER . . . . . 0.49 ' C ' ' HZ2' ' A' ' 25' ' ' LYS . 36.5 t . . . . . 0 C--O 1.249 1.074 0 C-N-CA 122.569 0.348 . . . . 12.109999999999999 110.687 -148.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.474 0.769 0 N-CA-C 108.999 -0.741 . . . . 10.33 108.999 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.03 -14.44 1.57 Allowed 'General case' 0 N--CA 1.471 0.618 0 O-C-N 124.841 1.338 . . . . 6.0599999999999996 113.944 -133.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 73.2 m 72.67 0.98 3.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 127.956 2.503 . . . . 6.2199999999999998 115.687 168.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -36.5 109.96 0.1 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 127.738 2.415 . . . . 3.6800000000000002 113.946 -177.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.8 p -73.14 154.23 40.42 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.107 0.563 . . . . 2.5800000000000001 111.451 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.34 2.11 8.21 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.259 1.023 . . . . 2.6200000000000001 113.1 169.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.11 -56.33 4.16 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.598 -1.314 . . . . 2.0 109.306 158.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -76.94 -50.51 13.07 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 120.854 -1.154 . . . . 2.73 112.837 -168.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.0 tmtt? -58.38 -24.86 61.17 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.209 -0.932 . . . . 5.9800000000000004 111.494 169.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.31 -43.23 57.58 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 119.662 -1.899 . . . . 1.73 112.721 168.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 77.0 t -55.29 -35.65 37.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 CA-C-N 120.612 1.551 . . . . 1.8899999999999999 111.258 169.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 38.2 mt -53.88 -58.9 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.026 0.83 . . . . 2.2000000000000002 111.081 165.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 49.2 t -61.37 -40.16 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.28 1.032 . . . . 2.1899999999999999 113.424 -177.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.7 mp -65.26 -40.06 93.46 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.522 1.056 . . . . 2.0499999999999998 111.843 177.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.0 t -63.84 -43.8 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-O 118.747 -0.644 . . . . 1.6699999999999999 110.605 171.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.46 -43.53 75.57 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.695 0.68 . . . . 3.6499999999999999 111.51 173.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.75 -15.87 63.85 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.979 1.474 . . . . 2.3900000000000001 114.979 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -86.3 -53.41 5.04 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.109 -0.994 . . . . 3.5800000000000001 111.306 167.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -60.61 -39.41 88.05 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.804 0.668 . . . . 3.1800000000000002 112.804 -175.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -19.76 65.06 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 114.981 1.475 . . . . 4.4400000000000004 114.981 173.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -95.44 -28.98 14.65 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.695 1.198 . . . . 4.0 112.603 172.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.6 t -61.26 -39.13 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 118.974 0.806 . . . . 3.48 110.771 165.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.2 p 153.96 -96.29 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 130.597 3.559 . . . . 5.1600000000000001 108.727 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -165.78 26.03 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.427 1.091 . . . . 7.6399999999999997 113.128 -173.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -149.46 -118.03 0.05 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.717 1.207 . . . . 8.8399999999999999 110.969 -165.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.7 t -173.15 -164.74 0.25 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.521 1.928 . . . . 8.1099999999999994 108.945 178.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 60.3 mt 66.09 -26.71 0.11 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 129.118 2.967 . . . . 7.71 114.396 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 91.6 t 110.57 -59.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.211 1 C-N-CA 133.878 4.871 . . . . 6.6799999999999997 108.698 168.281 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt 67.83 -21.61 0.12 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 126.934 2.094 . . . . 8.75 115.578 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -140.73 135.62 31.74 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.673 1.189 . . . . 7.2300000000000004 110.7 177.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -76.74 73.23 3.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.729 0.812 . . . . 10.369999999999999 111.67 173.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.4 pt -59.62 128.26 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 O-C-N 121.264 -0.898 . . . . 3.9300000000000002 108.995 177.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.7 m -60.14 136.64 58.08 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.24 0.829 . . . . 3.0600000000000001 113.24 -166.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -55.75 -31.85 62.9 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 120.877 -1.14 . . . . 6.0199999999999996 113.518 176.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.72 -30.86 14.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.774 1.63 . . . . 3.23 113.151 169.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.9 m -77.58 -36.29 52.12 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.985 -1.072 . . . . 1.9099999999999999 112.622 -174.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -53.01 -56.19 17.95 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.283 0.947 . . . . 3.0899999999999999 111.023 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 13.9 ptt85 -61.62 -8.39 4.42 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.844 1.258 . . . . 4.0199999999999996 113.966 -178.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -117.0 -32.79 4.94 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.943 1.297 . . . . 4.2199999999999998 113.715 -174.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 5.6 tmm? -50.97 -42.98 60.41 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.873 0.76 . . . . 1.95 109.399 150.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.1 mt -62.68 -19.02 63.44 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 115.502 1.668 . . . . 2.2999999999999998 115.502 169.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -91.57 -35.5 14.23 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 119.714 1.143 . . . . 2.6499999999999999 112.106 172.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -81.27 -50.98 8.88 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.042 0.837 . . . . 2.7799999999999998 112.271 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -78.46 -30.58 47.49 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.907 0.776 . . . . 2.6800000000000002 111.769 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.16 19.41 20.64 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.055 1.342 . . . . 2.3900000000000001 113.763 -177.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -48.09 -35.38 11.25 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.143 1.777 . . . . 1.4299999999999999 115.228 -173.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.466 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 7.4 m-70 -65.21 -21.11 66.71 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.437 1.495 . . . . 2.3500000000000001 114.588 -178.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 39.4 ttm -95.22 10.52 35.71 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.462 1.505 . . . . 3.1099999999999999 114.325 -169.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.7 mp -81.11 169.81 16.96 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.818 1.247 . . . . 3.54 112.489 178.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.3 m -157.12 36.35 0.29 Allowed 'General case' 0 N--CA 1.476 0.838 0 O-C-N 119.843 -1.786 . . . . 4.4400000000000004 110.386 -164.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.498 ' CG ' ' H ' ' A' ' 53' ' ' THR . 19.6 t70 92.71 -175.06 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 129.592 3.157 . . . . 4.0599999999999996 107.865 -146.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.498 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 52.8 p -66.38 -12.76 58.69 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.971 1.708 . . . . 3.96 114.764 170.018 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.46 -30.72 42.12 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 125.668 1.604 . . . . 1.79 114.644 -171.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -69.24 -45.55 69.52 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.483 1.513 . . . . 3.23 110.65 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.9 ttt-85 -65.74 -47.33 75.66 Favored 'General case' 0 C--N 1.346 0.448 0 O-C-N 121.461 -0.774 . . . . 6.0300000000000002 110.039 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.8 mmtt -55.94 -29.04 59.51 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.09 0.774 . . . . 4.9100000000000001 113.09 175.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.86 -39.27 69.79 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 117.759 -1.115 . . . . 1.79 112.305 171.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.62 -44.37 93.48 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.386 1.075 . . . . 2.02 111.969 172.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -53.01 -37.57 61.6 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.376 1.07 . . . . 2.2599999999999998 112.731 175.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -61.3 -34.53 75.37 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 120.195 -1.565 . . . . 4.6699999999999999 112.797 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.4 mt -74.5 -38.2 62.93 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.04 1.336 . . . . 2.04 111.852 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.8 mm -49.56 -59.18 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 117.726 -1.13 . . . . 2.2400000000000002 109.595 170.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -62.51 -36.15 81.66 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 119.603 1.092 . . . . 3.3599999999999999 113.091 -174.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -62.71 -34.48 77.23 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.859 1.263 . . . . 3.5 113.009 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -86.36 -44.85 11.74 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.368 1.067 . . . . 4.0300000000000002 112.266 176.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -62.43 -38.76 90.97 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.281 1.433 . . . . 2.54 111.724 -168.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.78 -18.72 13.71 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.66 1.184 . . . . 2.9100000000000001 114.117 171.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -113.43 -0.54 14.44 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.082 1.753 . . . . 3.1099999999999999 113.099 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -135.24 128.77 32.54 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 120.964 1.711 . . . . 4.8700000000000001 112.042 -163.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -79.49 46.56 0.76 Allowed 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 122.599 1.19 . . . . 4.8200000000000003 112.042 -175.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 59.45 2.24 1.5 Allowed Glycine 0 CA--C 1.538 1.489 0 C-N-CA 125.24 1.4 . . . . 4.1100000000000003 113.043 -157.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -79.06 100.63 7.44 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 120.609 -1.524 . . . . 8.6999999999999993 110.977 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.5 pt -69.58 166.4 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.965 1.706 . . . . 4.3300000000000001 112.976 162.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 64.2 m -141.87 169.36 17.74 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.451 1.5 . . . . 3.2000000000000002 110.973 166.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -52.62 -55.74 20.25 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.31 1.053 . . . . 3.2400000000000002 111.927 179.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.02 -37.82 64.49 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 128.733 2.813 . . . . 2.98 111.785 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -74.77 -46.98 33.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.588 1.155 . . . . 3.6800000000000002 110.603 -171.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -51.12 -54.09 28.28 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.725 0.693 . . . . 2.9100000000000001 111.002 167.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 22.6 t-105 -62.78 -46.87 86.01 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 118.375 0.534 . . . . 0.62 111.873 -171.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 39.1 p -61.31 -43.49 98.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 117.785 -1.102 . . . . 4.0999999999999996 111.549 178.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 23.8 mt -56.44 -36.88 69.51 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.173 -0.918 . . . . 2.1200000000000001 113.231 175.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.1 mm -51.07 -36.52 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-N 120.127 1.33 . . . . 1.97 111.232 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.49 -19.65 76.42 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.479 1.037 . . . . 0.68000000000000005 114.646 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.11 -11.84 84.96 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 119.083 1.441 . . . . 0.73999999999999999 113.44 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.8 mp -105.0 -45.71 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.041 1.336 . . . . 1.9399999999999999 110.263 165.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.7 m -80.71 88.18 5.79 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 126.582 1.953 . . . . 1.74 107.782 178.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -172.22 -77.6 0.05 OUTLIER Glycine 0 CA--C 1.528 0.856 0 CA-C-O 118.384 -1.231 . . . . 1.29 112.602 -170.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -59.71 -41.53 54.61 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.417 2.745 . . . . 1.1000000000000001 112.756 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.8 pt -77.39 -11.39 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 114.216 1.191 . . . . 2.2200000000000002 114.216 174.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.16 -32.63 74.07 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 113.936 1.087 . . . . 2.2400000000000002 113.936 -166.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -43.68 97.57 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.856 -1.153 . . . . 4.1799999999999997 111.963 169.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.5 tt -61.43 -37.82 84.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.892 1.277 . . . . 2.5299999999999998 110.875 -169.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 97.3 mt -50.06 -67.14 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.29 1.436 . . . . 2.04 110.97 168.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -59.7 -29.83 68.38 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.598 -1.314 . . . . 1.78 112.998 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.24 -29.68 65.41 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.944 0.898 . . . . 3.54 111.781 174.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.437 ' C ' ' H ' ' A' ' 99' ' ' GLN . 6.4 tp-100 -77.81 -37.96 47.48 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.782 2.033 . . . . 4.9400000000000004 110.984 179.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -63.01 4.1 0.2 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 123.483 1.611 . . . . 2.5899999999999999 113.331 171.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.437 ' H ' ' C ' ' A' ' 97' ' ' GLN . 34.8 mm-40 -115.91 -70.19 0.81 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.301 1.44 . . . . 3.0 110.925 169.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -75.22 -5.23 43.43 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 114.848 -1.069 . . . . 6.2300000000000004 112.868 -163.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.2 m 58.16 23.93 10.78 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 127.39 2.276 . . . . 8.5800000000000001 112.621 166.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.3 t 82.64 14.53 0.43 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 128.392 2.677 . . . . 13.15 115.797 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.6 t . . . . . 0 C--O 1.25 1.108 0 CA-C-O 116.987 -1.482 . . . . 10.82 110.977 145.4 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 CA--C 1.505 -0.781 0 N-CA-C 109.16 -0.681 . . . . 10.619999999999999 109.16 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -134.54 -14.9 2.18 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 124.781 1.301 . . . . 5.8700000000000001 113.675 -133.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 73.2 m 70.46 2.25 3.98 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.689 2.396 . . . . 5.6399999999999997 116.425 165.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -32.19 101.57 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 127.922 2.489 . . . . 3.5099999999999998 113.555 -177.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 20.7 p -67.98 154.8 40.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 122.608 0.363 . . . . 2.27 110.105 -175.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -57.92 -38.39 75.81 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-O 118.322 -0.846 . . . . 2.4900000000000002 111.471 174.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.1 -53.52 49.18 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.523 1.056 . . . . 1.73 110.67 173.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 12.1 tm-20 -74.64 -47.4 32.28 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.613 -0.68 . . . . 2.8399999999999999 111.769 -170.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -60.95 -28.1 68.72 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.873 0.869 . . . . 5.5 111.908 171.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.38 -41.43 73.07 Favored 'General case' 0 C--O 1.222 -0.39 0 O-C-N 119.559 -1.963 . . . . 1.6599999999999999 112.565 166.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 64.3 t -59.71 -37.04 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 120.572 1.533 . . . . 1.8500000000000001 110.698 171.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 26.2 mt -53.41 -59.17 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 118.913 0.778 . . . . 1.8700000000000001 111.166 164.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 44.3 t -61.45 -40.83 87.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-N 119.342 0.973 . . . . 1.8 113.307 -175.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.7 mp -63.18 -45.47 91.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.593 1.157 . . . . 2.0 111.68 174.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 44.5 t -57.16 -46.45 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-O 118.794 -0.622 . . . . 1.8999999999999999 110.302 173.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.1 -44.77 75.23 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 118.849 0.749 . . . . 3.46 111.391 173.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . 0.414 HD22 ' HG3' ' B' ' 148' ' ' GLU . 0.3 OUTLIER -67.36 -15.67 63.81 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.933 1.457 . . . . 2.25 114.933 -179.332 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -85.04 -58.19 2.79 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.442 -0.786 . . . . 3.8100000000000001 111.151 166.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -57.74 -38.47 75.39 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.133 0.79 . . . . 3.1200000000000001 113.133 -175.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -19.59 65.98 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.534 1.309 . . . . 4.3899999999999997 114.534 175.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -92.86 -32.58 14.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.509 1.123 . . . . 3.8100000000000001 112.337 169.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 97.7 t -55.98 -38.47 52.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 CA-C-N 119.348 0.976 . . . . 3.3500000000000001 111.043 167.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 14.8 p 150.26 -94.43 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 131.0 3.72 . . . . 5.1500000000000004 108.537 176.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 9.0 tttt -166.25 30.41 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.889 1.676 . . . . 6.96 111.911 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -150.03 -114.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.125 1.37 . . . . 8.5600000000000005 111.461 -164.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 15.8 t -176.02 -164.26 0.12 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.675 1.99 . . . . 8.5399999999999991 109.429 -177.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 78.9 mt 65.18 -28.4 0.11 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 129.592 3.157 . . . . 7.6100000000000003 115.582 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 73.3 t 111.53 -65.74 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.182 1 C-N-CA 133.833 4.853 . . . . 6.6900000000000004 107.835 177.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt 72.35 -38.07 0.41 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.716 2.406 . . . . 8.8399999999999999 114.542 173.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -121.74 134.48 54.94 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.709 1.603 . . . . 7.2599999999999998 109.577 172.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -74.7 67.09 1.54 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.067 0.947 . . . . 10.5 112.203 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 3.8 pt -59.55 127.25 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.752 -0.592 . . . . 4.0199999999999996 109.56 -175.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 2.9 m -59.53 138.86 57.56 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.995 1.109 . . . . 2.7200000000000002 113.995 -164.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . 0.456 ' HZ3' ' CD ' ' B' ' 181' ' ' GLU . 3.0 mtpp -56.89 -37.75 71.81 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 120.426 -1.421 . . . . 6.0199999999999996 110.48 169.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 66.0 m -55.94 -13.36 1.82 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.803 2.041 . . . . 4.0999999999999996 116.093 167.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 74.5 m -88.76 -39.19 14.11 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.42 1.463 . . . . 1.8500000000000001 111.975 169.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -52.54 -48.23 66.22 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 120.242 1.383 . . . . 3.6600000000000001 111.819 -179.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 19.6 ptt85 -55.23 -18.76 6.59 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.776 1.399 . . . . 4.5800000000000001 114.776 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -114.8 -32.12 5.91 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.759 1.223 . . . . 3.3999999999999999 113.659 -172.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 6.3 tmm? -50.67 -46.46 58.63 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.725 -0.472 . . . . 2.0499999999999998 109.725 153.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 4.4 mt -63.87 -27.63 69.29 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 114.923 1.453 . . . . 2.48 114.923 170.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -77.35 -33.46 55.34 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 120.258 1.39 . . . . 2.5299999999999998 112.177 175.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -84.77 -55.33 4.15 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.392 0.677 . . . . 2.2999999999999998 112.801 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.414 ' HG3' HD22 ' B' ' 121' ' ' ASN . 3.8 mm-40 -77.0 -19.52 57.17 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.639 0.654 . . . . 2.7200000000000002 112.589 -174.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.52 20.02 12.51 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.464 1.506 . . . . 2.9100000000000001 113.294 -177.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -52.13 -26.0 10.24 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 116.159 1.911 . . . . 1.3899999999999999 116.159 -172.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . 0.415 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 6.6 m-70 -77.47 -25.19 50.29 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.87 -1.144 . . . . 2.4100000000000001 113.576 -175.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 32.1 ttm -80.01 27.81 0.3 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.338 1.455 . . . . 3.46 113.973 -171.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.6 mp -102.71 173.69 6.22 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.437 1.895 . . . . 4.0199999999999996 113.289 -171.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 62.5 m -162.22 43.53 0.14 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 126.032 1.733 . . . . 4.6500000000000004 109.469 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . 0.45 ' CG ' ' H ' ' B' ' 156' ' ' THR . 7.5 t70 82.82 -175.98 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.575 2.35 . . . . 4.4900000000000002 108.498 -144.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 156' ' ' THR . . . . . 0.45 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 70.7 p -66.46 -15.82 63.64 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 128.468 2.707 . . . . 3.98 114.87 -178.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.71 -37.27 67.98 Favored Glycine 0 N--CA 1.476 1.309 0 CA-C-N 120.622 1.555 . . . . 1.8999999999999999 113.328 -173.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.97 -39.62 94.55 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.387 1.475 . . . . 3.52 110.79 176.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 43.2 ttt-85 -71.59 -38.81 70.84 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.327 -0.858 . . . . 5.5599999999999996 112.942 167.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -57.48 -33.44 68.0 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.237 -1.539 . . . . 3.9500000000000002 111.175 178.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -65.28 -13.95 59.6 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 115.973 1.842 . . . . 1.8300000000000001 115.973 171.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.01 -49.53 10.14 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.822 1.249 . . . . 1.9399999999999999 110.817 164.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -59.48 -34.53 72.7 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 125.047 1.339 . . . . 2.8500000000000001 111.686 -176.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -55.55 -31.1 61.86 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 120.861 -1.149 . . . . 4.8499999999999996 113.684 169.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 23.4 mt -82.8 -37.33 24.65 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.332 -0.855 . . . . 2.21 112.391 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 26.8 mm -47.89 -60.61 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.098 0.959 . . . . 1.8100000000000001 109.299 173.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -58.25 -39.26 78.71 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.37 0.878 . . . . 2.4300000000000002 113.37 -174.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -62.69 -29.6 70.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.594 1.558 . . . . 3.6000000000000001 112.637 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -99.69 -47.2 5.16 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.308 1.443 . . . . 4.3799999999999999 110.839 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -53.61 -48.03 69.67 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 128.863 2.865 . . . . 2.6699999999999999 111.533 -178.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.52 -15.1 15.76 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 115.009 1.485 . . . . 3.77 115.009 175.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -118.28 5.74 11.89 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.982 1.713 . . . . 4.0599999999999996 112.852 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.02 134.18 42.12 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 119.749 -1.844 . . . . 5.2999999999999998 113.627 -164.004 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -79.83 58.86 2.96 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 122.422 1.106 . . . . 4.6399999999999997 111.604 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 62.8 19.54 60.96 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.169 1.842 . . . . 4.1900000000000004 113.451 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -88.67 153.34 21.19 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 122.835 1.302 . . . . 8.8000000000000007 114.06 -163.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 5.3 pt -132.15 169.65 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 128.022 2.529 . . . . 4.75 109.784 170.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 58.6 m -142.09 176.66 8.79 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.019 1.328 . . . . 2.0499999999999998 109.562 165.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -59.15 -52.58 65.11 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 122.371 1.081 . . . . 3.3599999999999999 110.083 168.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -43.71 87.17 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 129.053 2.941 . . . . 3.0600000000000001 111.128 -178.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . 0.456 ' CD ' ' HZ3' ' B' ' 138' ' ' LYS . 10.5 tm-20 -72.64 -47.43 47.65 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.454 1.102 . . . . 3.6000000000000001 110.691 -174.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -51.33 -51.53 53.56 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.931 1.241 . . . . 3.0800000000000001 111.598 168.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -65.25 -41.79 93.94 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.394 0.516 . . . . 0.81000000000000005 112.394 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 41.7 p -65.5 -37.21 86.13 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 117.908 -1.044 . . . . 3.8999999999999999 111.777 176.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 76.3 mt -57.33 -39.91 76.88 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.973 0.806 . . . . 1.75 112.549 172.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 42.2 mm -54.07 -44.79 64.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 119.773 1.17 . . . . 2.0800000000000001 111.596 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -70.15 -5.63 54.3 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 125.081 1.324 . . . . 1.03 114.266 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -93.3 -11.97 57.86 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-O 118.495 -1.169 . . . . 0.75 113.775 170.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.9 mp -95.35 -56.21 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 119.036 1.418 . . . . 2.3500000000000001 107.895 164.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 42.1 m -74.65 98.01 3.33 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 126.252 1.821 . . . . 2.23 108.119 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -170.45 -80.18 0.05 OUTLIER Glycine 0 CA--C 1.532 1.143 0 C-N-CA 124.985 1.279 . . . . 1.45 112.787 -172.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -62.53 -43.38 22.21 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.126 2.551 . . . . 1.5800000000000001 112.125 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 10.4 pt -72.49 -10.35 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 114.313 1.227 . . . . 2.5600000000000001 114.313 173.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.92 -35.18 76.03 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.109 1.152 . . . . 2.4500000000000002 114.109 -174.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -48.82 80.06 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.471 -1.393 . . . . 4.54 111.734 166.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.14 -37.83 78.21 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.183 1.393 . . . . 2.6200000000000001 111.917 -174.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 96.5 mt -53.29 -60.7 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.441 1.496 . . . . 2.4100000000000001 111.935 168.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -63.74 -30.67 71.74 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.381 -0.824 . . . . 1.8999999999999999 112.094 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -71.72 -27.28 62.9 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.4 -0.812 . . . . 3.75 111.86 175.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . 0.405 ' C ' ' H ' ' B' ' 202' ' ' GLN . 6.0 tp-100 -73.98 -39.67 63.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.821 1.248 . . . . 5.3499999999999996 110.248 179.028 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.6 1.81 0.53 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 125.408 1.483 . . . . 3.1000000000000001 112.905 172.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.405 ' H ' ' C ' ' B' ' 200' ' ' GLN . 33.7 mm-40 -109.73 -71.35 0.77 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 120.427 -1.42 . . . . 2.98 111.579 167.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -73.35 -7.2 50.64 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 114.92 -1.037 . . . . 5.9800000000000004 112.414 -164.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 70.2 m 60.55 21.53 11.3 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 127.896 2.478 . . . . 8.7400000000000002 112.021 165.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 7.3 t 82.42 16.93 0.37 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.955 2.502 . . . . 13.199999999999999 116.013 -179.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 32.7 t . . . . . 0 C--O 1.25 1.115 0 CA-C-O 116.604 -1.665 . . . . 10.779999999999999 111.146 139.835 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.0 m . . . . . 0 CA--C 1.51 -0.593 0 CA-C-O 118.751 -0.642 . . . . 9.1699999999999999 109.98 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 4' ' ' CYS . 37.1 t70 -71.57 -129.28 0.0 OUTLIER 'General case' 0 CA--C 1.559 1.303 0 O-C-N 125.191 1.557 . . . . 7.1900000000000004 108.224 139.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.407 ' H ' ' CG ' ' A' ' 3' ' ' ASP . 52.5 t -91.96 -41.21 10.69 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.218 1.407 . . . . 5.0899999999999999 112.714 175.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 75.13 98.79 0.07 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 128.647 2.779 . . . . 3.5499999999999998 111.22 -169.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 70.5 p -57.53 148.21 24.53 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.84 0.856 . . . . 2.1000000000000001 109.634 176.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -59.17 -31.42 68.97 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 118.554 0.615 . . . . 2.2799999999999998 111.445 175.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.87 -41.75 98.23 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.681 -0.637 . . . . 2.3199999999999998 111.0 177.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -53.09 13.17 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 118.407 -0.806 . . . . 3.3700000000000001 110.495 175.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -42.32 -43.09 3.36 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.343 1.057 . . . . 5.6299999999999999 112.5 170.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.17 -42.09 76.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 125.054 1.342 . . . . 1.5800000000000001 112.668 -178.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 54.3 t -56.52 -46.41 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.99 0.814 . . . . 2.1899999999999999 109.762 167.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 16.3 mt -54.77 -49.15 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-N 118.413 0.551 . . . . 2.1200000000000001 111.432 174.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.7 t -65.07 -41.71 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 118.997 0.817 . . . . 1.78 112.341 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.56 -41.38 97.29 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.251 -0.905 . . . . 1.96 111.233 176.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 80.1 t -72.66 -37.33 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.275 1.43 . . . . 1.76 112.486 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -55.51 -54.75 40.01 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.312 1.045 . . . . 3.04 110.142 170.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -71.12 -9.57 58.28 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.198 1.184 . . . . 2.7400000000000002 114.198 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.423 ' HB2' ' CE2' ' A' ' 79' ' ' TYR . 60.0 t80 -79.95 -65.62 0.98 Allowed 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.853 -1.154 . . . . 3.9300000000000002 112.22 167.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -63.69 -28.63 70.03 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 118.934 -0.555 . . . . 3.6899999999999999 112.053 -170.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.0 mtpt -46.35 -38.59 9.01 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.354 1.462 . . . . 3.8799999999999999 114.44 168.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -92.41 -26.09 18.18 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.808 -0.557 . . . . 3.5 111.325 -176.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.8 t -72.32 -55.2 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 126.243 1.817 . . . . 3.3100000000000001 112.881 176.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.8 p 167.05 -97.77 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 127.284 2.234 . . . . 4.3399999999999999 112.704 -177.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 74.3 tttt -170.12 -12.17 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.551 1.941 . . . . 7.1100000000000003 113.303 -166.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -167.54 -38.44 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.777 1.631 . . . . 7.0999999999999996 113.779 -175.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.1 t -115.35 131.24 56.99 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.616 -1.302 . . . . 5.5300000000000002 114.16 -171.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.04 -61.4 2.06 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.385 1.874 . . . . 9.1500000000000004 113.22 -177.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . 0.278 6.0 m -85.63 65.08 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-O 124.409 2.052 . . . . 5.0 112.117 -178.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HA ' ' HE2' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -82.04 -5.0 58.03 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 111.516 -2.583 . . . . 8.0600000000000005 113.627 162.786 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 36.67 67.3 0.34 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.864 2.466 . . . . 9.9399999999999995 113.102 -178.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.8 tptt -163.69 -16.33 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.46 1.652 . . . . 9.7899999999999991 115.46 175.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.3 tt -76.65 162.11 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 119.746 1.157 . . . . 3.8900000000000001 108.379 133.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.8 m -163.9 163.29 23.71 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 127.081 2.152 . . . . 4.7800000000000002 109.433 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.452 ' HZ1' ' HA ' ' A' ' 67' ' ' ASP . 39.4 pttt -47.15 -13.3 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.273 0 N-CA-C 118.011 2.597 . . . . 3.79 118.011 179.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.3 m -78.98 -28.02 43.5 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 119.912 -1.743 . . . . 2.8100000000000001 114.501 169.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.8 m -77.66 -48.76 16.02 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.624 1.102 . . . . 1.6100000000000001 111.477 -171.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -49.13 -49.6 41.38 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.166 0.986 . . . . 3.2599999999999998 112.032 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -58.3 -30.24 66.5 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 118.23 -0.891 . . . . 4.4900000000000002 113.16 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -96.58 -40.93 8.79 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.172 1.389 . . . . 2.8799999999999999 113.533 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 43.3 ttp -49.43 -42.1 41.83 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.863 1.665 . . . . 2.5899999999999999 112.044 163.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.0 mt -55.01 -19.99 8.18 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 114.398 1.258 . . . . 1.8999999999999999 114.398 170.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -98.75 -11.23 22.09 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.447 1.499 . . . . 2.6499999999999999 113.009 177.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 -59.5 1.77 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.275 1.03 . . . . 2.54 112.118 170.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -76.9 -26.42 54.13 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.708 1.203 . . . . 3.5899999999999999 113.156 -172.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.15 43.91 2.34 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.006 1.722 . . . . 2.73 111.745 -179.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -84.24 -17.86 38.38 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 116.566 2.061 . . . . 1.3400000000000001 116.566 -171.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.525 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 10.5 m-70 -80.92 -25.99 37.08 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 120.917 1.69 . . . . 2.1899999999999999 113.244 -168.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 76.0 mtm -97.59 15.5 23.21 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.182 1.393 . . . . 3.79 113.257 164.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.26 -152.56 0.29 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.194 1.798 . . . . 3.2200000000000002 110.853 174.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.1 t 69.11 -35.91 0.32 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.849 2.059 . . . . 6.6100000000000003 113.78 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -35.03 18.26 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 127.3 2.24 . . . . 6.3499999999999996 113.075 174.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 95.1 m 74.41 -23.45 0.23 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 127.329 2.252 . . . . 3.4900000000000002 114.123 169.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.26 -48.97 76.15 Favored Glycine 0 CA--C 1.532 1.154 0 CA-C-N 120.549 1.522 . . . . 2.5899999999999999 110.244 160.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -37.47 -65.2 0.33 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.073 2.549 . . . . 4.6299999999999999 111.254 159.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.9 tpm_? -56.77 -46.52 81.41 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 114.613 1.338 . . . . 6.96 114.613 -175.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -66.28 -35.86 81.49 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.534 0.733 . . . . 3.8700000000000001 111.586 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.19 -32.87 66.89 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 118.086 -0.959 . . . . 1.8300000000000001 112.885 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.56 -44.12 95.05 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.422 1.089 . . . . 1.8899999999999999 112.78 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.99 -22.73 59.5 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.172 0.804 . . . . 3.4900000000000002 113.172 -175.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -54.88 -37.79 66.73 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 121.552 -0.718 . . . . 3.7799999999999998 112.167 164.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 12.6 mt -74.63 -43.7 54.13 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.159 -0.928 . . . . 2.21 111.175 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.0 mm -60.22 -39.04 79.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 118.408 -0.806 . . . . 2.6800000000000002 111.384 -175.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -72.32 -37.58 68.88 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.889 0.876 . . . . 2.8500000000000001 113.297 176.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -62.82 -34.9 78.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.902 1.281 . . . . 4.2199999999999998 112.552 171.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.1 tp -82.27 -36.64 26.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.259 1.424 . . . . 3.6600000000000001 111.454 178.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.452 ' HA ' ' HZ1' ' A' ' 35' ' ' LYS . 29.4 t70 -43.71 -57.13 3.37 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.8 2.04 . . . . 4.4199999999999999 113.024 -169.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.42 -16.34 3.56 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.702 2.001 . . . . 3.4100000000000001 114.844 -177.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -110.89 -1.62 16.4 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.918 1.287 . . . . 2.54 113.059 -173.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 30.6 m80 -138.06 101.21 4.36 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.024 -1.047 . . . . 4.1900000000000004 112.755 -166.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.13 27.4 0.14 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.942 2.097 . . . . 4.6600000000000001 114.349 -171.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.77 32.8 58.72 Favored Glycine 0 CA--C 1.533 1.161 0 O-C-N 120.112 -1.618 . . . . 2.8799999999999999 110.643 -150.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.8 mmt-85 -95.34 159.17 15.13 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.051 1.34 . . . . 6.96 108.615 162.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.4 mm -145.26 140.66 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 126.454 1.902 . . . . 3.21 107.895 -173.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 t -116.97 173.47 6.63 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.671 0.748 . . . . 2.54 112.15 166.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -78.19 -47.47 17.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.355 1.062 . . . . 3.6499999999999999 111.988 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -73.3 -23.86 60.33 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.092 2.157 . . . . 2.77 113.372 -178.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -48.07 -61.19 2.1 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.807 2.043 . . . . 3.27 111.075 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.423 ' CE2' ' HB2' ' A' ' 19' ' ' PHE . 6.8 t80 -54.98 -49.29 71.81 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.312 -0.868 . . . . 3.04 111.485 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 19.6 t-105 -61.0 -48.18 83.01 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.239 0.615 . . . . 1.1000000000000001 111.881 -178.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.5 t -73.28 -25.15 60.56 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.752 -1.118 . . . . 2.75 112.647 -178.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.7 mt -69.45 -36.11 76.3 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.562 1.073 . . . . 2.1200000000000001 112.274 170.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 21.4 mm -48.23 -44.11 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 CA-C-N 120.336 1.425 . . . . 2.0299999999999998 111.408 177.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.45 -15.1 44.72 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 124.159 0.885 . . . . 0.81000000000000005 114.998 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.86 -19.81 60.71 Favored Glycine 0 CA--C 1.533 1.161 0 CA-C-N 118.741 1.27 . . . . 0.81999999999999995 114.077 172.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.0 mp -99.13 -52.49 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-N 119.139 1.47 . . . . 2.0499999999999998 109.24 170.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.1 m -73.91 59.23 0.69 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 128.225 2.61 . . . . 2.3799999999999999 108.387 167.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -146.11 -69.63 0.01 OUTLIER Glycine 0 CA--C 1.525 0.692 0 C-N-CA 126.711 2.1 . . . . 1.26 109.299 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -58.0 -50.88 9.0 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.273 2.649 . . . . 1.6699999999999999 112.742 173.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.9 pp -90.8 -11.82 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 113.827 1.047 . . . . 2.2400000000000002 113.827 -175.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.58 -29.99 70.66 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 120.842 -1.161 . . . . 2.7200000000000002 113.448 -174.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -37.74 67.42 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.036 -1.04 . . . . 4.5800000000000001 113.792 168.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.6 tt -56.58 -40.35 75.09 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.829 1.252 . . . . 2.9300000000000002 110.807 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 57.0 mt -47.92 -62.8 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.059 1.344 . . . . 2.7400000000000002 110.1 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -73.24 -24.82 60.52 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.966 -1.084 . . . . 1.8300000000000001 112.794 -174.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -67.65 -27.89 67.24 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-O 118.489 -0.767 . . . . 3.6400000000000001 110.136 168.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -90.27 -38.59 13.31 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.328 1.851 . . . . 2.3199999999999998 115.745 178.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -61.37 -2.66 0.74 Allowed 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 121.47 1.941 . . . . 2.2000000000000002 112.054 167.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -112.0 -88.56 0.53 Allowed 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.129 1.771 . . . . 2.0899999999999999 111.838 165.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.13 18.91 0.09 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.117 2.967 . . . . 4.71 115.24 -176.407 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.1 m -141.27 16.76 2.24 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.778 2.031 . . . . 6.7599999999999998 110.074 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 9.9 m -178.39 86.09 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 128.361 2.664 . . . . 8.0899999999999999 105.74 -174.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 67.3 m . . . . . 0 C--O 1.25 1.129 0 C-N-CA 126.341 1.856 . . . . 10.23 109.626 -137.265 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 67.3 m . . . . . 0 N--CA 1.473 0.719 0 CA-C-O 118.319 -0.848 . . . . 9.0199999999999996 109.343 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -71.75 -128.23 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 107.912 -1.144 . . . . 6.9000000000000004 107.912 137.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 41.8 t -104.0 -49.13 3.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.065 1.346 . . . . 5.1399999999999997 111.141 172.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.525 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 85.8 m-85 79.06 120.69 0.05 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 129.059 2.944 . . . . 4.0899999999999999 110.168 -156.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 81.3 p -64.14 156.8 27.32 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 121.372 -0.83 . . . . 2.2400000000000002 110.373 171.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -60.38 -19.52 56.08 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.219 0.463 . . . . 2.71 111.49 171.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -44.9 66.07 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.599 1.56 . . . . 2.3599999999999999 111.369 172.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.37 -44.57 62.38 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 117.69 -1.147 . . . . 2.9399999999999999 111.634 173.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -43.83 -48.05 8.23 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.621 1.555 . . . . 5.3899999999999997 111.088 165.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.21 -53.36 38.18 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 118.045 -0.978 . . . . 1.76 113.606 178.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 42.6 t -52.84 -46.61 52.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 CA-C-N 119.707 1.14 . . . . 2.2000000000000002 111.131 174.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 93.8 mt -53.16 -52.35 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.846 1.258 . . . . 2.4700000000000002 110.926 170.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 21.8 t -67.62 -37.96 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-N 119.97 1.259 . . . . 1.75 112.543 -175.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -61.78 -41.86 98.26 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.062 0.945 . . . . 2.0699999999999998 111.055 175.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 72.9 t -75.07 -40.44 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.886 1.274 . . . . 1.76 112.302 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -51.93 -56.42 14.24 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.724 1.21 . . . . 3.0800000000000001 110.086 170.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -69.78 -15.08 63.06 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.811 1.041 . . . . 3.0099999999999998 113.811 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -83.79 -60.85 1.99 Allowed 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.406 -0.809 . . . . 3.3999999999999999 113.103 172.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -58.34 -32.9 68.96 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.66 -0.65 . . . . 3.79 112.16 -174.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -41.24 -44.54 2.67 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.102 1.761 . . . . 4.0199999999999996 114.293 169.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -89.16 -29.52 19.26 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.46 0.704 . . . . 3.4199999999999999 112.282 -176.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 56.1 t -66.89 -47.4 82.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.217 1.807 . . . . 3.48 111.991 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 63.9 p 153.27 -77.81 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 130.064 3.346 . . . . 4.5 109.836 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 14.9 tttp -179.06 -71.55 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.881 2.072 . . . . 5.7800000000000002 110.09 -167.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -120.16 -7.98 9.78 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 115.186 1.55 . . . . 7.1200000000000001 115.186 -169.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 29.0 t -128.83 135.87 49.71 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 119.869 -1.769 . . . . 5.71 112.39 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 85.9 mt -81.18 -53.68 6.17 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.922 1.289 . . . . 9.3399999999999999 112.998 -172.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . 0.28 29.1 m -85.8 54.17 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 CA-C-O 124.634 2.159 . . . . 5.0999999999999996 112.574 -178.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.18 -2.84 39.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 111.158 -2.746 . . . . 8.0299999999999994 113.789 166.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 60.5 t30 35.19 64.36 0.45 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.478 2.711 . . . . 9.8900000000000006 114.197 172.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 20.8 tptt -165.77 -19.04 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.855 1.262 . . . . 9.5999999999999996 114.373 177.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.7 tt -69.68 157.28 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 N-CA-C 107.544 -1.28 . . . . 4.0199999999999996 107.544 136.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 6.2 m -161.79 162.82 29.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 124.354 1.062 . . . . 4.6799999999999997 110.273 173.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . 0.463 ' HZ1' ' HA ' ' B' ' 170' ' ' ASP . 30.3 pttt -50.98 -11.06 0.08 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 128.301 2.64 . . . . 3.6200000000000001 117.066 -179.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.0 m -80.99 -27.9 35.73 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 119.706 -1.872 . . . . 2.5699999999999998 114.418 166.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 26.8 m -76.86 -46.4 24.81 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.572 -1.33 . . . . 1.3899999999999999 112.058 -169.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -51.23 -50.16 59.68 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.513 1.125 . . . . 3.8300000000000001 112.438 175.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -65.01 -12.28 48.57 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.979 1.103 . . . . 4.3600000000000003 113.979 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -98.37 -43.67 6.83 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 120.171 1.351 . . . . 2.48 111.225 170.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 63.2 ttp -54.04 -41.85 68.54 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.279 1.831 . . . . 2.9100000000000001 112.479 177.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 11.7 mt -59.86 -29.3 68.2 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.913 -1.117 . . . . 2.6499999999999999 113.625 172.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -80.48 -9.82 59.76 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.901 1.281 . . . . 2.6099999999999999 112.885 176.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.99 -64.72 1.01 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.551 1.14 . . . . 2.46 111.366 167.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -75.85 -13.71 60.28 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.557 -1.339 . . . . 3.1899999999999999 114.279 -172.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.2 18.13 9.12 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.104 1.362 . . . . 2.5299999999999998 112.748 177.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -53.75 -28.45 34.58 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 115.365 1.617 . . . . 1.26 115.365 -171.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -66.98 -25.89 66.54 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 114.128 1.159 . . . . 2.3199999999999998 114.128 -169.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 68.1 mtm -105.14 11.59 32.99 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.407 1.083 . . . . 3.8700000000000001 112.598 171.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . 0.437 HD23 ' H ' ' B' ' 154' ' ' SER . 0.2 OUTLIER -99.21 -163.76 1.07 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.448 1.899 . . . . 2.9199999999999999 110.398 -178.701 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 154' ' ' SER . . . . . 0.437 ' H ' HD23 ' B' ' 153' ' ' LEU . 5.3 t 70.53 -23.16 0.17 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.235 1.814 . . . . 7.0899999999999999 113.988 -177.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -65.54 16.67 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 128.309 2.644 . . . . 7.0099999999999998 114.638 177.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 156' ' ' THR . . . . . 0.402 ' H ' ' C ' ' B' ' 154' ' ' SER . 98.8 m 62.41 -65.83 0.09 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 128.853 2.861 . . . . 5.0899999999999999 113.548 -179.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -54.01 -40.52 66.15 Favored Glycine 0 N--CA 1.468 0.825 0 C-N-CA 125.543 1.544 . . . . 2.8500000000000001 112.692 -172.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -43.74 -67.5 0.27 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.77 1.628 . . . . 4.6399999999999997 112.232 168.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 25.0 ttt-85 -73.79 -29.58 62.26 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.105 -0.997 . . . . 6.04 112.528 -173.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -61.19 -42.42 98.55 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.574 -1.328 . . . . 4.0 112.137 171.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.12 -37.61 74.91 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.55 0.944 . . . . 1.96 113.55 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -58.02 -47.18 83.84 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.851 1.26 . . . . 1.8799999999999999 112.856 173.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.06 -23.59 60.58 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.438 -0.789 . . . . 3.3999999999999999 112.906 -173.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -54.5 -36.64 64.4 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.683 -0.635 . . . . 3.8300000000000001 112.058 164.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 7.4 mt -73.76 -46.04 48.11 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.523 -0.762 . . . . 2.0099999999999998 110.712 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 7.1 mm -60.31 -42.73 91.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.691 0.678 . . . . 2.5699999999999998 112.002 -175.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -68.65 -36.46 78.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.486 1.114 . . . . 2.6800000000000002 113.223 177.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -70.24 -37.62 75.01 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.06 1.344 . . . . 3.5299999999999998 111.57 174.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 10.5 tp -74.48 -32.74 62.65 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.62 1.168 . . . . 3.5699999999999998 111.506 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . 0.463 ' HA ' ' HZ1' ' B' ' 138' ' ' LYS . 38.4 t70 -46.4 -54.58 8.83 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 125.822 1.649 . . . . 4.0300000000000002 112.808 -172.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -61.53 -4.95 1.52 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.337 1.855 . . . . 3.3900000000000001 115.771 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -121.35 -2.76 9.49 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.526 1.13 . . . . 2.52 113.423 -176.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 66.7 m80 -137.15 89.61 2.45 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.889 -1.132 . . . . 4.54 111.978 -167.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.78 29.32 0.09 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.581 2.752 . . . . 4.75 114.564 -167.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.35 32.23 58.22 Favored Glycine 0 CA--C 1.534 1.24 0 O-C-N 120.268 -1.52 . . . . 2.5699999999999998 110.557 -149.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 47.1 mmt-85 -103.23 151.32 22.79 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.231 1.812 . . . . 6.9299999999999997 107.388 161.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 33.2 mm -144.49 140.78 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 127.281 2.232 . . . . 3.0099999999999998 106.713 -172.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.1 t -119.81 171.3 8.51 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.754 0.788 . . . . 2.6200000000000001 112.559 171.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -77.99 -46.46 21.0 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.062 0.945 . . . . 3.77 112.327 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -71.2 -23.6 62.06 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.473 1.909 . . . . 2.7799999999999998 113.213 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -48.51 -60.5 2.64 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 127.083 2.153 . . . . 3.1800000000000002 111.061 175.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -57.17 -46.21 83.01 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.299 -0.876 . . . . 3.1000000000000001 111.602 -179.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -61.86 -46.19 90.52 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.366 0.666 . . . . 1.1000000000000001 112.395 -178.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 6.5 t -69.05 -36.75 78.04 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.803 0.729 . . . . 2.8999999999999999 111.299 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 81.6 mt -61.18 -37.22 82.15 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.458 1.026 . . . . 1.8600000000000001 113.288 174.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 15.3 mm -49.51 -44.85 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 120.049 1.295 . . . . 2.1800000000000002 110.795 176.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -64.67 -13.13 55.23 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.607 1.098 . . . . 0.69999999999999996 114.601 -177.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -83.41 -20.64 59.95 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-N 118.7 1.25 . . . . 0.79000000000000004 113.906 170.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 5.1 mp -96.06 -55.56 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 119.429 1.615 . . . . 2.2200000000000002 108.797 171.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 27.6 m -73.11 59.17 0.52 Allowed 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 128.638 2.775 . . . . 2.4399999999999999 108.555 169.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -142.84 -72.11 0.03 OUTLIER Glycine 0 CA--C 1.525 0.717 0 C-N-CA 126.882 2.182 . . . . 1.27 108.458 175.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -58.94 -51.27 7.17 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.208 2.605 . . . . 1.5900000000000001 113.169 174.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.0 pp -87.18 -10.77 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.5 1.046 . . . . 2.2799999999999998 113.087 -175.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.06 -31.04 70.41 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 120.975 -1.078 . . . . 2.6499999999999999 113.054 -173.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -36.75 69.72 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 117.815 -1.088 . . . . 4.3600000000000003 113.048 172.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.7 tt -55.98 -40.15 72.86 Favored 'General case' 0 C--O 1.217 -0.605 0 C-N-CA 124.342 1.057 . . . . 3.23 110.671 -177.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 88.2 mt -48.4 -61.71 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.63 1.172 . . . . 2.5099999999999998 110.869 171.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -65.54 -34.97 79.5 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 121.595 -0.691 . . . . 1.8300000000000001 111.729 -176.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -68.49 -21.3 64.62 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 118.728 -0.653 . . . . 3.5499999999999998 110.769 176.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -91.85 -38.77 12.13 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.063 1.745 . . . . 2.2799999999999998 114.751 173.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -59.98 -6.69 1.41 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 121.229 1.831 . . . . 2.3999999999999999 112.208 164.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -104.65 -93.32 0.35 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.453 1.501 . . . . 2.1899999999999999 112.105 162.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.3 24.09 0.26 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 128.424 2.689 . . . . 4.8300000000000001 113.934 -172.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 15.1 m -139.94 22.86 2.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 127.853 2.461 . . . . 6.9400000000000004 109.454 -170.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 21.4 m -175.23 71.42 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.984 2.114 . . . . 8.5399999999999991 107.916 -175.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 33.2 m . . . . . 0 C--O 1.252 1.2 0 C-N-CA 125.837 1.655 . . . . 10.050000000000001 111.197 -150.0 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 N--CA 1.473 0.691 0 N-CA-C 106.294 -1.743 . . . . 11.02 106.294 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.76 -116.52 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 107.744 -1.206 . . . . 6.8399999999999999 107.744 127.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 85.0 m -75.62 -113.52 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.849 0 O-C-N 120.325 -1.485 . . . . 4.3600000000000003 108.723 159.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.5 m-30 123.97 155.03 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.162 1 C-N-CA 132.886 4.474 . . . . 3.3199999999999998 111.747 -174.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.8 p -73.68 159.19 33.38 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.807 0.843 . . . . 1.7 110.351 169.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -64.95 -20.52 66.51 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.702 -0.624 . . . . 2.54 111.661 170.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.89 -45.76 77.02 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 118.749 -0.643 . . . . 1.9199999999999999 109.926 173.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.16 -49.68 66.56 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 117.331 -1.318 . . . . 3.4700000000000002 112.187 172.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -41.6 -48.46 4.03 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 121.045 1.748 . . . . 5.9000000000000004 112.273 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.71 -47.31 48.15 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-O 117.306 -1.33 . . . . 1.71 112.727 -177.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.64 -40.42 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 CA-C-N 121.14 1.791 . . . . 1.79 110.619 173.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 88.4 mt -54.17 -58.46 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.207 1.003 . . . . 2.1099999999999999 110.696 168.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.9 t -61.58 -35.15 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 125.542 1.537 . . . . 1.8799999999999999 112.964 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -69.71 -39.17 77.03 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.85 0.86 . . . . 1.8799999999999999 110.515 175.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 68.6 t -75.56 -34.41 29.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.024 0.929 . . . . 1.98 111.339 178.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -61.64 -45.5 93.76 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 124.916 1.286 . . . . 3.0499999999999998 111.262 168.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -58.56 -23.54 58.71 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.612 0.967 . . . . 2.2599999999999998 113.612 174.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -82.98 -60.87 2.02 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.822 -1.174 . . . . 3.5600000000000001 112.489 170.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -69.07 -13.74 62.61 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.761 1.023 . . . . 3.23 113.761 -174.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.5 mttp -31.83 -48.24 0.15 Allowed 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 127.872 2.469 . . . . 3.0699999999999998 112.851 162.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -98.38 6.22 47.48 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.543 1.137 . . . . 3.6600000000000001 112.664 -171.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.2 t -112.41 131.61 63.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.552 1.141 . . . . 4.2400000000000002 110.189 -170.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -47.83 -45.71 30.18 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.13 1.372 . . . . 3.7999999999999998 112.279 -178.171 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.74 -45.9 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.701 1.601 . . . . 5.8300000000000001 110.669 163.27 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -144.02 -50.89 0.31 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.31 0.644 . . . . 8.1400000000000006 111.375 174.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.3 m 65.54 -2.33 0.85 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 126.72 2.008 . . . . 5.0599999999999996 115.091 168.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.1 mt 56.12 -78.74 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 128.986 2.915 . . . . 7.54 111.95 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.409 HG21 ' H ' ' A' ' 74' ' ' ILE . 4.8 p -177.63 21.13 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.006 0 C-N-CA 128.747 2.819 . . . . 5.8799999999999999 111.919 -157.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -77.1 -22.28 52.99 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 119.526 -1.984 . . . . 10.640000000000001 115.399 -174.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 164.27 -59.31 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 129.657 3.183 . . . . 10.07 107.237 -168.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 44.8 tttt 67.66 -101.1 0.06 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.918 1.287 . . . . 11.4 111.823 160.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 42.6 pt -133.4 130.82 57.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 120.764 1.62 . . . . 3.2599999999999998 110.109 174.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.5 m -66.14 140.66 58.23 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.561 -1.337 . . . . 3.1600000000000001 111.549 178.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -61.95 -17.74 57.95 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.342 1.238 . . . . 4.0300000000000002 114.342 -169.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.0 p -54.37 -33.34 58.96 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.802 -1.186 . . . . 2.77 112.231 168.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.1 m -60.05 -25.59 65.47 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.644 -1.285 . . . . 2.52 113.737 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -65.5 -62.51 1.48 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.308 1.413 . . . . 3.3199999999999998 111.441 175.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -58.26 -21.92 50.41 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.202 1.001 . . . . 2.8300000000000001 112.653 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.405 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 25.5 mt-10 -93.23 -44.74 8.18 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 124.662 1.185 . . . . 3.8399999999999999 113.459 -174.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -32.1 68.04 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.593 1.088 . . . . 1.8899999999999999 111.137 163.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.6 mt -66.24 -19.23 65.76 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 115.576 1.695 . . . . 2.04 115.576 169.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.41 -24.4 13.48 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.963 1.256 . . . . 3.1299999999999999 113.475 171.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 1.6 mppt? -86.07 -48.2 8.85 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.78 1.232 . . . . 3.7000000000000002 110.639 -178.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -86.77 -36.97 18.28 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.235 1.014 . . . . 2.9300000000000002 112.238 -178.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.3 mt -103.75 50.04 0.81 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.035 0.934 . . . . 3.8399999999999999 111.883 173.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -68.17 36.3 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 125.575 1.55 . . . . 2.1000000000000001 113.61 175.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -136.42 -96.03 0.23 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.577 1.951 . . . . 2.23 110.745 -159.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.1 ptp -56.57 -20.23 19.77 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.638 1.563 . . . . 2.73 114.436 174.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.2 mp -80.65 64.23 5.36 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 123.801 1.762 . . . . 4.79 110.25 162.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.1 m -79.83 -10.74 59.82 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 113.036 -1.893 . . . . 4.3200000000000003 114.425 -158.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -151.96 164.77 36.47 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.659 1.584 . . . . 4.5999999999999996 109.639 160.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.5 m -34.47 -44.15 0.19 Allowed 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 129.443 3.097 . . . . 3.3199999999999998 112.805 160.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.34 -32.09 79.62 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 117.653 -1.637 . . . . 2.6099999999999999 114.39 -179.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -78.6 -47.67 16.67 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.214 1.507 . . . . 2.9100000000000001 109.679 170.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -48.73 -29.62 4.68 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.421 1.889 . . . . 6.3499999999999996 115.571 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.7 mtmt -48.36 -34.42 10.68 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.933 -1.104 . . . . 5.8300000000000001 113.838 168.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.59 -16.49 63.41 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.54 1.311 . . . . 1.96 114.54 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.07 -49.01 8.64 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.719 0.808 . . . . 1.78 111.67 168.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.0 -31.5 72.43 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 112.916 0.709 . . . . 2.4399999999999999 112.916 -179.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -57.31 -28.84 63.42 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.105 -0.997 . . . . 3.4100000000000001 112.703 174.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 45.9 mt -78.32 -30.52 48.31 Favored 'General case' 0 C--O 1.224 -0.238 0 O-C-N 121.637 -0.664 . . . . 1.8899999999999999 111.404 -178.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.5 mm -66.25 -49.02 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 123.94 0.896 . . . . 1.8500000000000001 110.13 -178.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.57 -37.22 85.32 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.94 1.296 . . . . 4.0 113.061 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -65.88 -25.05 67.0 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.382 1.473 . . . . 3.3700000000000001 113.979 171.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -87.94 -80.06 0.28 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 117.715 -1.136 . . . . 3.29 109.842 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -50.64 -34.7 27.24 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.437 1.471 . . . . 3.5899999999999999 114.771 -158.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -54.37 -18.86 4.57 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 115.249 1.574 . . . . 4.5099999999999998 115.249 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -132.48 5.48 4.04 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.541 1.936 . . . . 5.2699999999999996 113.866 168.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -141.4 9.79 2.06 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 116.144 1.905 . . . . 5.6100000000000003 116.144 -164.325 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -51.76 145.34 9.65 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.504 1.521 . . . . 7.1799999999999997 112.869 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 71.47 -22.91 0.64 Allowed Glycine 0 CA--C 1.535 1.334 0 C-N-CA 126.333 1.92 . . . . 3.0299999999999998 114.795 -173.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -94.39 135.11 36.17 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.294 1.437 . . . . 6.21 110.893 -178.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.409 ' H ' HG21 ' A' ' 29' ' ' VAL . 32.2 mm -147.07 111.98 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.975 1.71 . . . . 3.2799999999999998 107.446 177.35 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.4 m -85.3 -158.87 0.4 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.302 1.441 . . . . 2.5499999999999998 111.334 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -109.03 -57.18 2.19 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 119.685 -1.884 . . . . 3.3399999999999999 109.988 170.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -52.32 -25.77 10.47 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 131.407 3.883 . . . . 3.0800000000000001 114.269 170.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -51.21 -59.21 4.44 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.422 1.489 . . . . 3.04 111.444 170.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -51.04 -44.71 61.11 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.6 -0.688 . . . . 3.9500000000000002 111.623 176.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 28.4 t-105 -64.52 -46.8 81.36 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.485 -0.769 . . . . 0.65000000000000002 111.996 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.9 t -74.47 -22.88 58.87 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 117.683 -1.151 . . . . 2.79 113.407 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.5 mt -65.68 -44.83 85.01 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.931 1.241 . . . . 1.76 110.331 169.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 27.4 mm -48.96 -43.87 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 CA-C-N 119.94 1.245 . . . . 1.8400000000000001 112.667 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.77 -19.51 43.55 Favored Glycine 0 CA--C 1.537 1.449 0 CA-C-N 119.468 1.031 . . . . 0.68000000000000005 114.07 177.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.11 -19.19 71.79 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 118.885 1.342 . . . . 0.64000000000000001 114.188 172.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -118.41 -43.1 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 CA-C-N 119.117 1.459 . . . . 1.96 110.325 175.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 17.6 m -77.26 52.67 0.94 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.223 1.809 . . . . 2.0299999999999998 109.749 166.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.68 -64.39 0.03 OUTLIER Glycine 0 CA--C 1.528 0.862 0 C-N-CA 126.955 2.216 . . . . 1.1299999999999999 109.912 179.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -63.28 -59.15 0.24 Allowed 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.204 2.603 . . . . 1.3200000000000001 112.624 173.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.1 pt -78.04 -17.55 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 114.028 1.121 . . . . 2.1899999999999999 114.028 -173.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.55 -37.46 75.74 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.308 -0.87 . . . . 2.1800000000000002 112.505 -173.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt -60.91 -29.42 69.58 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 120.639 -1.288 . . . . 6.1100000000000003 113.238 176.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.8 tt -77.85 -23.05 49.04 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.444 1.498 . . . . 2.9500000000000002 112.963 178.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.3 mt -51.75 -48.64 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 118.955 0.798 . . . . 2.0299999999999998 110.466 168.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.41 -33.86 73.1 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 114.194 1.183 . . . . 4.04 114.194 -179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.83 -55.65 24.37 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.328 1.051 . . . . 5.6799999999999997 111.71 172.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -56.56 -46.05 80.95 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.865 0.866 . . . . 2.6400000000000001 113.299 -175.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -80.29 2.41 24.73 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.677 0.791 . . . . 2.9100000000000001 111.797 -175.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.85 -51.03 3.52 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.734 0.813 . . . . 2.1699999999999999 111.041 162.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -58.06 -22.29 49.53 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.642 0.978 . . . . 5.5599999999999996 113.642 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.6 t -115.29 22.92 12.87 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.905 1.682 . . . . 8.3699999999999992 112.72 173.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.1 t -76.64 8.64 3.4 Favored 'General case' 0 CA--C 1.55 0.955 0 O-C-N 120.197 -1.564 . . . . 11.039999999999999 115.051 -176.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.254 1.308 0 C-N-CA 129.57 3.148 . . . . 13.91 110.106 -178.952 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 106.298 -1.741 . . . . 10.9 106.298 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -58.42 -118.03 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 108.086 -1.079 . . . . 6.8300000000000001 108.086 127.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 61.0 m -76.79 -116.17 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.545 1.538 . . . . 4.6399999999999997 108.753 157.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 132.76 155.77 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.174 1 C-N-CA 132.917 4.487 . . . . 3.4300000000000002 112.695 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 66.1 p -71.66 150.57 44.45 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.312 0.645 . . . . 1.98 110.006 164.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -53.47 -36.9 62.15 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.312 1.045 . . . . 2.3399999999999999 111.097 175.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.61 -42.88 93.64 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.719 1.608 . . . . 1.9199999999999999 111.726 178.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -51.47 24.93 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 121.401 -0.812 . . . . 3.3500000000000001 110.323 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -55.14 -30.36 59.64 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.423 1.089 . . . . 5.8099999999999996 112.125 172.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.65 -44.26 62.1 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.563 -1.335 . . . . 1.77 113.221 170.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 54.0 t -59.18 -39.33 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 120.877 1.671 . . . . 1.79 109.834 172.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 63.1 mt -54.77 -57.79 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.853 -1.07 . . . . 1.8200000000000001 110.824 167.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 5.6 t -56.55 -39.35 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 CA-C-N 120.502 1.501 . . . . 1.8500000000000001 113.035 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.67 -40.42 84.46 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.359 -0.838 . . . . 1.9099999999999999 111.953 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 68.7 t -72.74 -34.51 47.35 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.635 0 C-N-CA 123.51 0.724 . . . . 1.95 110.987 177.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -65.22 -41.82 94.04 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.523 1.129 . . . . 3.0600000000000001 112.281 172.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . 0.422 HD22 ' CG ' ' B' ' 144' ' ' MET . 40.0 t30 -58.67 -24.03 60.48 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.961 -1.087 . . . . 2.21 113.603 173.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -84.67 -61.12 1.87 Allowed 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.13 -0.981 . . . . 3.4900000000000002 112.674 172.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -68.1 -14.67 63.15 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.44 0.904 . . . . 3.29 113.44 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mttp -32.61 -48.14 0.18 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 127.156 2.182 . . . . 3.1400000000000001 113.349 164.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -97.64 6.78 47.53 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.371 1.468 . . . . 3.5 113.235 -172.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 45.9 t -109.63 135.29 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.238 1.015 . . . . 4.1699999999999999 109.982 -171.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.3 m -48.7 -44.32 37.92 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.672 1.189 . . . . 3.8799999999999999 112.286 -178.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.01 -42.42 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.599 1.96 . . . . 5.8799999999999999 111.235 166.434 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -145.8 -53.85 0.27 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.871 0.869 . . . . 7.9900000000000002 111.223 171.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 22.5 m 65.11 -9.44 0.2 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 127.046 2.138 . . . . 5.1600000000000001 115.667 170.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 77.9 mt 59.25 -73.75 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 129.713 3.205 . . . . 7.4299999999999997 112.349 179.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 3.8 p -177.06 7.95 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.072 0 C-N-CA 127.835 2.454 . . . . 5.6399999999999997 113.112 -153.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -72.62 -21.58 61.09 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 119.742 -1.849 . . . . 10.18 115.898 -173.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 169.42 -60.28 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 128.975 2.91 . . . . 9.8900000000000006 107.713 -170.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 37.9 tttt 65.03 -107.95 0.16 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 117.633 -1.175 . . . . 11.279999999999999 110.807 162.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 31.6 pt -131.37 131.76 63.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-N 120.717 1.599 . . . . 3.2799999999999998 109.375 176.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 15.2 m -64.47 140.76 58.9 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.171 -0.956 . . . . 3.0699999999999998 112.212 178.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -60.71 -16.73 42.73 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.606 1.335 . . . . 3.8500000000000001 114.606 -169.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 14.3 p -56.76 -33.95 67.11 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.583 -1.323 . . . . 2.5899999999999999 112.48 168.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 63.9 m -57.93 -28.47 64.31 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.862 -1.149 . . . . 2.29 113.293 174.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . 0.404 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 73.8 t80 -62.14 -63.15 1.34 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.295 1.407 . . . . 3.21 111.735 175.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -60.1 -20.8 60.02 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.585 0.754 . . . . 2.6400000000000001 112.02 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . 0.424 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 26.7 mt-10 -90.24 -50.26 6.08 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 117.8 -1.095 . . . . 3.6200000000000001 112.482 -175.193 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 144' ' ' MET . . . . . 0.422 ' CG ' HD22 ' B' ' 121' ' ' ASN . 0.0 OUTLIER -55.06 -32.07 61.63 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.092 0.86 . . . . 1.8999999999999999 111.54 164.248 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 10.0 mt -61.05 -52.26 65.69 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.247 -0.908 . . . . 1.96 112.039 168.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.03 -18.95 60.78 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.643 1.11 . . . . 3.1200000000000001 113.242 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 2.0 mppt? -92.02 -48.66 6.63 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.972 1.309 . . . . 3.6200000000000001 111.232 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -93.57 -28.39 16.07 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.518 1.508 . . . . 2.9900000000000002 114.901 -175.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 60.0 mt -104.79 25.07 10.85 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.66 1.184 . . . . 2.9700000000000002 112.201 172.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -54.51 -10.4 0.41 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.84 2.056 . . . . 1.46 116.319 -173.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.64 -64.39 1.15 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.99 -1.069 . . . . 2.5800000000000001 110.509 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.7 ptp -59.26 -33.17 70.72 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.063 0.847 . . . . 3.0 113.005 170.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 2.3 mp -86.79 67.78 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 123.445 1.593 . . . . 5.1100000000000003 110.212 170.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 3.3 m -74.06 -11.16 60.24 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 112.873 -1.967 . . . . 4.1399999999999997 114.978 -157.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -175.72 164.99 3.05 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.298 2.239 . . . . 5.4299999999999997 110.301 178.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 9.3 m -29.15 -48.99 0.07 Allowed 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 130.167 3.387 . . . . 3.8100000000000001 113.861 160.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -63.75 -32.96 85.92 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-N 119.857 1.208 . . . . 3.0 113.863 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -77.44 -49.16 15.39 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.757 1.223 . . . . 2.77 109.202 170.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 17.4 ttp180 -50.08 -29.36 8.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.078 1.751 . . . . 5.8200000000000003 114.78 179.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 32.9 mtmt -49.83 -30.68 10.25 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.34 1.427 . . . . 5.6699999999999999 114.308 170.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.68 -20.86 52.97 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.363 1.246 . . . . 1.98 114.363 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -77.49 -52.5 8.97 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.151 0.887 . . . . 1.79 110.675 162.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -61.98 -34.26 75.81 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.387 0.675 . . . . 2.0099999999999998 112.759 -175.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.35 -30.27 64.69 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.396 -0.815 . . . . 3.6600000000000001 112.958 174.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 38.4 mt -74.8 -34.25 62.36 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.649 -0.657 . . . . 1.8200000000000001 111.244 -178.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 28.7 mm -61.84 -48.73 87.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.247 1.019 . . . . 1.8 110.479 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -64.91 -40.93 95.83 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.773 1.229 . . . . 4.0599999999999996 112.32 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -61.0 -26.11 67.37 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.053 1.341 . . . . 3.4300000000000002 113.838 171.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -83.58 -80.13 0.19 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 117.368 -1.301 . . . . 3.4199999999999999 109.465 169.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -50.08 -33.08 17.33 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 120.513 1.506 . . . . 3.46 114.602 -160.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -53.51 -21.01 5.57 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 115.274 1.583 . . . . 4.1299999999999999 115.274 173.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -128.83 9.71 5.89 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.033 1.733 . . . . 4.96 113.494 168.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.8 6.3 0.91 Allowed 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 116.397 1.999 . . . . 5.0700000000000003 116.397 -159.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -50.96 144.42 8.72 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 122.226 1.012 . . . . 7.0800000000000001 112.7 172.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 71.56 -20.44 0.8 Allowed Glycine 0 CA--C 1.535 1.313 0 C-N-CA 126.211 1.862 . . . . 2.9900000000000002 114.925 -173.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -99.79 135.11 41.7 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.418 1.487 . . . . 6.0800000000000001 110.422 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.3 mm -145.22 113.71 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 107.023 -1.473 . . . . 3.7000000000000002 107.023 177.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 2.4 t -87.19 -173.14 4.27 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.678 1.126 . . . . 2.04 113.14 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -92.89 -56.62 2.93 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.031 -1.668 . . . . 3.3199999999999998 110.769 172.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -61.33 -23.55 65.81 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 129.048 2.939 . . . . 3.02 113.138 176.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -47.62 -58.92 3.68 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.492 1.517 . . . . 3.1499999999999999 110.856 167.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -51.99 -45.52 64.53 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 120.931 -1.106 . . . . 3.7999999999999998 112.372 177.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.3 t-105 -65.82 -47.37 75.25 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.65 -0.69 . . . . 0.65000000000000002 111.875 -178.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 8.2 t -72.7 -24.1 60.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 117.684 -1.15 . . . . 2.75 112.975 177.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . 0.404 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 82.5 mt -65.82 -45.24 83.02 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.882 1.219 . . . . 1.6599999999999999 110.815 170.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 34.9 mm -48.03 -43.42 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 CA-C-N 120.734 1.606 . . . . 1.8600000000000001 112.51 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -58.59 -19.57 42.55 Favored Glycine 0 CA--C 1.538 1.476 0 CA-C-N 118.57 0.623 . . . . 0.72999999999999998 114.497 177.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.74 -19.36 79.24 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 118.619 1.209 . . . . 0.77000000000000002 114.147 174.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -117.1 -47.79 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 118.829 1.314 . . . . 2.2999999999999998 110.108 177.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 20.7 m -74.23 50.68 0.4 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.679 1.991 . . . . 2.0899999999999999 109.573 166.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -138.97 -64.48 0.04 OUTLIER Glycine 0 CA--C 1.527 0.815 0 C-N-CA 127.022 2.249 . . . . 1.1000000000000001 109.481 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -62.0 -54.44 1.5 Allowed 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.198 2.599 . . . . 1.3400000000000001 112.8 172.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 4.2 pt -84.78 -19.38 8.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 N-CA-C 114.672 1.36 . . . . 2.3100000000000001 114.672 -175.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -53.33 -43.0 67.31 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.963 0.905 . . . . 2.4199999999999999 112.498 -174.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -54.45 -27.93 40.77 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.167 1.173 . . . . 5.8600000000000003 114.167 175.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.22 -19.07 61.78 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.443 1.897 . . . . 2.4100000000000001 111.735 178.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 98.2 mt -57.68 -43.71 84.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 O-C-N 120.062 -1.649 . . . . 2.8500000000000001 110.561 166.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -74.89 -0.39 18.38 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 115.145 1.535 . . . . 4.3200000000000003 115.145 177.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -88.63 -66.09 0.95 Allowed 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.568 1.147 . . . . 4.9400000000000004 111.2 153.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -54.65 -44.94 73.69 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 114.301 1.223 . . . . 2.3799999999999999 114.301 -167.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -80.86 10.71 4.66 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 123.026 1.393 . . . . 2.73 111.006 -175.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -114.65 -54.07 2.6 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.432 1.493 . . . . 2.9700000000000002 109.885 166.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -57.07 -19.11 17.36 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.153 2.181 . . . . 6.0599999999999996 113.887 178.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 34.4 t -123.97 28.76 6.7 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.324 1.849 . . . . 8.1799999999999997 112.187 172.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 42.4 t -76.51 3.4 11.39 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 119.885 -1.76 . . . . 11.01 115.044 179.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 38.4 t . . . . . 0 C--O 1.252 1.196 0 C-N-CA 128.097 2.559 . . . . 13.6 111.073 -176.961 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 CA--C 1.504 -0.821 0 N-CA-C 108.889 -0.782 . . . . 10.49 108.889 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -136.88 -15.78 1.52 Allowed 'General case' 0 N--CA 1.472 0.661 0 O-C-N 124.997 1.436 . . . . 6.04 113.585 -134.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 71.4 m 66.39 20.33 10.96 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 127.264 2.226 . . . . 4.4400000000000004 115.364 164.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -42.0 125.95 3.08 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.394 1.877 . . . . 3.8900000000000001 114.517 -178.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.5 p -66.4 147.84 52.72 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.187 0.595 . . . . 2.4100000000000001 109.915 164.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -67.12 -17.8 65.03 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 119.276 -0.392 . . . . 2.2799999999999998 111.712 170.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.6 -48.94 62.86 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.617 1.098 . . . . 2.02 110.062 173.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -51.39 66.99 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.421 -0.585 . . . . 3.3700000000000001 109.421 175.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -53.89 -37.1 63.39 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.764 0.653 . . . . 4.9900000000000002 112.764 176.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.58 -37.95 88.21 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 117.609 -1.186 . . . . 2.1000000000000001 112.896 172.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 16.8 t -58.52 -44.93 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-N 120.914 1.688 . . . . 2.1200000000000001 110.516 168.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.8 mt -54.69 -46.93 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 CA-C-N 118.765 0.711 . . . . 2.0299999999999998 110.663 172.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 42.0 t -69.09 -40.49 80.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 124.057 0.943 . . . . 1.8600000000000001 112.994 -176.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -62.74 -39.85 95.41 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.122 -0.986 . . . . 1.97 111.051 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 84.1 t -74.76 -38.14 43.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.72 0.808 . . . . 1.6399999999999999 112.582 177.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -51.12 -52.16 46.43 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.015 0.926 . . . . 3.1699999999999999 109.848 168.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -60.38 -30.66 69.72 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.486 1.291 . . . . 2.2400000000000002 114.486 -175.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -80.81 -54.16 5.85 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.225 -0.922 . . . . 3.0600000000000001 111.812 175.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -69.63 -23.44 63.5 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.734 1.013 . . . . 3.6200000000000001 113.734 -174.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 42.2 pttt -60.74 -9.25 3.73 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 115.712 1.745 . . . . 3.0499999999999998 115.712 175.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -107.03 2.28 24.94 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.877 1.271 . . . . 3.6200000000000001 114.264 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.2 m -126.28 170.14 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 120.111 1.323 . . . . 3.6800000000000002 110.987 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -67.47 -30.18 69.82 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 116.024 1.861 . . . . 4.9500000000000002 116.024 -177.073 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 ttpm? 107.84 -30.65 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 131.297 3.839 . . . . 6.1100000000000003 111.952 -160.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -143.02 101.7 3.87 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.536 1.534 . . . . 8.3900000000000006 112.617 -177.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 p -169.59 150.03 4.02 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.594 2.358 . . . . 4.7999999999999998 107.246 157.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 90.0 mt -75.21 -61.0 2.05 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 118.739 0.7 . . . . 8.4800000000000004 109.125 162.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.9 t -144.39 72.19 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 124.486 1.114 . . . . 5.79 110.273 178.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -124.5 -21.97 4.76 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 118.122 -0.942 . . . . 9.2100000000000009 113.482 160.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -163.14 61.51 0.18 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.903 1.281 . . . . 7.9400000000000004 111.116 178.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.46 169.9 14.06 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.505 1.122 . . . . 7.0599999999999996 111.806 168.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.2 pt -75.59 140.59 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 O-C-N 120.985 -1.072 . . . . 3.6200000000000001 110.28 163.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.0 m -92.97 152.15 19.5 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.624 -0.672 . . . . 3.3599999999999999 110.457 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.409 ' HZ1' ' C ' ' A' ' 66' ' ' LEU . 19.1 mtpt -52.48 -33.18 43.57 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.324 1.45 . . . . 3.54 114.768 -176.395 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.3 t -69.59 -23.35 63.52 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.545 1.313 . . . . 2.6299999999999999 114.545 172.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.1 m -77.19 -44.48 29.99 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.85 1.205 . . . . 1.5 111.385 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -51.49 -54.2 29.63 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.416 1.007 . . . . 3.1800000000000002 111.85 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -57.88 -27.03 62.9 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.91 1.078 . . . . 3.3999999999999999 113.91 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -94.98 -48.8 5.83 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.63 1.572 . . . . 2.8700000000000001 110.74 -171.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -49.5 -40.12 36.47 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.713 2.405 . . . . 1.8899999999999999 112.24 165.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.1 mt -60.25 -20.27 58.22 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.948 1.462 . . . . 1.98 114.948 176.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -92.82 -14.33 27.93 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.592 1.157 . . . . 2.5899999999999999 112.428 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.36 -53.54 3.89 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.553 1.141 . . . . 2.2999999999999998 112.599 172.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -78.34 -16.7 57.43 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.55 -0.719 . . . . 2.5299999999999998 112.287 -174.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.51 24.88 9.66 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.427 1.891 . . . . 2.8500000000000001 111.576 179.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -61.94 -39.09 90.87 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.405 2.002 . . . . 1.6200000000000001 116.405 -162.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.505 ' H ' ' CD2' ' A' ' 48' ' ' HIS . 0.5 OUTLIER -69.58 -19.8 63.66 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.975 1.262 . . . . 2.1400000000000001 113.228 -174.036 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 52.0 tpp -77.64 -26.55 50.57 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.233 1.813 . . . . 2.8100000000000001 113.016 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.0 mp -56.75 111.57 1.05 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.069 0.948 . . . . 3.46 110.399 174.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.2 m -100.73 -3.89 29.24 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.364 1.066 . . . . 3.7000000000000002 111.769 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -178.75 175.46 1.06 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 131.366 3.866 . . . . 3.8100000000000001 106.768 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -53.99 -26.08 24.21 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 117.021 -1.466 . . . . 4.7400000000000002 111.78 160.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -51.53 -39.96 46.23 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 127.344 2.402 . . . . 2.0699999999999998 115.0 -174.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -57.07 -47.63 80.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 117.951 0.875 . . . . 3.7200000000000002 110.78 170.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -70.98 -32.24 69.03 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.392 0.677 . . . . 6.2699999999999996 112.207 175.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -58.84 -38.01 77.73 Favored 'General case' 0 N--CA 1.481 1.078 0 O-C-N 119.516 -1.99 . . . . 4.21 111.334 173.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.77 -14.22 62.36 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.059 1.503 . . . . 2.1800000000000002 115.059 172.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.64 -53.83 5.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.389 0.995 . . . . 2.1800000000000002 110.82 164.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.47 -34.98 69.58 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.965 0.906 . . . . 2.0600000000000001 112.866 -177.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -61.34 -24.31 66.36 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.682 0.993 . . . . 3.5800000000000001 113.682 174.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.5 mt -78.63 -37.5 42.03 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.257 -0.902 . . . . 1.74 111.135 174.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.4 mm -58.19 -44.6 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.196 0.998 . . . . 1.96 111.558 -176.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -67.22 -38.8 85.87 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.234 1.813 . . . . 2.9500000000000002 113.173 176.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -62.56 -27.65 69.33 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.916 -0.49 . . . . 4.4900000000000002 111.972 172.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.409 ' C ' ' HZ1' ' A' ' 35' ' ' LYS . 7.4 mp -86.82 -19.89 28.33 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 113.565 0.95 . . . . 4.71 113.565 174.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.49 -25.21 67.89 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 120.419 1.463 . . . . 3.6200000000000001 111.507 168.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.2 -10.79 59.79 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.474 1.287 . . . . 3.1099999999999999 114.474 170.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -136.79 -14.08 1.65 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.805 1.78 . . . . 2.71 115.805 -171.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -155.45 119.02 4.45 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 121.195 1.816 . . . . 3.6800000000000002 114.036 -159.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.9 40.28 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 130.375 3.47 . . . . 4.4400000000000004 116.563 -170.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.18 13.4 76.51 Favored Glycine 0 CA--C 1.537 1.415 0 O-C-N 119.502 -1.999 . . . . 5.1299999999999999 114.283 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -86.38 -171.51 3.59 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.212 1.405 . . . . 8.0199999999999996 108.303 155.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 41.9 pt -147.94 161.6 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.966 1.706 . . . . 5.4800000000000004 107.911 150.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.8 m -74.08 169.1 18.2 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 112.745 0.646 . . . . 2.3700000000000001 112.745 164.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -63.1 -52.91 60.79 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.07 -1.019 . . . . 3.1200000000000001 111.069 169.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.6 -33.76 60.92 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 128.142 2.577 . . . . 3.0800000000000001 113.224 172.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.83 -38.99 76.7 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 118.44 -0.791 . . . . 4.1500000000000004 112.622 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -53.09 -47.31 68.67 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.655 1.571 . . . . 2.8300000000000001 110.393 172.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 28.5 t-105 -64.55 -45.86 85.29 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 118.455 -0.783 . . . . 0.69999999999999996 111.987 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.13 -40.64 98.19 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.549 1.068 . . . . 2.4900000000000002 112.039 -177.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 91.1 mt -63.88 -34.11 77.2 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.839 -0.6 . . . . 1.77 112.1 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.45 -36.21 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 119.896 1.225 . . . . 1.8300000000000001 111.6 179.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.48 -18.02 67.25 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.929 1.252 . . . . 0.66000000000000003 114.41 178.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.47 -29.58 59.66 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-N 119.007 1.404 . . . . 0.84999999999999998 112.737 176.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.8 mp -86.95 -45.14 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.264 1.026 . . . . 1.8500000000000001 109.537 168.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.4 m -82.55 57.28 3.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 127.546 2.338 . . . . 1.8799999999999999 109.989 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -132.74 -67.56 0.08 OUTLIER Glycine 0 CA--C 1.527 0.793 0 C-N-CA 125.825 1.678 . . . . 1.0700000000000001 110.093 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -66.02 -51.77 1.11 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.269 2.646 . . . . 1.1100000000000001 112.576 175.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.6 pt -71.84 -17.83 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 N-CA-C 113.95 1.093 . . . . 2.0800000000000001 113.95 -175.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -50.36 -55.73 14.38 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.763 0.825 . . . . 1.74 111.994 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -61.84 -32.69 73.04 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 120.569 -1.332 . . . . 3.9300000000000002 113.168 176.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.0 tt -60.39 -40.79 92.17 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 121.146 1.794 . . . . 2.4100000000000001 111.024 178.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 74.7 mt -53.84 -54.46 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-O 122.156 0.979 . . . . 2.1299999999999999 110.429 172.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -67.76 -28.38 67.57 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.228 -0.92 . . . . 1.72 113.279 -177.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -73.88 -29.2 61.96 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.597 1.159 . . . . 3.6200000000000001 111.356 173.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.525 ' C ' ' H ' ' A' ' 99' ' ' GLN . 12.8 mm100 -74.16 -42.5 59.81 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.288 1.035 . . . . 2.1299999999999999 111.538 174.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -73.47 17.28 0.15 Allowed 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 123.736 1.731 . . . . 2.96 112.211 172.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.525 ' H ' ' C ' ' A' ' 97' ' ' GLN . 2.6 mm-40 -124.5 -67.87 0.89 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.522 1.529 . . . . 2.6000000000000001 110.398 161.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . 0.317 10.4 pt20 42.36 19.66 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 130.437 3.495 . . . . 5.4400000000000004 115.141 -171.52 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 3.3 m -146.94 29.26 1.0 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.977 2.511 . . . . 7.1699999999999999 109.093 -174.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.1 t -79.61 0.0 31.89 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 120.049 -1.657 . . . . 9.1899999999999995 114.849 -175.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 45.9 t . . . . . 0 C--O 1.252 1.188 1 C-N-CA 132.249 4.22 . . . . 11.0 107.461 -166.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 20.4 m . . . . . 0 CA--C 1.504 -0.8 0 N-CA-C 108.704 -0.85 . . . . 10.470000000000001 108.704 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -135.51 -16.26 1.82 Allowed 'General case' 0 N--CA 1.47 0.568 0 O-C-N 124.935 1.397 . . . . 5.6600000000000001 113.549 -134.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 94.2 m 54.03 43.77 30.29 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.841 2.056 . . . . 4.5 113.858 168.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -53.07 132.49 38.12 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.327 1.051 . . . . 4.21 112.36 -179.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 8.3 p -62.68 152.3 35.84 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.223 -0.658 . . . . 2.1400000000000001 109.223 173.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -63.85 -27.54 69.24 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 118.415 -0.802 . . . . 2.52 111.489 170.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.56 -46.46 85.8 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.759 1.618 . . . . 1.96 109.83 176.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -50.15 32.2 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.597 -0.69 . . . . 2.9300000000000002 111.142 -177.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -48.74 -38.66 22.27 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.804 1.241 . . . . 5.7800000000000002 113.255 167.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.98 -42.9 94.14 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 120.783 -1.198 . . . . 1.9299999999999999 113.233 171.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 14.0 t -55.74 -42.58 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 CA-C-N 120.917 1.689 . . . . 2.23 110.666 170.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 59.9 mt -56.4 -51.22 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 118.638 -0.696 . . . . 2.21 110.189 172.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 36.1 t -65.79 -36.6 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.346 0.975 . . . . 1.77 113.342 -176.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -64.26 -37.97 89.37 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.997 -1.064 . . . . 1.99 111.44 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 89.3 t -83.21 -35.32 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 118.619 -0.705 . . . . 1.6100000000000001 112.396 -178.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -51.16 -54.98 20.33 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.511 1.125 . . . . 3.3300000000000001 109.634 165.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -57.78 -37.56 73.92 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 113.207 0.817 . . . . 2.3300000000000001 113.207 -176.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -76.59 -55.87 5.13 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 122.02 -0.425 . . . . 3.6400000000000001 110.785 -177.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -68.15 -24.05 64.94 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.675 0.991 . . . . 3.6600000000000001 113.675 -175.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -56.81 -16.21 6.17 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 120.979 1.718 . . . . 2.8700000000000001 115.137 176.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -90.69 -0.7 57.78 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.824 1.787 . . . . 3.3199999999999998 115.824 173.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.6 m -128.38 177.24 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 125.075 1.35 . . . . 3.5299999999999998 109.787 176.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.4 p -69.98 -28.97 65.96 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 116.666 -1.635 . . . . 4.6699999999999999 115.373 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 4.3 ttpm? 111.62 -26.82 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 130.879 3.672 . . . . 6.21 111.852 -156.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -148.11 105.16 3.62 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.811 1.244 . . . . 8.4100000000000001 114.094 -173.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 3.8 p -168.63 149.31 4.63 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 127.572 2.349 . . . . 4.9400000000000004 107.74 155.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 93.8 mt -74.87 -61.77 1.77 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 119.321 0.964 . . . . 8.3300000000000001 109.731 163.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 21.3 t -147.21 71.22 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.128 1.371 . . . . 5.9699999999999998 109.002 -177.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -132.79 -15.29 2.7 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.168 1.387 . . . . 9.2599999999999998 114.266 164.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -159.91 30.22 0.18 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.798 0.839 . . . . 8.0700000000000003 112.609 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.83 151.09 43.72 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 120.48 -1.388 . . . . 7.0199999999999996 111.956 176.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 28.5 pt -63.83 151.38 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 120.899 -1.125 . . . . 3.25 111.092 176.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 20.6 m -91.26 155.14 18.77 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 120.396 -1.44 . . . . 2.9399999999999999 110.737 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -55.48 -30.75 61.16 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.016 0.926 . . . . 3.6200000000000001 113.118 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 39.3 t -69.18 -20.4 64.0 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 115.31 1.596 . . . . 2.7799999999999998 115.31 170.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 16.4 m -74.49 -41.46 60.67 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 120.638 1.563 . . . . 1.54 111.444 176.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -56.35 -53.46 57.08 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 118.906 0.776 . . . . 3.46 111.29 -178.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.4 ptt180 -57.12 -23.62 48.41 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.109 0.964 . . . . 3.3199999999999998 113.092 178.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 tm-20 -99.48 -45.11 5.93 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.024 1.33 . . . . 2.9300000000000002 112.131 -173.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 11.9 tmm? -51.62 -36.44 45.83 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.062 1.745 . . . . 1.76 112.175 167.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 12.4 mt -65.94 -12.4 54.5 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 115.917 1.821 . . . . 2.0699999999999998 115.917 172.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -86.26 -25.14 25.7 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 123.826 0.85 . . . . 2.4500000000000002 112.592 169.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.02 -61.39 1.41 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.761 1.624 . . . . 2.4399999999999999 112.45 -175.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -70.51 -16.12 62.86 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.604 0.761 . . . . 2.6400000000000001 111.658 -175.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.83 17.12 11.85 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.683 1.993 . . . . 2.79 113.472 177.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -49.49 -37.73 27.49 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.468 1.655 . . . . 1.78 115.468 -171.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . 0.417 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 12.3 m-70 -63.45 -28.46 69.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.882 1.273 . . . . 2.3500000000000001 113.917 -175.548 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 60.1 tpp -81.79 -22.88 36.89 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.177 1.391 . . . . 2.6499999999999999 113.421 -172.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 11.2 mp -58.13 116.32 3.47 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.251 1.42 . . . . 3.5699999999999998 111.024 176.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 45.9 m -97.46 -4.85 37.32 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.836 0.854 . . . . 3.7999999999999998 112.616 172.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 12.4 t70 175.71 179.23 0.16 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 129.939 3.295 . . . . 3.9500000000000002 106.694 -168.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 12.4 t -55.49 -26.23 41.5 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 116.931 -1.509 . . . . 4.6299999999999999 112.077 160.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -51.32 -46.1 52.23 Favored Glycine 0 N--CA 1.471 1.023 0 C-N-CA 126.468 1.985 . . . . 2.1600000000000001 115.46 -171.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -53.81 -45.05 70.68 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.244 1.022 . . . . 3.6899999999999999 111.173 171.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.7 ttt-85 -74.13 -33.78 63.67 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.516 0.726 . . . . 5.9400000000000004 111.99 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 60.0 mmtt -56.62 -38.18 71.72 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 120.82 1.645 . . . . 4.0599999999999996 111.448 172.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -65.49 -14.46 61.06 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 115.089 1.515 . . . . 2.2599999999999998 115.089 173.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -85.67 -50.62 7.05 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.565 1.075 . . . . 2.2000000000000002 111.886 165.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.61 -37.63 76.29 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.957 0.903 . . . . 2.1400000000000001 112.458 -178.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -60.42 -25.29 65.85 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.506 0.928 . . . . 3.5299999999999998 113.506 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 15.6 mt -76.21 -37.7 57.41 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.13 -0.981 . . . . 1.8799999999999999 111.123 176.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 28.1 mm -57.13 -43.73 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.076 0.95 . . . . 2.0 111.337 -175.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -69.32 -41.11 77.15 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.505 1.922 . . . . 3.1200000000000001 113.054 175.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -59.53 -27.18 65.97 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.862 -0.524 . . . . 4.5999999999999996 112.138 170.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 6.2 mp -86.57 -19.62 29.15 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 114.227 1.195 . . . . 4.3700000000000001 114.227 174.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -22.71 67.04 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 120.296 1.407 . . . . 3.77 112.026 167.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -74.59 -9.56 58.69 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.309 1.225 . . . . 3.3399999999999999 114.309 168.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -138.0 -14.95 1.35 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 116.455 2.02 . . . . 2.77 116.455 -170.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -154.7 122.06 5.68 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 121.079 1.763 . . . . 3.77 114.187 -159.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -71.75 41.81 0.08 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 128.936 2.894 . . . . 4.4299999999999997 116.034 -171.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 76.32 0.36 66.26 Favored Glycine 0 CA--C 1.534 1.269 0 O-C-N 119.996 -1.69 . . . . 5.0999999999999996 114.195 177.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -78.94 -175.47 4.53 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.309 1.444 . . . . 8.0199999999999996 108.826 160.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 16.6 pt -147.51 155.74 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 128.098 2.559 . . . . 5.2699999999999996 106.871 158.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 4.2 m -77.65 -177.53 4.86 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.464 0.706 . . . . 2.4399999999999999 112.687 165.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -69.51 -54.27 15.0 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 122.281 1.038 . . . . 3.3199999999999998 110.462 169.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.68 -37.35 18.3 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 128.99 2.916 . . . . 3.1400000000000001 113.7 172.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -66.96 -42.97 84.27 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.14 0.976 . . . . 4.7000000000000002 112.886 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -53.8 -47.4 70.86 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.362 -1.462 . . . . 3.02 111.176 173.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 28.7 t-105 -63.41 -45.07 92.69 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 118.621 -0.704 . . . . 0.82999999999999996 111.484 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.91 -41.71 97.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.734 0.814 . . . . 2.4199999999999999 111.569 -179.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.0 mt -64.82 -33.44 76.01 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.399 -0.81 . . . . 1.8700000000000001 112.446 179.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 36.8 mm -56.98 -34.66 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 CA-C-N 120.698 1.59 . . . . 1.8100000000000001 111.823 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.66 -20.19 69.89 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 124.292 0.949 . . . . 0.66000000000000003 114.079 176.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.78 -27.6 68.74 Favored Glycine 0 CA--C 1.529 0.916 0 CA-C-N 118.282 1.041 . . . . 0.76000000000000001 113.218 177.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -89.82 -42.75 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.446 1.099 . . . . 1.8999999999999999 110.127 167.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 6.2 m -83.14 57.34 3.89 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.935 2.094 . . . . 1.8799999999999999 110.5 -177.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -126.17 -71.64 0.19 Allowed Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.831 1.682 . . . . 1.1499999999999999 110.57 177.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.5 -44.19 1.15 Allowed 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 123.017 2.478 . . . . 1.2 112.71 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 12.9 pt -72.0 -22.35 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 119.091 0.859 . . . . 2.25 113.128 -173.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -45.41 -62.65 1.19 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.374 1.47 . . . . 1.7 112.988 177.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -64.37 -26.82 68.64 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 120.539 -1.351 . . . . 4.5199999999999996 113.36 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.47 -41.78 97.76 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.796 1.634 . . . . 2.4399999999999999 110.621 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 53.4 mt -53.69 -56.06 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-O 121.867 0.842 . . . . 2.3900000000000001 110.682 170.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 43.4 t60 -63.19 -28.95 70.4 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.09 1.144 . . . . 1.8200000000000001 114.09 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -74.43 -28.24 60.97 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.796 1.238 . . . . 3.71 111.657 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . 0.527 ' C ' ' H ' ' B' ' 202' ' ' GLN . 2.8 mm100 -74.72 -40.56 61.24 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.501 1.12 . . . . 2.25 111.164 171.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -73.2 19.59 0.09 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 126.662 1.985 . . . . 2.8799999999999999 112.293 170.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.527 ' H ' ' C ' ' B' ' 200' ' ' GLN . 1.6 mm-40 -127.97 -61.68 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 125.238 1.415 . . . . 2.8500000000000001 109.652 159.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.307 12.2 pt20 41.71 18.66 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 130.127 3.371 . . . . 5.75 115.366 -171.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 1.9 m -146.59 27.49 1.11 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 127.769 2.428 . . . . 7.1299999999999999 109.607 -174.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 33.4 t -81.74 4.15 23.05 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 119.869 -1.769 . . . . 9.2200000000000006 114.211 -178.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 48.5 t . . . . . 0 C--O 1.251 1.135 1 C-N-CA 132.527 4.331 . . . . 10.76 107.303 -166.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.0 m . . . . . 0 CA--C 1.508 -0.642 0 CA-C-O 117.14 -1.409 . . . . 11.9 108.51 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 72.43 -53.01 0.7 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.957 2.206 . . . . 9.9399999999999995 116.957 130.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 21.2 m 136.62 -31.56 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 1 C-N-CA 134.064 4.946 . . . . 4.3300000000000001 109.304 -173.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.57 142.5 42.72 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.135 1.374 . . . . 4.1200000000000001 110.476 165.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 60.1 p -65.7 148.87 51.05 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 120.142 1.337 . . . . 2.02 110.138 168.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -63.71 -36.65 84.56 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.743 -0.598 . . . . 2.0899999999999999 111.644 -175.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.72 -48.39 80.95 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.273 1.429 . . . . 2.3900000000000001 110.031 174.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -72.82 -43.52 62.58 Favored 'General case' 0 C--O 1.23 0.072 0 CA-C-N 118.142 0.428 . . . . 3.6699999999999999 111.442 -173.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -48.51 -42.86 34.34 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.921 1.288 . . . . 6.1500000000000004 111.432 163.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.96 -30.22 65.07 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 116.762 -1.59 . . . . 1.8400000000000001 114.511 175.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.7 t -55.59 -33.81 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 CA-C-N 122.447 2.385 . . . . 2.0600000000000001 111.095 167.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 16.8 mt -56.89 -63.34 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 CA-C-N 119.588 1.085 . . . . 2.5 111.401 162.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.7 t -50.1 -43.31 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.095 1.358 . . . . 1.73 113.279 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.4 mp -66.44 -39.93 89.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.541 1.136 . . . . 2.1200000000000001 112.245 176.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.3 t -68.61 -45.98 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.906 0.883 . . . . 1.8400000000000001 110.258 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.3 tt0 -55.88 -44.86 78.54 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.364 0.529 . . . . 3.1200000000000001 111.027 171.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -69.1 -17.42 63.85 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 115.23 1.567 . . . . 2.3999999999999999 115.23 -170.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -80.74 -61.48 1.96 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.208 0.603 . . . . 3.1699999999999999 111.368 161.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -68.12 -22.9 64.86 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.376 0.88 . . . . 3.1099999999999999 113.376 -164.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -49.1 -24.2 1.53 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 125.018 1.327 . . . . 3.8900000000000001 113.084 170.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -94.43 -2.76 51.36 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.512 1.525 . . . . 3.3900000000000001 114.998 178.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.494 HG23 ' H ' ' A' ' 24' ' ' SER . 16.3 m -130.0 -101.07 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 125.593 1.557 . . . . 2.73 112.8 -178.368 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.494 ' H ' HG23 ' A' ' 23' ' ' VAL . 1.9 p 162.53 159.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 128.905 2.882 . . . . 5.2300000000000004 114.079 -178.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HE3' ' HB2' ' B' ' 199' ' ' GLU . 43.1 tttt -18.34 -64.08 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 129.707 3.203 . . . . 9.1600000000000001 117.342 -170.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -124.99 27.61 6.66 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 126.215 1.806 . . . . 8.7899999999999991 112.759 -178.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.5 m -70.31 45.68 0.08 Allowed 'General case' 0 CA--C 1.55 0.944 0 O-C-N 120.242 -1.536 . . . . 4.7300000000000004 112.555 170.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 71.7 mt -62.17 -23.34 66.54 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 116.573 2.064 . . . . 9.1699999999999999 116.573 -157.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.4 p -126.82 4.72 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 127.391 2.276 . . . . 6.6900000000000004 112.345 170.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.21 105.37 16.48 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.497 1.519 . . . . 8.4800000000000004 112.288 -159.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 t-20 -42.65 126.04 3.52 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.076 1.75 . . . . 8.8100000000000005 112.645 170.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -126.1 8.93 7.36 Favored 'General case' 0 CA--C 1.556 1.177 0 O-C-N 121.13 -0.981 . . . . 10.039999999999999 110.566 145.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.9 pt -150.98 146.75 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 131.147 3.779 . . . . 4.2999999999999998 107.42 175.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.2 m -99.8 168.9 9.6 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 121.69 -0.631 . . . . 3.3399999999999999 111.302 172.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.02 -35.48 15.54 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.835 2.054 . . . . 3.3900000000000001 112.525 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.6 p -55.44 -19.62 9.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.889 2.076 . . . . 2.3399999999999999 114.843 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m -79.17 -46.44 17.93 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.398 0.999 . . . . 3.04 111.253 175.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -51.47 -51.87 51.36 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.556 1.142 . . . . 3.02 111.768 -177.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -52.67 -26.78 14.77 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.177 1.177 . . . . 4.8399999999999999 114.177 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -108.04 -40.08 5.32 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.457 1.103 . . . . 3.7599999999999998 112.792 -172.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -46.32 -46.17 17.97 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.122 0.969 . . . . 1.8300000000000001 110.577 162.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.3 mt -45.85 -67.1 0.31 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.453 1.501 . . . . 2.02 111.703 165.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -67.27 -12.04 59.06 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 115.544 1.683 . . . . 3.1699999999999999 115.544 -172.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.81 -43.44 10.64 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.505 0.928 . . . . 2.5499999999999998 113.505 169.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -104.14 -31.06 9.83 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.761 1.225 . . . . 2.7000000000000002 113.375 -166.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.3 mt -109.34 62.64 0.6 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 127.819 2.448 . . . . 3.7200000000000002 109.838 164.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -94.65 -12.26 27.7 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 115.147 1.536 . . . . 1.3100000000000001 115.147 -177.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 -91.14 -36.76 13.79 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 120.425 -1.422 . . . . 2.3500000000000001 113.014 -173.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.2 mmm -81.31 5.14 18.2 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.302 1.441 . . . . 3.1800000000000002 111.25 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.4 tp -66.88 83.49 0.11 Allowed 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 127.566 2.346 . . . . 4.3399999999999999 110.952 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.6 t -69.38 59.94 0.13 Allowed 'General case' 0 CA--C 1.549 0.94 0 O-C-N 121.281 -0.887 . . . . 5.4900000000000002 111.529 165.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.443 ' CG ' ' H ' ' A' ' 53' ' ' THR . 32.0 t70 51.09 -132.25 1.94 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 129.639 3.176 . . . . 3.9700000000000002 112.879 171.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.443 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 89.1 m -71.42 -36.85 71.44 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 126.665 1.986 . . . . 5.1200000000000001 109.951 -172.3 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.18 -51.35 59.37 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-N 119.518 1.054 . . . . 2.7200000000000002 111.63 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -60.15 -52.31 65.86 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.28 1.032 . . . . 3.96 112.53 174.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.5 ttt-85 -76.65 -31.66 57.48 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.628 -0.67 . . . . 5.6500000000000004 112.608 -170.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -68.2 -32.6 72.94 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 120.112 -1.617 . . . . 4.46 112.33 167.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.68 -19.83 59.46 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.392 1.256 . . . . 1.8400000000000001 114.392 169.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.85 -56.51 4.53 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 119.994 1.27 . . . . 1.6799999999999999 111.869 162.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.96 -31.44 72.55 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.172 1.175 . . . . 2.0899999999999999 114.172 -173.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -57.36 -28.4 63.14 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.35 -0.843 . . . . 3.4199999999999999 113.173 173.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.8 mt -75.37 -43.72 48.89 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.039 0.935 . . . . 1.8100000000000001 110.802 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.0 mm -56.9 -53.65 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.066 1.746 . . . . 2.0499999999999998 110.728 -175.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -58.92 -29.68 67.26 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.997 1.319 . . . . 2.5800000000000001 113.624 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.5 -24.72 42.1 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.484 1.914 . . . . 3.23 113.524 176.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 mt -124.05 -20.56 5.3 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.672 2.101 . . . . 4.3499999999999996 116.672 -168.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -61.89 -25.33 67.49 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.627 1.103 . . . . 3.2999999999999998 110.734 154.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -79.47 -21.29 45.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.53 1.532 . . . . 3.8799999999999999 114.836 171.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -128.58 17.04 6.43 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 119.939 1.245 . . . . 3.8700000000000001 114.031 -174.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -153.78 126.99 8.46 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 120.556 -1.34 . . . . 4.3399999999999999 111.736 173.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.07 59.26 3.22 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.284 2.234 . . . . 5.2999999999999998 114.226 -148.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.65 4.59 26.32 Favored Glycine 0 CA--C 1.534 1.277 0 O-C-N 120.727 -1.233 . . . . 3.27 112.566 -165.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 75.2 mmt-85 -75.29 151.55 38.32 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 127.006 2.122 . . . . 5.8899999999999997 111.413 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.6 mm -140.06 113.52 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 105.134 -2.173 . . . . 3.5699999999999998 105.134 166.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.2 m -79.72 173.68 12.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 118.967 0.803 . . . . 2.1899999999999999 112.153 168.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -55.03 -50.12 69.86 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.828 0.823 . . . . 3.4199999999999999 111.403 156.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.76 -26.58 67.79 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.492 1.917 . . . . 3.3199999999999998 113.994 -174.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -58.94 -55.24 37.68 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.938 1.295 . . . . 3.4900000000000002 110.952 173.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -54.85 -48.36 73.0 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 120.726 -1.234 . . . . 3.8199999999999998 111.668 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 24.6 t-105 -63.02 -44.03 97.08 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.163 0.801 . . . . 0.63 113.163 -177.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.9 t -67.58 -42.68 82.13 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.288 0.949 . . . . 2.8199999999999998 110.997 178.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.1 -39.12 93.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 117.975 -1.012 . . . . 1.8799999999999999 112.337 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 28.7 mm -52.47 -40.58 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 CA-C-N 120.62 1.555 . . . . 1.8400000000000001 111.5 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -68.19 -22.07 74.22 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.843 0.735 . . . . 0.70999999999999996 113.922 -178.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.38 -30.15 76.1 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-N 118.343 1.072 . . . . 0.68000000000000005 112.368 174.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -89.03 -47.73 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.069 0.947 . . . . 1.9099999999999999 109.514 167.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.2 m -83.62 59.35 5.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.327 2.251 . . . . 1.8799999999999999 110.948 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -151.06 -57.35 0.01 OUTLIER Glycine 0 CA--C 1.529 0.95 0 C-N-CA 126.642 2.068 . . . . 1.05 110.974 -178.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.02 -60.46 0.44 Allowed 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.445 2.097 . . . . 1.21 111.569 167.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.2 pt -64.24 -18.32 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 115.425 1.639 . . . . 2.3500000000000001 115.425 -175.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.32 -45.52 69.06 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.282 1.433 . . . . 2.2200000000000002 113.026 -175.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -60.75 -36.76 79.72 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.618 0.767 . . . . 6.25 112.786 178.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.3 tt -75.15 -44.59 46.03 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.702 1.601 . . . . 2.1600000000000001 109.875 -176.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 42.2 mt -52.51 -60.58 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.495 0.718 . . . . 2.1699999999999999 109.491 168.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -55.52 -40.54 71.94 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 118.42 -0.8 . . . . 2.1400000000000001 112.99 -176.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.436 ' HB2' ' HE3' ' B' ' 128' ' ' LYS . 11.8 pt-20 -69.66 -36.7 76.27 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 119.672 -0.811 . . . . 3.3100000000000001 111.638 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -70.82 -34.29 71.57 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 117.708 -1.139 . . . . 3.8799999999999999 113.879 -174.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -63.33 -12.24 28.32 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.443 1.02 . . . . 2.8100000000000001 112.396 172.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -111.14 -40.28 4.51 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.613 1.565 . . . . 2.96 112.907 179.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -87.13 -3.66 59.08 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.349 2.26 . . . . 7.6200000000000001 112.155 -172.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 49.1 m -153.93 28.65 0.47 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.951 1.301 . . . . 7.0599999999999996 112.813 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.4 m -64.23 -21.66 66.66 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.402 2.001 . . . . 11.15 116.402 -172.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 35.8 m . . . . . 0 C--O 1.253 1.287 0 C-N-CA 129.966 3.307 . . . . 13.859999999999999 109.87 -172.743 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 8.5 m . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 118.338 -0.839 . . . . 11.550000000000001 110.293 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 87.27 -37.31 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 114.204 1.187 . . . . 9.4299999999999997 114.204 139.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 1.5 m -177.07 -40.66 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 131.436 3.895 . . . . 4.2800000000000002 107.231 -178.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.32 105.63 0.95 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 109.966 -0.383 . . . . 4.3399999999999999 109.966 171.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 10.4 p -59.78 147.94 36.21 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 120.707 0.289 . . . . 1.78 110.642 -165.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . 0.462 ' CD ' ' HZ1' ' B' ' 113' ' ' LYS . 22.4 tp10 -63.96 -32.52 74.09 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 121.925 -0.484 . . . . 2.2999999999999998 111.942 -174.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.9 -47.68 76.92 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.427 1.091 . . . . 2.02 110.164 171.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.04 -44.98 52.44 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 119.544 1.065 . . . . 3.46 112.748 -172.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . 0.462 ' HZ1' ' CD ' ' B' ' 110' ' ' GLU . 44.6 tttm -42.72 -47.21 5.35 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.368 1.467 . . . . 5.8099999999999996 112.43 157.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.27 -31.96 69.56 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 117.165 -1.398 . . . . 1.6599999999999999 114.284 176.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 32.8 t -59.72 -33.58 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 121.253 1.842 . . . . 2.1899999999999999 110.747 171.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 11.8 mt -55.9 -63.59 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 CA-C-N 119.377 0.99 . . . . 2.6699999999999999 110.58 164.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 83.4 t -55.35 -40.47 57.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.398 1.479 . . . . 1.6599999999999999 112.936 -173.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -62.57 -35.01 78.11 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.118 0.967 . . . . 2.1699999999999999 112.319 175.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 70.5 t -80.86 -41.54 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.538 1.135 . . . . 1.75 110.735 -177.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 64.7 tt0 -56.96 -45.67 82.71 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.363 0.529 . . . . 3.0600000000000001 111.087 171.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -59.25 -27.94 66.26 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 114.51 1.3 . . . . 2.1600000000000001 114.51 -177.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -79.46 -60.35 2.4 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.236 0.926 . . . . 3.2000000000000002 111.296 173.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -65.73 -24.14 66.9 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.1 0.778 . . . . 3.1299999999999999 113.1 -169.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -51.55 -23.51 4.24 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.547 1.314 . . . . 3.9199999999999999 114.547 175.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -89.55 -11.09 43.79 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 115.045 1.498 . . . . 3.7000000000000002 115.045 175.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.4 m -127.93 -118.63 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 126.267 1.827 . . . . 2.8799999999999999 111.864 -169.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 24.8 m -162.54 165.56 25.88 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 121.069 1.758 . . . . 5.4199999999999999 113.459 -176.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . 0.436 ' HE3' ' HB2' ' A' ' 96' ' ' GLU . 59.0 tttt -37.64 -48.43 1.04 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 128.079 2.552 . . . . 8.7200000000000006 115.802 -171.09 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -126.16 36.61 4.48 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.383 1.873 . . . . 8.6400000000000006 112.421 -177.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 16.8 m -71.1 67.0 0.42 Allowed 'General case' 0 N--CA 1.478 0.97 0 O-C-N 120.776 -1.202 . . . . 6.1200000000000001 113.624 175.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 90.9 mt -77.23 -17.75 58.22 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.309 1.226 . . . . 9.4199999999999999 114.309 -178.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -140.6 -1.74 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 126.337 1.855 . . . . 6.3200000000000003 112.887 173.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -93.49 108.18 19.91 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 120.793 -1.192 . . . . 7.9400000000000004 113.696 -169.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -51.72 123.24 9.66 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 114.09 -1.414 . . . . 9.1300000000000008 109.757 155.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.64 -7.02 11.09 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.682 0.793 . . . . 9.0399999999999991 109.805 147.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 8.8 pt -136.7 153.48 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 128.49 2.716 . . . . 4.4900000000000002 108.368 167.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 75.7 m -100.06 174.27 6.25 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.259 0.624 . . . . 3.6299999999999999 110.837 169.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -48.12 -30.74 4.81 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 113.767 1.025 . . . . 3.0499999999999998 113.767 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 14.1 p -50.46 -30.36 12.52 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.628 1.344 . . . . 2.4900000000000002 114.628 172.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 51.0 m -82.4 -32.42 29.14 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.41 1.004 . . . . 1.3 112.754 174.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -60.95 -48.57 81.21 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 120.007 1.276 . . . . 3.1699999999999999 111.38 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -56.86 -28.63 61.99 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.114 0.783 . . . . 5.1200000000000001 113.114 174.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.36 -52.09 5.83 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 125.253 1.421 . . . . 2.6299999999999999 111.81 -173.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 7.0 tmm? -47.24 -41.02 17.77 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.792 1.237 . . . . 1.97 111.402 167.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 30.7 mt -56.52 -70.86 0.1 Allowed 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 123.949 0.899 . . . . 1.96 111.502 167.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -72.37 -1.7 16.52 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.742 1.756 . . . . 3.6899999999999999 115.742 -171.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.25 -50.84 3.51 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.704 1.602 . . . . 2.4100000000000001 114.767 166.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -100.28 -26.18 14.0 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.102 1.319 . . . . 2.96 113.468 -172.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 22.2 mt -101.89 65.12 0.98 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.633 1.173 . . . . 4.0700000000000003 110.3 160.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -96.96 -8.79 29.74 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.636 1.347 . . . . 1.28 114.636 -177.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 36.3 m-70 -93.89 -32.08 14.06 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.489 -1.382 . . . . 2.2799999999999998 113.458 -171.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.0 mmm -91.25 -2.39 57.46 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.817 2.047 . . . . 3.1600000000000001 111.365 173.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.4 tp -71.47 74.45 0.76 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.857 2.063 . . . . 3.1099999999999999 111.322 -173.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 33.8 t -68.64 72.98 0.24 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.302 1.841 . . . . 4.9699999999999998 112.635 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 21.8 t70 38.2 -133.43 0.13 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 130.146 3.378 . . . . 4.3300000000000001 113.258 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 81.8 m -69.76 -40.99 75.76 Favored 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 125.097 1.359 . . . . 5.4400000000000004 111.19 -165.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.37 -48.17 87.49 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 119.562 1.074 . . . . 2.7599999999999998 111.747 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -72.47 -41.73 65.72 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.108 0.781 . . . . 3.8500000000000001 113.108 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -67.12 -40.24 86.8 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 120.256 -1.527 . . . . 5.9199999999999999 112.124 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 27.5 mmmt -67.23 -31.36 71.67 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 120.617 -1.302 . . . . 4.7300000000000004 112.401 170.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.49 -19.81 65.81 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 114.651 1.352 . . . . 1.8100000000000001 114.651 169.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.28 -57.7 3.64 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.808 1.185 . . . . 1.9399999999999999 111.632 162.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -65.73 -26.37 67.71 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.736 1.013 . . . . 2.25 113.736 -172.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -56.47 -34.07 66.55 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.014 -1.054 . . . . 3.46 112.254 169.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 21.0 mt -75.7 -34.59 60.41 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.803 0.441 . . . . 1.78 111.593 -177.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 38.7 mm -62.47 -55.23 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 124.746 1.218 . . . . 2.2999999999999998 109.744 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -60.73 -33.71 73.31 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.899 0.857 . . . . 2.3900000000000001 112.88 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -64.48 -24.53 67.65 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.469 1.508 . . . . 3.3799999999999999 113.308 174.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.32 -23.48 4.14 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 115.526 1.676 . . . . 3.77 115.526 -165.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -61.74 -13.61 24.78 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.065 -1.022 . . . . 3.2999999999999998 112.139 153.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.86 -12.53 59.41 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 115.435 1.643 . . . . 3.5600000000000001 115.435 163.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -134.48 -3.64 2.66 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.049 1.87 . . . . 3.1800000000000002 116.049 -169.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -149.8 90.36 1.69 Allowed 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 120.853 1.66 . . . . 3.9300000000000002 114.72 -170.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -81.07 116.42 21.0 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.094 1.757 . . . . 6.04 112.894 -178.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 67.02 8.59 50.27 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 115.989 1.156 . . . . 2.8599999999999999 115.989 165.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 36.2 mmt-85 -112.31 163.57 14.23 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.078 1.751 . . . . 6.2800000000000002 110.428 173.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.8 mm -149.82 129.78 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 126.375 1.87 . . . . 3.2599999999999998 106.469 161.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 11.3 m -93.25 171.75 8.73 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.216 1.006 . . . . 2.0699999999999998 111.065 171.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -71.37 -50.36 32.99 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 122.048 0.928 . . . . 3.6499999999999999 111.956 173.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -70.79 -18.48 62.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.189 2.196 . . . . 3.04 113.621 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -54.38 -55.7 26.02 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.93 1.692 . . . . 3.4399999999999999 111.569 167.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -55.22 -44.8 75.76 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.662 -1.274 . . . . 3.9199999999999999 111.824 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 22.9 t-105 -62.93 -45.62 91.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.742 -0.647 . . . . 0.81999999999999995 112.419 -177.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 6.8 t -71.59 -40.09 70.12 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 118.668 -0.682 . . . . 2.6299999999999999 111.827 178.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 85.9 mt -56.42 -49.31 74.9 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 117.888 -1.053 . . . . 1.8 111.091 173.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 26.7 mm -50.13 -36.97 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-N 120.53 1.514 . . . . 1.8300000000000001 112.63 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.42 -26.87 66.92 Favored Glycine 0 CA--C 1.53 1.023 0 CA-C-O 119.121 -0.821 . . . . 0.58999999999999997 113.257 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -73.9 -31.5 60.0 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 118.313 1.056 . . . . 0.88 113.922 178.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.1 mp -85.99 -36.0 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 118.638 1.219 . . . . 1.8700000000000001 110.877 173.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 62.6 m -71.46 -54.63 9.99 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.17 1.388 . . . . 2.9199999999999999 111.475 -176.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -46.63 -41.85 13.44 Favored Glycine 0 CA--C 1.539 1.588 0 CA-C-O 117.264 -1.853 . . . . 2.4100000000000001 116.705 -175.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.92 -51.91 2.02 Favored 'Trans proline' 0 C--N 1.353 0.812 0 CA-C-N 122.173 2.986 . . . . 1.5 112.046 175.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 25.2 pt -81.11 -15.49 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 N-CA-C 114.722 1.379 . . . . 2.0099999999999998 114.722 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -49.8 -43.76 48.65 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.692 1.597 . . . . 2.0699999999999998 112.849 -178.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 2.6 ptpp? -59.7 -36.31 76.26 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.962 0.905 . . . . 6.3499999999999996 113.349 175.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 3.4 tt -77.89 -41.31 37.07 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.894 1.678 . . . . 2.3999999999999999 110.091 -176.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 24.2 mt -56.22 -60.86 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.413 0.685 . . . . 2.3199999999999998 109.347 168.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -54.58 -39.36 67.72 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 113.256 0.836 . . . . 2.2200000000000002 113.256 -177.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . 0.439 ' HB2' ' HE3' ' A' ' 25' ' ' LYS . 12.3 pt-20 -68.89 -38.02 79.39 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 119.745 -0.782 . . . . 3.29 111.627 178.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -70.14 -34.23 72.78 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 117.959 -1.019 . . . . 3.9399999999999999 113.281 -173.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -63.01 -9.7 11.1 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.407 1.003 . . . . 2.7599999999999998 112.942 171.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -114.15 -39.14 3.96 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.773 1.629 . . . . 3.0699999999999998 113.33 177.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -87.73 -3.51 58.95 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.185 2.194 . . . . 7.7800000000000002 112.159 -172.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 48.8 m -153.99 28.35 0.47 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.843 1.257 . . . . 6.75 112.992 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 1.3 m -66.51 -23.99 66.33 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 116.324 1.972 . . . . 10.779999999999999 116.324 -172.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 34.4 m . . . . . 0 C--O 1.254 1.291 0 C-N-CA 130.275 3.43 . . . . 13.52 110.071 -173.641 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.511 -0.556 0 CA-C-O 120.314 0.102 . . . . 11.710000000000001 110.921 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -63.11 -141.36 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.388 0 O-C-N 124.966 1.416 . . . . 8.3699999999999992 109.796 146.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 13.6 t -79.85 -4.19 51.15 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.258 1.823 . . . . 4.6299999999999999 112.982 176.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -66.61 155.19 38.54 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.854 1.262 . . . . 3.8799999999999999 112.322 169.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.1 p -62.67 144.95 55.76 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 108.006 -1.109 . . . . 2.0800000000000001 108.006 159.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.41 -43.54 98.57 Favored 'General case' 0 C--O 1.213 -0.834 0 CA-C-O 116.815 -1.564 . . . . 2.5499999999999998 110.071 176.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -46.89 -48.44 21.18 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 120.3 1.409 . . . . 2.0499999999999998 110.363 177.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -71.54 -51.21 24.75 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 118.045 -0.979 . . . . 2.9399999999999999 112.581 -175.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 34.5 tptt -61.84 -23.89 66.55 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 121.456 1.935 . . . . 6.9400000000000004 114.082 170.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.04 -38.79 72.55 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 125.338 1.455 . . . . 2.2200000000000002 111.302 167.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.86 -41.09 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 121.04 1.745 . . . . 1.8799999999999999 110.07 169.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 16.6 mm -53.07 -50.56 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 119.567 1.076 . . . . 2.8599999999999999 111.063 167.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.7 t -62.43 -38.03 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.823 1.192 . . . . 2.1400000000000001 111.99 179.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp -70.52 -26.84 63.77 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 120.705 -1.247 . . . . 2.1200000000000001 112.584 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 97.3 t -81.41 -38.3 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 118.932 0.787 . . . . 1.8999999999999999 111.311 175.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -52.57 -48.66 66.05 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.984 0.914 . . . . 3.3599999999999999 110.512 165.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -63.98 -15.39 59.18 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.516 1.673 . . . . 2.48 115.516 -171.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -88.86 -60.56 1.92 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.846 0.858 . . . . 3.1299999999999999 111.886 166.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -68.23 -22.39 64.79 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.383 1.253 . . . . 2.9900000000000002 114.383 -169.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.1 ptmt -52.54 -19.89 2.58 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 115.707 1.743 . . . . 3.25 115.707 -177.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -96.53 -1.43 47.17 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 115.36 1.615 . . . . 4.9800000000000004 115.36 174.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 19.9 m -137.29 144.46 31.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-N 120.704 1.593 . . . . 3.73 112.377 -172.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.1 p -84.55 70.5 10.73 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.376 1.25 . . . . 4.2300000000000004 114.376 -175.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.9 ttpp 72.81 -43.67 0.57 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.687 2.395 . . . . 7.5999999999999996 115.976 149.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -136.09 117.83 15.05 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.412 -1.43 . . . . 9.7799999999999994 110.532 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.435 ' HB3' ' HE2' ' A' ' 30' ' ' LYS . 84.5 p -170.98 146.43 2.48 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.484 1.114 . . . . 5.0800000000000001 113.718 155.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.48 -78.8 0.08 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 107.186 -1.413 . . . . 8.6400000000000006 107.186 143.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.402 ' C ' ' H ' ' A' ' 31' ' ' ASN . 3.4 t -80.1 -109.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 125.071 1.349 . . . . 5.7000000000000002 110.9 175.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.435 ' HE2' ' HB3' ' A' ' 27' ' ' SER . 19.7 mtmt 54.34 -4.53 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 126.394 1.878 . . . . 8.7599999999999998 115.103 -160.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.402 ' H ' ' C ' ' A' ' 29' ' ' VAL . 73.0 m-20 58.42 154.83 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.306 1.842 . . . . 8.5199999999999996 113.005 -144.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.4 mtmm -131.75 -157.28 0.81 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.854 1.661 . . . . 10.06 107.931 167.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 37.7 pt -64.23 162.43 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.6 -0.688 . . . . 3.7599999999999998 111.331 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.0 m -71.05 145.87 49.66 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.646 -0.659 . . . . 3.0699999999999998 110.578 170.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -59.39 -25.9 64.67 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 119.765 -1.834 . . . . 3.0299999999999998 113.12 172.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.1 p -72.71 -20.42 61.22 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 114.04 1.126 . . . . 2.2400000000000002 114.04 169.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 39.6 m -71.54 -21.03 61.95 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 120.748 -1.22 . . . . 1.3700000000000001 111.527 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -58.98 -59.24 5.78 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.548 1.067 . . . . 3.6400000000000001 111.206 172.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -61.84 -19.67 62.84 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.878 0.871 . . . . 3.2200000000000002 113.301 -176.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -88.82 -49.88 6.56 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 127.175 2.19 . . . . 2.9399999999999999 110.685 179.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 7.1 tmm? -54.4 -40.13 67.93 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.642 1.577 . . . . 1.6799999999999999 111.599 173.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.3 mt -49.77 -32.64 14.3 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.252 1.421 . . . . 1.76 113.206 168.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.84 -5.61 50.61 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.103 1.32 . . . . 3.25 113.823 -178.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.23 -51.58 4.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.676 0.79 . . . . 2.27 111.186 168.074 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -96.06 -21.38 18.0 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.597 0.962 . . . . 2.8100000000000001 113.597 -167.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.01 34.61 4.84 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.427 1.891 . . . . 2.6200000000000001 111.616 -176.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -80.42 -15.23 57.3 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 116.727 2.121 . . . . 1.53 116.727 -156.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 15.3 m-70 -79.73 -49.52 11.94 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 121.324 1.875 . . . . 2.27 112.388 -167.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 76.4 mtm -72.13 -19.83 61.71 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.925 1.69 . . . . 3.4300000000000002 112.861 170.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.7 tp -86.13 50.89 2.07 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.927 1.291 . . . . 3.8399999999999999 110.061 178.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 2.5 m -71.02 -9.03 57.33 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 115.801 1.778 . . . . 4.3399999999999999 115.801 -153.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.515 ' CG ' ' H ' ' A' ' 53' ' ' THR . 22.6 t70 -162.28 174.98 12.1 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.423 1.889 . . . . 5.4000000000000004 111.44 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.515 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 9.5 m -48.66 -37.0 17.24 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 130.232 3.413 . . . . 4.04 111.943 162.383 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.0 -45.82 91.97 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 119.235 0.925 . . . . 2.7999999999999998 112.217 172.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -69.47 -42.39 74.93 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.93 0.892 . . . . 4.4400000000000004 109.975 175.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.75 -30.45 22.7 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.801 1.64 . . . . 5.8799999999999999 114.114 172.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.5 mtmt -59.96 -22.23 62.23 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.28 1.4 . . . . 4.8700000000000001 113.293 174.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.48 -15.32 57.01 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 114.866 1.432 . . . . 1.8600000000000001 114.866 169.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.74 -49.31 10.58 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.402 1.081 . . . . 1.5600000000000001 110.799 162.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -67.71 -29.46 68.72 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.735 1.214 . . . . 2.0600000000000001 114.105 -176.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.2 ptmt -50.34 -35.68 28.87 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 119.563 1.074 . . . . 4.7300000000000004 111.663 165.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.7 mt -78.23 -44.97 24.17 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 123.305 0.642 . . . . 2.1200000000000001 111.15 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 23.0 mm -52.55 -49.53 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 123.734 0.646 . . . . 2.0 110.468 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -65.43 -40.12 92.92 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.503 0.927 . . . . 2.3399999999999999 113.503 178.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -61.97 -29.66 70.4 Favored 'General case' 0 CA--C 1.554 1.123 0 N-CA-C 113.224 0.824 . . . . 4.3200000000000003 113.224 172.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.84 -26.15 21.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.745 1.218 . . . . 2.98 112.158 179.209 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -64.16 -22.21 66.85 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.83 -1.168 . . . . 2.8599999999999999 113.772 165.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.43 -15.98 60.89 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 114.294 1.22 . . . . 3.1299999999999999 114.294 164.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -126.56 -13.38 5.98 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 116.887 2.18 . . . . 2.6000000000000001 116.887 -166.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.14 125.31 27.66 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 121.963 2.165 . . . . 4.1600000000000001 111.873 174.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -80.1 58.52 3.0 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.933 2.093 . . . . 4.2300000000000004 111.955 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 76.12 2.5 72.6 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.594 1.093 . . . . 3.4500000000000002 113.819 -174.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -77.22 163.0 26.93 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.407 1.104 . . . . 7.54 110.855 177.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 36.0 mm -138.61 140.11 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.479 1.511 . . . . 3.23 108.084 171.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.9 t -95.24 -146.49 0.27 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 127.05 2.14 . . . . 2.6800000000000002 112.061 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -112.92 -59.67 1.99 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.03 1.732 . . . . 3.9700000000000002 109.904 152.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.53 -22.63 61.93 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.079 2.151 . . . . 3.5 112.943 -170.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -47.57 -59.62 3.13 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 127.335 2.254 . . . . 3.1299999999999999 111.09 167.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -54.17 -44.21 71.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.381 0.992 . . . . 3.9500000000000002 112.202 -179.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.8 t-105 -63.1 -48.07 80.12 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 118.881 -0.581 . . . . 0.83999999999999997 111.887 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.9 t -71.22 -26.45 62.93 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.931 0.787 . . . . 2.79 112.304 178.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.0 mt -66.15 -46.43 77.47 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.448 -1.263 . . . . 1.8700000000000001 111.338 170.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.7 mm -51.99 -41.4 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 CA-C-N 121.808 2.094 . . . . 1.8799999999999999 112.038 176.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.57 -21.96 71.17 Favored Glycine 0 CA--C 1.532 1.118 0 O-C-N 121.568 -0.708 . . . . 0.97999999999999998 113.565 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.29 -23.36 68.48 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 118.631 -1.094 . . . . 1.01 114.279 -177.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -92.04 -42.68 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 125.441 1.496 . . . . 2.29 110.044 166.137 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.2 m -78.77 60.11 2.71 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.528 2.331 . . . . 1.8799999999999999 110.691 -177.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -130.33 -77.2 0.17 Allowed Glycine 0 CA--C 1.532 1.154 0 C-N-CA 126.206 1.86 . . . . 1.0700000000000001 111.094 173.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -62.32 -38.0 57.23 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.146 2.564 . . . . 1.1699999999999999 112.735 -178.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.2 pp -77.82 -14.75 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 112.864 0.69 . . . . 2.3300000000000001 112.864 174.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.67 -33.02 41.56 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.798 -1.188 . . . . 2.25 113.512 -174.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.82 -33.57 71.93 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 120.095 -1.628 . . . . 3.4700000000000002 111.657 163.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.04 -40.01 90.64 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 118.407 -0.806 . . . . 3.0499999999999998 111.687 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 92.3 mt -45.71 -62.68 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.617 0.767 . . . . 1.8700000000000001 110.212 164.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -60.43 -42.81 96.86 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.088 -0.505 . . . . 1.79 111.875 -172.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.298 4.1 pt-20 -76.38 -19.97 57.63 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 112.818 0.673 . . . . 3.2799999999999998 112.818 -176.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -85.11 -37.24 20.49 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.984 1.714 . . . . 2.4900000000000002 115.297 173.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -73.07 -16.48 61.48 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.178 0.899 . . . . 2.48 110.992 176.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.448 ' C ' ' H ' ' A' ' 101' ' ' SER . 1.2 mm-40 -92.06 -66.4 0.93 Allowed 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.047 1.339 . . . . 2.2999999999999998 111.085 170.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 53.03 -2.31 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 131.068 3.747 . . . . 5.5 116.238 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.448 ' H ' ' C ' ' A' ' 99' ' ' GLN . 37.4 t -129.16 17.28 6.09 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.555 1.542 . . . . 7.04 112.818 -166.436 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 23.3 m -113.22 6.02 17.24 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.224 1.41 . . . . 9.0099999999999998 113.862 -171.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.7 t . . . . . 0 C--O 1.255 1.359 0 C-N-CA 125.159 1.384 . . . . 10.68 109.616 -148.765 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 CA--C 1.52 -0.202 0 N-CA-C 108.392 -0.966 . . . . 11.050000000000001 108.392 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . 0.415 ' CG ' ' H ' ' B' ' 107' ' ' CYS . 14.4 t70 -49.23 -154.42 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.592 0 CA-C-O 121.94 0.876 . . . . 7.5599999999999996 111.72 122.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . 0.415 ' H ' ' CG ' ' B' ' 106' ' ' ASP . 12.1 t -71.44 -14.3 62.1 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 119.398 -2.064 . . . . 4.0099999999999998 112.478 -179.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -63.57 144.5 56.95 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 124.171 0.989 . . . . 3.4300000000000002 111.552 167.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 11.7 p -57.93 151.35 18.42 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.053 -0.721 . . . . 1.9199999999999999 109.053 166.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -68.55 -31.44 70.66 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 116.498 -1.715 . . . . 3.2000000000000002 111.614 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.98 -48.62 70.17 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 121.418 1.917 . . . . 2.0299999999999998 109.746 171.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -72.25 -51.35 21.35 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.442 -0.789 . . . . 2.8999999999999999 112.325 -174.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -62.29 -24.07 67.08 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 121.324 1.875 . . . . 7.96 114.078 170.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.43 -43.24 73.78 Favored 'General case' 0 C--O 1.222 -0.376 0 O-C-N 120.233 -1.542 . . . . 2.0099999999999998 111.461 166.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.04 -43.17 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 121.512 1.96 . . . . 1.9199999999999999 110.69 169.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 22.3 mm -52.93 -55.57 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.045 0.838 . . . . 3.2799999999999998 111.648 168.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 6.7 t -61.15 -38.71 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.61 1.164 . . . . 1.8700000000000001 112.32 -177.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.8 mp -66.84 -32.59 73.96 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.237 -0.914 . . . . 2.1499999999999999 111.848 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 79.4 t -80.01 -38.94 19.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.267 1.027 . . . . 1.8400000000000001 111.025 177.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -55.05 -46.82 75.38 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.279 1.031 . . . . 3.1800000000000002 110.5 168.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -59.44 -24.8 63.83 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 115.303 1.594 . . . . 2.3700000000000001 115.303 -173.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -87.96 -58.4 2.58 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.158 1.383 . . . . 3.52 112.302 171.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -64.79 -26.69 68.46 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 112.582 0.586 . . . . 2.9199999999999999 112.582 -172.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -53.43 -16.51 1.45 Allowed 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.017 1.488 . . . . 3.2799999999999998 115.017 174.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -90.24 -5.51 56.27 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 114.744 1.387 . . . . 4.0300000000000002 114.744 173.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 22.4 m -141.05 148.65 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 CA-C-N 121.271 1.85 . . . . 3.3399999999999999 112.418 -171.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 12.8 p -83.18 72.0 10.16 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 120.956 -1.09 . . . . 4.0499999999999998 113.748 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 20.7 ttpt 69.39 -53.27 0.6 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.799 2.44 . . . . 7.3700000000000001 116.682 153.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -131.69 117.83 19.18 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.52 1.528 . . . . 10.44 112.15 -175.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 130' ' ' SER . . . . . 0.413 ' HB3' ' HE2' ' B' ' 133' ' ' LYS . 96.2 p -173.89 148.33 1.41 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.575 1.55 . . . . 5.25 113.35 156.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.95 -69.79 0.42 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 107.92 -1.141 . . . . 8.9000000000000004 107.92 148.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 2.4 t -85.89 -112.68 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 C-N-CA 124.764 1.225 . . . . 5.7300000000000004 110.87 175.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . 0.413 ' HE2' ' HB3' ' B' ' 130' ' ' SER . 22.1 mtmt 56.61 -6.33 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 126.669 1.988 . . . . 8.4499999999999993 114.658 -159.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 42.3 m-20 57.77 159.17 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.306 1.842 . . . . 8.9900000000000002 112.494 -144.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -138.93 -131.55 0.12 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.662 1.585 . . . . 10.09 108.961 173.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 31.3 pt -86.95 165.66 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 119.682 1.128 . . . . 3.1000000000000001 112.064 -175.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 69.0 m -85.95 151.17 23.96 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.201 -0.937 . . . . 2.6499999999999999 111.172 169.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . 0.476 ' HE3' ' HA ' ' B' ' 170' ' ' ASP . 0.0 OUTLIER -58.06 -28.99 65.03 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.238 -1.539 . . . . 3.8999999999999999 112.667 175.764 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 43.9 p -70.5 -24.51 62.86 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.616 -1.303 . . . . 2.27 114.218 171.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 20.0 m -72.53 -26.3 61.7 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 120.794 -1.191 . . . . 1.4299999999999999 112.195 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -60.97 -51.25 70.06 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.137 -0.977 . . . . 3.2799999999999998 112.103 173.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -67.08 -25.93 66.47 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.597 -0.689 . . . . 3.27 112.312 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.92 -52.52 28.49 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 124.314 1.046 . . . . 3.1899999999999999 110.714 170.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 2.2 ttm -55.39 -39.83 70.63 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.976 1.31 . . . . 2.29 110.696 179.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.7 mt -56.53 -62.1 1.96 Allowed 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 125.825 1.65 . . . . 1.71 112.25 165.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -63.85 -16.76 62.13 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 120.349 1.431 . . . . 3.2999999999999998 114.779 -176.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.78 -56.8 3.31 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.331 0.969 . . . . 2.1200000000000001 112.019 170.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -93.88 -19.48 20.93 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 113.606 0.965 . . . . 2.8300000000000001 113.606 -165.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 3.9 mt -122.33 57.21 1.09 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 129.135 2.974 . . . . 2.54 109.739 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -96.2 -16.82 21.23 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.724 1.75 . . . . 1.3799999999999999 115.724 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -82.72 -27.51 31.1 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 121.087 1.767 . . . . 2.6099999999999999 114.131 -172.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 65.3 mtm -89.26 6.1 41.85 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.413 1.885 . . . . 3.3500000000000001 113.207 174.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 2.3 tp -83.36 -167.37 1.67 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 128.148 2.579 . . . . 3.5099999999999998 111.49 173.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 15.5 m -174.6 -45.63 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 128.524 2.73 . . . . 4.0899999999999999 109.266 171.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . 0.441 ' CG ' ' H ' ' B' ' 156' ' ' THR . 17.4 t70 -151.69 179.07 8.72 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-O 123.437 1.589 . . . . 4.96 112.192 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 156' ' ' THR . . . . . 0.441 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 12.5 m -35.38 -40.99 0.16 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 128.802 2.841 . . . . 3.77 112.673 151.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.96 -47.76 47.43 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 124.923 1.249 . . . . 2.29 113.351 176.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -64.15 -48.17 77.04 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.904 0.881 . . . . 4.5300000000000002 110.391 173.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -55.86 -33.4 64.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.992 1.717 . . . . 6.0700000000000003 114.074 -178.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -55.69 -22.95 25.81 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 120.99 -1.069 . . . . 5.9100000000000001 113.721 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -80.94 -14.89 57.56 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.044 1.498 . . . . 1.9399999999999999 115.044 172.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -80.15 -52.19 8.06 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.58 1.082 . . . . 1.6299999999999999 110.485 160.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -66.42 -29.8 70.03 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.775 1.23 . . . . 1.95 113.323 -172.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt -50.13 -35.18 24.78 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 118.911 0.778 . . . . 5.0099999999999998 112.406 165.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.5 mt -81.32 -40.86 22.96 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.64 -0.663 . . . . 2.21 111.322 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.62 -48.98 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 123.23 0.612 . . . . 1.97 111.102 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -65.04 -24.42 67.48 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.002 1.112 . . . . 2.2999999999999998 114.002 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -82.36 -41.05 20.49 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.293 1.22 . . . . 4.1500000000000004 114.293 173.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.56 -32.04 20.9 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 121.12 -0.988 . . . . 3.4300000000000002 112.45 -171.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . 0.476 ' HA ' ' HE3' ' B' ' 138' ' ' LYS . 7.9 t70 -60.26 -44.88 94.91 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.256 -0.902 . . . . 3.0 111.228 174.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.99 -12.0 7.02 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.168 1.787 . . . . 3.0299999999999998 115.363 174.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -117.11 -4.06 11.48 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.758 1.223 . . . . 2.2799999999999998 113.628 -177.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -154.96 95.29 1.73 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.697 1.135 . . . . 4.6399999999999997 110.104 -168.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -76.23 79.94 3.02 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.631 1.572 . . . . 4.21 112.858 -164.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 68.24 -4.67 4.56 Favored Glycine 0 CA--C 1.535 1.304 0 O-C-N 121.03 -1.043 . . . . 3.1400000000000001 113.114 -166.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 64.3 mmt-85 -68.52 147.95 51.25 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.799 1.24 . . . . 7.0599999999999996 109.702 174.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 35.6 mm -142.55 137.92 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 126.464 1.905 . . . . 3.2200000000000002 107.37 176.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 9.1 t -92.12 -142.87 0.2 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.961 1.704 . . . . 2.6099999999999999 111.512 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -117.82 -56.71 2.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.404 1.881 . . . . 3.9900000000000002 110.284 158.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -61.68 -27.41 68.67 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 128.508 2.723 . . . . 3.0 114.32 -177.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -43.54 -58.78 2.46 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.336 1.854 . . . . 3.0099999999999998 111.054 165.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -54.5 -43.88 72.22 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.239 -0.913 . . . . 3.9199999999999999 111.772 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 35.4 t-105 -62.3 -47.94 82.07 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 122.123 -0.361 . . . . 0.80000000000000004 111.753 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 13.2 t -71.74 -25.81 62.21 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 118.215 -0.898 . . . . 2.7000000000000002 112.274 177.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 62.1 mt -63.96 -48.97 74.37 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 117.28 -1.343 . . . . 1.8500000000000001 110.737 168.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 38.7 mm -50.27 -41.88 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 CA-C-N 121.348 1.885 . . . . 1.8500000000000001 112.065 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.55 -25.1 72.69 Favored Glycine 0 CA--C 1.531 1.057 0 O-C-N 121.534 -0.729 . . . . 0.94999999999999996 113.744 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.94 -21.68 75.83 Favored Glycine 0 CA--C 1.533 1.182 0 CA-C-O 118.672 -1.071 . . . . 1.0700000000000001 114.438 -176.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -88.49 -48.4 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 125.12 1.368 . . . . 2.23 109.161 163.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 1.5 m -86.44 44.71 1.17 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.621 1.968 . . . . 2.5600000000000001 111.9 -165.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -118.42 -71.39 0.39 Allowed Glycine 0 CA--C 1.53 1.027 0 C-N-CA 126.603 2.049 . . . . 1.29 111.036 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.14 -30.66 82.54 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.471 2.781 . . . . 1.8200000000000001 114.176 -178.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 7.7 pt -83.88 -13.75 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 119.713 1.142 . . . . 2.46 113.518 172.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.95 -34.94 76.17 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.31 1.226 . . . . 2.02 114.31 -169.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -56.78 -36.29 69.69 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.434 -1.416 . . . . 3.9900000000000002 111.808 168.289 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.02 -40.04 75.44 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 123.625 0.77 . . . . 3.2799999999999998 111.369 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 90.3 mt -47.41 -62.33 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.768 0.827 . . . . 2.1000000000000001 110.85 166.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -56.35 -46.67 79.87 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.514 0.561 . . . . 1.6799999999999999 112.514 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.305 2.6 pt-20 -78.6 -13.19 59.95 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.977 0.732 . . . . 2.9100000000000001 112.977 -173.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -81.45 -25.81 35.81 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 115.058 1.503 . . . . 2.3300000000000001 115.058 169.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -75.13 -15.63 60.58 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.12 0.968 . . . . 2.23 111.228 170.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.433 ' C ' ' H ' ' B' ' 204' ' ' SER . 0.5 OUTLIER -102.49 -61.81 1.35 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.965 1.306 . . . . 2.3399999999999999 110.876 -179.553 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.254 7.5 pt20 56.85 -6.11 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.057 1 C-N-CA 132.026 4.13 . . . . 5.6100000000000003 115.72 171.744 . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' B' B ' 204' ' ' SER . . . . . 0.433 ' H ' ' C ' ' B' ' 202' ' ' GLN . 48.4 t -118.26 40.54 3.16 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.789 2.036 . . . . 6.8700000000000001 110.317 -178.22 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 20.0 m -144.54 17.55 1.67 Allowed 'General case' 0 N--CA 1.477 0.92 0 O-C-N 119.961 -1.712 . . . . 9.0 114.092 -172.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 C--O 1.256 1.418 0 C-N-CA 125.032 1.333 . . . . 11.01 110.54 -164.507 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.547 ' HA ' ' CE2' ' A' ' 5' ' ' TYR . 42.0 m . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 118.831 -0.604 . . . . 11.130000000000001 110.877 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 4' ' ' CYS . 2.4 t70 -76.69 -116.09 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 106.708 -1.59 . . . . 7.5899999999999999 106.708 137.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.544 ' H ' ' CG ' ' A' ' 3' ' ' ASP . 75.7 m -82.96 -60.93 2.0 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.595 1.543 . . . . 4.8399999999999999 108.86 166.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.547 ' CE2' ' HA ' ' A' ' 2' ' ' SER . 10.1 m-30 70.88 138.07 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.992 2.517 . . . . 3.7799999999999998 112.34 176.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 17.1 p -78.95 166.75 22.03 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 120.795 -1.191 . . . . 2.1800000000000002 110.953 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.472 ' CD ' ' HZ1' ' A' ' 10' ' ' LYS . 4.3 tp10 -56.58 -34.13 66.85 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.28 0.632 . . . . 2.25 112.47 176.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -45.7 90.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.17 1.388 . . . . 1.8999999999999999 110.122 175.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -76.23 -47.99 21.93 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.993 0.917 . . . . 2.9300000000000002 111.423 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.472 ' HZ1' ' CD ' ' A' ' 7' ' ' GLU . 40.2 tttm -44.89 -46.69 11.01 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.248 1.419 . . . . 6.6500000000000004 113.104 159.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.99 88.08 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.563 -1.208 . . . . 1.6100000000000001 112.896 175.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.5 t -57.76 -38.61 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 120.87 1.668 . . . . 1.72 110.377 174.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.4 mt -63.64 -43.37 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 121.634 -0.666 . . . . 2.3999999999999999 111.277 173.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.8 t -68.28 -39.82 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 124.394 1.077 . . . . 1.5900000000000001 111.986 179.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.4 mp -59.83 -45.29 92.85 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.75 1.159 . . . . 1.97 110.212 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.6 t -64.66 -42.22 94.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 124.896 1.278 . . . . 1.6599999999999999 112.32 177.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -56.57 -49.28 75.33 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.408 1.083 . . . . 3.3799999999999999 111.13 168.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.16 -24.62 61.47 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.91 0.707 . . . . 2.5899999999999999 112.91 -170.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -71.2 -63.15 1.16 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.983 0.513 . . . . 3.1099999999999999 112.185 161.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -63.53 -32.59 74.09 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.792 -0.623 . . . . 3.0899999999999999 112.376 -163.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.8 pttt -55.57 -23.38 26.66 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.585 1.328 . . . . 3.04 114.585 175.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -78.95 -31.03 44.9 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.623 -1.298 . . . . 3.6000000000000001 112.607 174.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.1 m -92.92 -170.06 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 CA-C-N 120.824 1.647 . . . . 2.7400000000000002 111.72 176.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.46 -44.76 61.88 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 120.306 -1.496 . . . . 4.46 114.189 173.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt 132.01 -95.9 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 131.184 3.793 . . . . 5.71 107.744 -156.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -121.1 125.28 46.86 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.938 1.695 . . . . 9.2699999999999996 111.272 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.4 m -154.68 25.05 0.45 Allowed 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.252 -0.905 . . . . 4.9500000000000002 111.576 174.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 71.7 mt 59.56 -61.66 0.05 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 128.269 2.628 . . . . 8.9199999999999999 114.018 -175.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.3 t -72.74 -37.85 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 127.489 2.316 . . . . 5.4400000000000004 111.044 174.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt 70.93 -2.77 2.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 127.927 2.491 . . . . 13.640000000000001 116.463 175.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -57.7 139.83 52.84 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 119.269 0.941 . . . . 8.9100000000000001 111.884 176.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.63 -40.43 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 128.294 2.638 . . . . 11.390000000000001 108.069 -169.01 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.0 pt -117.5 171.11 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 127.315 2.246 . . . . 4.2599999999999998 108.907 158.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 72.1 m -113.92 167.64 10.48 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.606 0.763 . . . . 3.7400000000000002 109.512 160.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.41 -18.28 4.01 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 115.583 1.697 . . . . 3.3199999999999998 115.583 176.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.3 p -57.15 -20.73 28.01 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.384 -1.447 . . . . 2.4300000000000002 114.286 165.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.7 m -82.44 -33.01 28.69 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.725 -1.234 . . . . 1.3799999999999999 113.52 171.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -55.3 -52.38 63.63 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.789 1.177 . . . . 3.79 111.37 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -16.32 8.81 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.688 1.195 . . . . 3.5800000000000001 113.976 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -106.86 -38.58 6.03 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 124.826 1.251 . . . . 3.04 112.529 -174.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.2 ttm -47.99 -44.58 30.74 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.767 0.827 . . . . 2.3500000000000001 110.286 156.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.2 mt -62.46 -12.64 23.17 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 116.006 1.854 . . . . 1.8500000000000001 116.006 170.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -104.96 -15.56 15.09 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 124.761 1.224 . . . . 2.3300000000000001 113.505 174.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.51 -47.56 3.9 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.326 1.051 . . . . 2.2599999999999998 112.924 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -94.73 -9.53 34.42 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.223 1.374 . . . . 2.9399999999999999 113.967 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -120.14 34.11 5.34 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.849 1.66 . . . . 2.3300000000000001 112.601 171.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -78.65 -21.2 48.69 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 116.209 1.929 . . . . 1.6499999999999999 116.209 -161.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -94.18 -14.35 25.69 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.237 1.381 . . . . 2.48 112.989 -170.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 50.2 mtm -85.53 -18.1 34.43 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.625 1.17 . . . . 3.3100000000000001 112.922 162.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.55 125.99 26.93 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 120.643 -1.286 . . . . 3.3199999999999998 108.618 163.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.6 p -171.81 -57.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.568 -0.707 . . . . 4.6399999999999997 109.449 -158.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -79.49 147.2 32.32 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.511 0.724 . . . . 5.4500000000000002 109.25 155.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.3 m -69.15 -30.17 68.35 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.785 0.834 . . . . 3.3700000000000001 110.473 171.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -55.8 -33.74 60.29 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 124.461 1.029 . . . . 2.0699999999999998 113.098 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -59.78 -56.0 27.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.319 1.047 . . . . 3.73 111.514 -179.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.6 ttt-85 -73.33 -33.29 65.05 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.148 0.795 . . . . 5.71 113.148 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -55.65 -38.11 69.12 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 119.562 -1.961 . . . . 3.71 112.163 171.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.96 -10.14 55.79 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.571 1.693 . . . . 1.8100000000000001 115.571 172.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.32 -57.32 3.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.585 1.084 . . . . 1.78 111.019 162.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.18 -29.42 70.35 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.49 0.716 . . . . 2.96 112.085 -172.295 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -62.64 -28.07 69.65 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 120.434 -1.416 . . . . 3.29 114.311 172.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.9 mt -78.54 -36.76 44.3 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.315 0.646 . . . . 1.8700000000000001 110.554 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.4 mm -51.6 -55.48 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 126.271 1.828 . . . . 2.0299999999999998 109.55 178.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -60.1 -31.15 69.77 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.67 0.989 . . . . 2.7400000000000002 113.67 -178.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -31.61 65.64 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.405 1.482 . . . . 3.9199999999999999 112.55 175.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.4 -29.98 21.08 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.335 1.454 . . . . 2.9199999999999999 111.587 177.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -55.4 -52.01 64.98 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.757 1.623 . . . . 2.9900000000000002 109.503 164.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.97 -14.69 24.47 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 115.553 1.686 . . . . 2.8199999999999998 115.553 175.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -118.73 -7.39 10.52 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.152 1.538 . . . . 2.3500000000000001 115.152 -175.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -147.45 125.28 11.92 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 121.019 1.736 . . . . 4.6299999999999999 111.051 -179.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -114.88 149.82 36.56 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.632 0.773 . . . . 5.2300000000000004 110.44 163.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.54 -43.67 0.59 Allowed Glycine 0 CA--C 1.53 1.002 0 C-N-CA 126.598 2.047 . . . . 3.8300000000000001 114.346 -178.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -88.93 140.66 29.21 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.296 1.439 . . . . 6.6799999999999997 112.342 -173.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 46.7 mm -114.29 129.61 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 N-CA-C 106.357 -1.72 . . . . 3.3300000000000001 106.357 154.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.2 t -84.9 -171.71 3.79 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.392 0.615 . . . . 2.0099999999999998 112.489 -179.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -94.51 -57.76 2.39 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 119.253 -2.154 . . . . 3.1200000000000001 110.404 167.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -51.46 -29.13 15.23 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 130.713 3.605 . . . . 3.3300000000000001 114.94 170.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -49.72 -58.67 4.87 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.306 1.442 . . . . 3.23 111.306 171.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -52.44 -48.21 65.94 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.211 -0.931 . . . . 3.1099999999999999 111.652 176.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.4 t-105 -64.54 -45.56 86.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 119.054 -0.498 . . . . 0.58999999999999997 111.416 -171.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.2 t -71.17 -29.39 65.13 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 117.753 -1.117 . . . . 2.96 112.229 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.89 -35.51 76.95 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.459 1.027 . . . . 1.73 112.207 174.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.3 mm -52.26 -38.72 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 CA-C-N 120.322 1.419 . . . . 1.79 111.359 173.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.79 -14.02 64.64 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.422 1.487 . . . . 0.58999999999999997 115.309 177.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.29 -24.94 64.7 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-N 119.394 1.597 . . . . 0.80000000000000004 112.842 173.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -97.08 -41.99 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.305 1.442 . . . . 2.29 109.96 171.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.4 m -80.93 64.12 5.57 Favored 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 127.014 2.126 . . . . 1.72 108.342 173.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -159.87 -55.67 0.01 OUTLIER Glycine 0 CA--C 1.531 1.038 0 C-N-CA 126.04 1.781 . . . . 1.3200000000000001 110.937 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.09 -73.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.344 2.696 . . . . 1.6299999999999999 111.341 161.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.5 pt -73.51 -18.33 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 N-CA-C 114.7 1.37 . . . . 2.52 114.7 -170.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.23 -39.29 69.55 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.227 1.011 . . . . 2.3399999999999999 112.606 -178.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -63.28 -41.79 99.05 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.5 -0.75 . . . . 6.8700000000000001 111.863 175.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.5 tt -65.18 -40.89 94.9 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 117.908 -1.044 . . . . 2.3799999999999999 110.818 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -45.72 -51.28 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 119.375 0.988 . . . . 1.97 110.726 174.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -63.71 -39.18 93.66 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.605 0.965 . . . . 1.98 113.605 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -85.41 -24.09 27.66 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.18 0.9 . . . . 2.7799999999999998 112.978 -177.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.504 ' C ' ' H ' ' A' ' 99' ' ' GLN . 5.3 tp60 -66.89 -46.36 75.15 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.159 1.383 . . . . 3.0800000000000001 109.166 164.521 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -84.16 41.16 0.8 Allowed 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 124.914 2.292 . . . . 3.1099999999999999 111.002 176.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.504 ' H ' ' C ' ' A' ' 97' ' ' GLN . 1.7 mm-40 -125.08 -54.38 1.61 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 111.862 -2.426 . . . . 2.77 107.361 149.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -64.94 -10.05 26.11 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.009 1.724 . . . . 6.71 115.213 -175.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 14.2 p -70.64 -1.45 11.24 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.155 -0.966 . . . . 7.5599999999999996 113.567 161.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 23.2 t -149.74 -22.36 0.27 Allowed 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 116.432 2.012 . . . . 8.8100000000000005 116.432 174.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 30.5 t . . . . . 0 N--CA 1.489 1.51 0 C-N-CA 127.008 2.123 . . . . 9.1799999999999997 114.347 177.841 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 118.778 -0.63 . . . . 10.220000000000001 110.937 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . 0.499 ' CG ' ' H ' ' B' ' 107' ' ' CYS . 4.4 t70 -72.8 -116.73 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.232 0 N-CA-C 106.847 -1.538 . . . . 6.8600000000000003 106.847 138.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . 0.499 ' H ' ' CG ' ' B' ' 106' ' ' ASP . 40.6 t -71.9 -63.48 1.13 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 121.154 1.797 . . . . 3.9399999999999999 109.208 156.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 74.15 146.3 0.08 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.857 2.863 . . . . 3.6400000000000001 111.976 -176.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.3 p -82.74 168.99 16.67 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 121.526 -0.734 . . . . 2.2200000000000002 110.359 177.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -63.8 -48.78 75.51 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-O 117.022 -1.466 . . . . 2.5600000000000001 110.509 171.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.25 -47.23 36.11 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 120.2 1.363 . . . . 1.73 111.0 178.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -73.49 -53.91 9.5 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 126.078 1.751 . . . . 2.96 112.503 -173.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -47.55 -36.64 10.83 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.125 1.37 . . . . 5.2400000000000002 113.299 161.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -73.61 -38.82 64.96 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 120.716 -1.24 . . . . 1.55 112.003 176.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.94 -40.99 79.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 120.914 1.688 . . . . 1.75 110.385 166.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 97.1 mt -58.74 -49.04 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 118.867 0.758 . . . . 2.1299999999999999 112.103 171.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.8 t -61.38 -43.3 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.98 1.312 . . . . 1.6000000000000001 112.265 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -60.77 -44.01 97.32 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.825 1.193 . . . . 1.9399999999999999 110.778 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 55.5 t -63.38 -42.55 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 124.325 1.05 . . . . 1.6599999999999999 111.836 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -55.54 -47.75 75.81 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 119.972 1.26 . . . . 3.6000000000000001 110.514 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.9 -24.9 60.89 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 112.694 0.627 . . . . 2.5600000000000001 112.694 -168.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -74.02 -59.72 2.59 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.898 0.479 . . . . 3.2200000000000002 112.111 163.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -64.34 -32.68 74.39 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.6 -0.714 . . . . 3.0299999999999998 112.286 -165.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 37.4 pttt -54.84 -24.57 23.67 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.437 1.273 . . . . 2.98 114.437 175.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -77.39 -31.29 54.09 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 117.49 -1.243 . . . . 3.3100000000000001 112.963 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.7 m -95.26 -173.87 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 CA-C-N 120.901 1.682 . . . . 2.7200000000000002 112.125 -179.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.59 -43.03 73.65 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.605 -1.309 . . . . 4.6500000000000004 113.645 175.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 22.4 ttpt 126.98 -93.1 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 131.466 3.906 . . . . 5.3300000000000001 108.161 -156.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -123.69 132.9 53.94 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.881 1.672 . . . . 9.4000000000000004 112.002 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 12.5 m -154.33 26.56 0.46 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.285 1.034 . . . . 5.1299999999999999 110.997 173.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 67.3 mt 59.01 -62.17 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.193 2.597 . . . . 9.2300000000000004 112.73 -167.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 54.9 t -74.45 -33.54 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 127.461 2.305 . . . . 5.25 112.204 177.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt 69.75 -5.54 1.2 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 127.672 2.389 . . . . 13.699999999999999 116.655 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -57.39 138.04 55.41 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 119.012 0.824 . . . . 8.9100000000000001 111.544 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.83 -38.75 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 128.158 2.583 . . . . 11.33 108.469 -167.206 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 3.2 pt -120.69 173.37 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 127.431 2.293 . . . . 4.3200000000000003 108.62 158.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 66.3 m -117.17 168.95 9.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.744 0.818 . . . . 3.6299999999999999 109.457 161.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.6 -16.96 2.77 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 116.02 1.859 . . . . 3.4700000000000002 116.02 175.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.9 p -59.59 -20.48 56.09 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 119.636 -1.915 . . . . 2.3500000000000001 114.455 165.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 23.6 m -78.88 -31.68 45.57 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 120.439 -1.413 . . . . 1.3100000000000001 112.983 170.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -61.05 -49.38 77.58 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.592 1.157 . . . . 3.4900000000000002 112.039 -178.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 1.2 ptt180 -55.58 -15.55 3.02 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.899 1.074 . . . . 3.52 113.899 173.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -106.03 -38.33 6.34 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 125.451 1.5 . . . . 2.73 112.525 -175.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.5 ttm -49.79 -44.39 49.0 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.247 1.019 . . . . 2.27 110.45 159.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 28.7 mt -65.04 -0.6 1.66 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 126.214 1.806 . . . . 1.8899999999999999 115.644 171.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -120.78 -14.71 8.5 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 125.452 1.501 . . . . 2.3500000000000001 114.046 174.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.86 -53.23 2.8 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.171 0.988 . . . . 2.46 113.47 175.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -85.69 -34.65 21.23 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 120.585 1.539 . . . . 2.79 112.545 177.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.22 47.38 0.9 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.753 1.221 . . . . 2.8300000000000001 111.595 179.284 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -89.69 -16.32 30.65 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 115.685 1.735 . . . . 1.6000000000000001 115.685 -160.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -97.82 -22.72 16.22 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 120.454 1.479 . . . . 2.23 113.278 -167.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 60.2 mtm -79.64 -19.38 49.26 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.672 -1.268 . . . . 3.4100000000000001 111.947 166.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 5.9 mp -63.28 125.54 24.46 Favored 'General case' 0 C--O 1.222 -0.358 0 O-C-N 121.399 -0.813 . . . . 3.1499999999999999 108.815 160.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 18.4 p -172.74 -68.72 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.996 -1.113 . . . . 4.3899999999999997 107.996 -161.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -66.14 139.52 58.15 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.723 0.773 . . . . 5.7000000000000002 109.392 155.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 37.8 m -68.0 -28.02 67.06 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.003 0.921 . . . . 3.4500000000000002 110.441 174.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.76 -32.02 58.45 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.544 1.069 . . . . 2.1400000000000001 112.953 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -64.78 -55.65 18.42 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.262 1.031 . . . . 3.73 111.522 -175.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 31.0 ttt-85 -71.74 -36.22 70.37 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.441 0.904 . . . . 5.4299999999999997 113.441 173.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -53.42 -42.88 67.5 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.829 1.65 . . . . 4.0700000000000003 111.859 172.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.66 -23.3 58.96 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.206 -1.378 . . . . 1.8200000000000001 114.521 174.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.4 -52.01 11.75 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.818 1.19 . . . . 1.75 111.799 167.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.42 -27.38 68.51 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 124.062 0.945 . . . . 2.5800000000000001 112.807 -175.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.1 mtmt -63.19 -31.21 72.3 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.345 -1.472 . . . . 4.8700000000000001 113.742 169.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 7.9 mt -76.25 -36.72 58.34 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.12 0.568 . . . . 2.04 111.209 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 34.8 mm -53.84 -58.81 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.046 1.339 . . . . 2.0899999999999999 110.099 175.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -59.06 -34.8 72.36 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.328 0.862 . . . . 2.3100000000000001 113.328 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -63.68 -36.6 84.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.54 1.136 . . . . 4.1399999999999997 112.205 173.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.67 -28.85 24.44 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.343 1.057 . . . . 3.1699999999999999 111.749 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -55.67 -55.51 31.32 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.252 1.021 . . . . 3.0099999999999998 110.264 163.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -56.52 -24.76 48.76 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.694 1.368 . . . . 2.73 114.694 176.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -103.6 -9.23 19.39 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 114.576 1.324 . . . . 2.3799999999999999 114.576 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -150.55 122.57 8.22 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 121.394 1.906 . . . . 4.6500000000000004 112.083 -177.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -100.42 153.1 19.62 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.289 0.635 . . . . 5.0099999999999998 110.315 153.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.56 -45.54 1.28 Allowed Glycine 0 CA--C 1.53 0.976 0 C-N-CA 126.876 2.179 . . . . 3.6099999999999999 115.489 168.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 23.6 mmt85 -84.47 154.19 22.9 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.352 1.461 . . . . 6.5599999999999996 111.89 -176.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.9 mm -131.67 129.2 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 126.236 1.814 . . . . 3.29 106.324 159.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 2.8 t -87.11 -174.2 4.79 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 112.779 0.659 . . . . 2.04 112.779 -177.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -89.82 -58.12 2.62 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 119.234 -2.166 . . . . 3.1099999999999999 110.029 163.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -54.53 -28.51 45.91 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.184 3.394 . . . . 3.1600000000000001 114.19 176.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -46.87 -59.93 2.76 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.148 1.379 . . . . 3.3100000000000001 111.287 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -52.0 -46.71 65.01 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.41 -0.806 . . . . 3.2999999999999998 111.498 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 -65.92 -42.65 89.84 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 119.009 -0.519 . . . . 0.66000000000000003 111.908 -174.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 11.2 t -70.5 -28.88 65.31 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 117.662 -1.161 . . . . 2.8700000000000001 112.262 174.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.7 mt -69.92 -40.97 75.25 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.801 1.182 . . . . 1.8200000000000001 112.106 172.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.5 mm -53.44 -37.19 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 CA-C-N 121.232 1.833 . . . . 1.77 111.989 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.22 -13.12 59.59 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 124.917 1.246 . . . . 0.56000000000000005 115.126 177.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -81.31 -19.61 66.33 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-N 119.535 1.668 . . . . 1.04 113.778 173.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.1 mp -100.39 -44.57 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 124.815 1.246 . . . . 2.3999999999999999 109.411 168.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.7 m -77.82 58.51 1.89 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.86 2.064 . . . . 1.8799999999999999 109.24 169.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -158.68 -58.54 0.01 OUTLIER Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.359 1.933 . . . . 1.3700000000000001 111.141 -172.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -61.66 -71.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.373 2.715 . . . . 1.9099999999999999 111.242 163.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 16.8 pt -76.38 -18.22 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 115.1 1.519 . . . . 2.5099999999999998 115.1 -170.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.0 -35.26 76.36 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.078 0.77 . . . . 2.52 113.078 -172.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -60.38 -38.49 84.08 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.918 -0.489 . . . . 7.1399999999999997 111.923 175.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.4 tt -71.67 -34.67 69.89 Favored 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 124.343 1.057 . . . . 2.7400000000000002 111.466 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 91.0 mt -47.16 -50.81 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 CA-C-N 119.83 1.195 . . . . 1.9199999999999999 110.098 172.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 13.3 t60 -63.86 -25.16 68.04 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.495 1.295 . . . . 2.04 114.495 -176.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -98.35 -27.0 14.3 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.769 1.168 . . . . 2.8300000000000001 113.17 176.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . 0.525 ' C ' ' H ' ' B' ' 202' ' ' GLN . 4.8 tp60 -72.0 -45.65 60.15 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 124.546 1.139 . . . . 2.6499999999999999 109.824 173.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -83.26 36.3 0.52 Allowed 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 124.374 2.035 . . . . 3.1200000000000001 110.969 175.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.525 ' H ' ' C ' ' B' ' 200' ' ' GLN . 0.9 OUTLIER -117.06 -52.79 2.5 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 112.803 -1.999 . . . . 2.3500000000000001 108.247 151.369 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -65.7 -7.77 17.26 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.537 1.535 . . . . 6.54 114.814 -176.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 22.0 p -71.25 -0.54 10.17 Favored 'General case' 0 CA--C 1.549 0.909 0 O-C-N 120.884 -1.135 . . . . 7.8099999999999996 113.6 160.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 27.0 t -150.62 -22.07 0.23 Allowed 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 116.921 2.193 . . . . 9.0700000000000003 116.921 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 26.4 t . . . . . 0 N--CA 1.492 1.628 0 CA-C-N 121.954 2.161 . . . . 9.1300000000000008 115.048 179.751 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 N--CA 1.477 0.879 0 CA-C-O 117.553 -1.213 . . . . 9.7799999999999994 107.983 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -48.69 -104.61 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 118.929 0.786 . . . . 6.3899999999999997 109.142 111.516 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 86.3 m -91.61 -101.33 0.11 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.514 1.525 . . . . 4.5700000000000003 109.298 172.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -46.11 127.31 8.45 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 126.171 1.788 . . . . 3.4100000000000001 113.186 -165.362 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p -71.51 168.12 18.23 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.952 0.901 . . . . 2.27 111.251 -169.874 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -61.2 -59.92 4.57 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-O 118.502 -0.761 . . . . 2.6800000000000002 109.941 169.287 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -46.64 -41.91 15.48 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.158 1.383 . . . . 1.8799999999999999 111.243 -178.168 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -70.78 -58.02 4.06 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 125.357 1.463 . . . . 2.6899999999999999 113.181 179.131 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -54.24 -26.54 29.26 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 120.622 1.556 . . . . 6.4400000000000004 113.438 168.341 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.75 -42.44 58.22 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 125.456 1.502 . . . . 1.6399999999999999 110.716 174.492 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.5 t -58.9 -38.24 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 120.144 1.338 . . . . 1.8300000000000001 110.754 165.501 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.5 mt -58.25 -48.78 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-O 117.481 -1.247 . . . . 1.97 111.183 168.664 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.8 t -60.77 -35.53 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 CA-C-N 121.029 1.74 . . . . 1.9299999999999999 113.085 178.39 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp -67.15 -48.66 67.36 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.042 -1.036 . . . . 1.8 111.775 170.384 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.1 t -57.59 -40.92 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 125.319 1.448 . . . . 1.8500000000000001 111.797 173.59 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -68.33 -47.87 66.38 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 126.991 2.116 . . . . 3.1499999999999999 111.154 -179.343 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -75.17 -5.27 43.5 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.8 1.037 . . . . 2.6699999999999999 113.8 -179.851 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -84.08 -60.01 2.23 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.272 -0.893 . . . . 3.8300000000000001 112.239 162.277 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -64.64 -30.88 71.91 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.075 -1.016 . . . . 2.96 113.575 -175.0 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -48.8 -34.11 11.73 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 114.277 1.214 . . . . 3.9100000000000001 114.277 167.633 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -95.42 -36.87 11.18 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.865 0.866 . . . . 3.6699999999999999 110.385 -176.012 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.8 t -70.15 -35.74 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 N-CA-C 114.244 1.201 . . . . 3.73 114.244 175.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.6 p 154.91 -89.4 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 129.983 3.313 . . . . 4.21 111.295 175.276 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -173.19 -64.21 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.792 1.637 . . . . 7.9500000000000002 111.457 -174.684 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -117.18 -26.99 6.6 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.296 1.038 . . . . 7.8700000000000001 112.239 -173.298 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.9 p -98.83 102.54 14.31 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.14 1.376 . . . . 5.2400000000000002 113.099 -171.094 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 79.8 mt -55.5 -41.65 73.36 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.059 0.944 . . . . 8.4199999999999999 113.458 -176.745 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 39.8 t -134.16 77.21 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 125.754 1.622 . . . . 4.5800000000000001 110.562 174.289 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -127.47 -10.96 5.7 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.416 1.265 . . . . 8.5700000000000003 114.416 157.053 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -146.86 -65.21 0.28 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.582 0.753 . . . . 7.5300000000000002 110.876 163.906 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt 81.66 -156.96 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 127.357 2.263 . . . . 7.8600000000000003 111.971 178.014 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 29.7 pt -125.38 166.7 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 C-N-CA 126.378 1.871 . . . . 3.25 109.377 175.639 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.4 m -98.77 139.83 33.87 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.011 0.924 . . . . 2.5899999999999999 109.353 163.143 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -54.45 -31.04 54.68 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 122.861 1.315 . . . . 3.2400000000000002 113.28 -177.19 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.2 p -60.77 -24.22 65.6 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.864 1.666 . . . . 2.2000000000000002 114.615 173.723 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.5 m -80.78 -33.43 34.94 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.08 0.952 . . . . 1.49 112.425 174.691 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -59.98 -49.28 78.28 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.072 -1.018 . . . . 3.4100000000000001 111.309 178.232 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 24.5 ptt180 -58.97 -25.21 63.36 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.94 0.718 . . . . 3.04 112.94 176.159 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -88.08 -47.54 8.42 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 125.298 1.439 . . . . 2.5499999999999998 111.276 -178.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -45.77 -43.39 13.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.332 1.453 . . . . 1.77 111.43 167.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 44.5 mt -67.9 -4.26 12.32 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 115.474 1.657 . . . . 2.0699999999999998 115.474 175.252 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -98.22 -19.25 17.97 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.166 1.787 . . . . 2.7400000000000002 113.611 166.657 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.47 -57.1 2.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.371 1.468 . . . . 2.23 112.774 -178.669 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -79.2 -15.8 57.51 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.097 -1.002 . . . . 3.6699999999999999 111.849 -178.085 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -126.66 45.85 2.6 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 127.508 2.323 . . . . 2.8399999999999999 110.672 176.101 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -87.34 -16.41 35.11 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 116.057 1.873 . . . . 1.3700000000000001 116.057 -175.314 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -98.57 -17.84 18.46 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 121.402 1.91 . . . . 2.04 112.196 -175.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.0 tpp -77.03 -13.29 59.98 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.874 1.67 . . . . 2.5299999999999998 112.543 166.423 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.3 tp -72.97 89.85 1.45 Allowed 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 124.142 1.925 . . . . 4.6799999999999997 112.813 -173.648 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.6 t -82.38 71.94 9.44 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 112.999 -1.909 . . . . 4.6900000000000004 110.027 163.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.1 t70 82.26 159.78 0.14 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 127.627 2.371 . . . . 3.8700000000000001 116.266 165.114 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -28.21 -41.28 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 130.959 3.704 . . . . 2.98 114.475 159.371 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.91 -50.87 62.76 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-N 119.596 1.089 . . . . 1.8600000000000001 112.36 176.296 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -64.39 -32.21 73.74 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.892 -0.769 . . . . 4.1399999999999997 112.263 172.795 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -66.33 -50.47 63.49 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 120.104 1.32 . . . . 7.71 112.871 173.506 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.8 mmmt -49.26 -40.84 35.72 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 119.144 0.884 . . . . 6.0999999999999996 112.283 170.022 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.16 -18.72 59.59 Favored 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 115.622 1.712 . . . . 2.48 115.622 177.453 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -78.2 -52.87 8.03 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.797 0.839 . . . . 1.96 111.882 163.188 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -60.28 -29.41 68.79 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.888 2.075 . . . . 2.7200000000000002 113.433 -177.163 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 ptmm? -56.51 -32.03 64.66 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 120.763 -1.21 . . . . 4.4000000000000004 113.015 167.562 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.9 mt -67.38 -42.15 83.83 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.493 -0.754 . . . . 1.8 111.507 176.406 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.9 mm -57.79 -50.09 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.774 1.23 . . . . 2.1800000000000002 110.385 -173.013 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -67.31 -36.57 81.76 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.373 1.069 . . . . 2.29 112.621 -179.085 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -65.81 -28.44 69.0 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 112.747 0.647 . . . . 4.9000000000000004 112.747 172.628 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 tt -91.94 -21.72 20.41 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.409 1.083 . . . . 3.5699999999999998 113.121 -178.366 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -59.21 -19.1 42.56 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.014 1.116 . . . . 2.5699999999999998 114.014 162.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.66 -9.28 59.8 Favored 'General case' 0 CA--C 1.553 1.096 0 N-CA-C 115.26 1.578 . . . . 2.9300000000000002 115.26 164.849 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -148.13 59.22 1.1 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 120.547 1.521 . . . . 3.1600000000000001 114.048 -166.116 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.9 t60 -168.64 112.93 0.59 Allowed 'General case' 0 N--CA 1.48 1.029 0 O-C-N 120.11 -1.619 . . . . 5.2400000000000002 113.34 -173.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.93 30.38 0.17 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.276 2.23 . . . . 7.1600000000000001 113.864 -175.785 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.93 8.06 72.25 Favored Glycine 0 CA--C 1.537 1.424 0 O-C-N 120.07 -1.644 . . . . 3.3199999999999998 113.468 -169.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 10.8 mmt-85 -98.98 98.7 9.72 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 125.964 1.706 . . . . 5.7199999999999998 108.909 -178.148 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.5 mm -68.69 113.16 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 N-CA-C 105.729 -1.952 . . . . 2.8599999999999999 105.729 164.801 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.8 m -80.25 165.64 22.16 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.049 0.841 . . . . 1.9399999999999999 112.297 167.798 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -59.59 -48.75 80.42 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 122.508 1.147 . . . . 3.4199999999999999 110.407 161.607 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.1 -22.73 66.04 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.722 2.009 . . . . 2.8700000000000001 113.482 177.457 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -66.66 -50.13 63.95 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.304 0.957 . . . . 2.8100000000000001 111.098 174.968 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -56.09 -49.8 72.83 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 120.857 -1.152 . . . . 2.8700000000000001 111.694 173.314 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.1 t-105 -63.64 -47.99 79.1 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 121.69 -0.631 . . . . 0.57999999999999996 112.206 -176.095 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 t -67.04 -26.79 66.93 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.354 -0.831 . . . . 2.5499999999999998 111.978 -179.945 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.6 mt -72.43 -35.59 68.37 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.306 -1.331 . . . . 1.77 112.921 171.725 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.5 mm -57.47 -39.29 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 CA-C-N 121.605 2.002 . . . . 1.8799999999999999 111.912 178.271 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.5 -10.84 67.44 Favored Glycine 0 N--CA 1.475 1.298 0 C-N-CA 124.291 0.948 . . . . 0.73999999999999999 114.045 175.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.99 -17.91 66.34 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.792 1.187 . . . . 0.77000000000000002 113.562 176.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -104.09 -45.7 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.667 1.187 . . . . 2.1899999999999999 109.637 166.999 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 30.7 m -75.02 96.53 3.21 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.103 1.361 . . . . 1.75 109.042 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -168.97 -74.02 0.04 OUTLIER Glycine 0 CA--C 1.532 1.127 0 CA-C-O 118.44 -1.2 . . . . 1.24 113.481 -175.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -63.18 -45.81 11.5 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.652 2.235 . . . . 1.3100000000000001 111.531 179.325 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.1 pt -71.82 -13.53 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 114.019 1.118 . . . . 2.3599999999999999 114.019 176.013 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.78 -52.96 63.33 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.148 1.34 . . . . 2.1000000000000001 112.922 177.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -61.01 -33.56 73.45 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.423 -1.423 . . . . 3.8700000000000001 112.669 173.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.6 -45.55 86.48 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.478 0.711 . . . . 1.98 110.865 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.8 mt -49.77 -58.3 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.273 0.629 . . . . 1.78 110.277 168.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -73.16 -20.01 61.0 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.434 0.901 . . . . 2.9300000000000002 113.434 -169.643 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.287 4.0 pt-20 -88.07 -21.9 24.46 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.586 0.754 . . . . 2.6899999999999999 111.987 175.055 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.48 ' C ' ' H ' ' A' ' 99' ' ' GLN . 4.4 mm100 -79.96 -38.72 31.7 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 125.057 1.343 . . . . 2.7400000000000002 114.336 172.23 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.62 9.84 0.58 Allowed 'General case' 0 N--CA 1.487 1.391 0 CA-C-O 123.659 1.695 . . . . 2.5600000000000001 112.682 177.438 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.48 ' H ' ' C ' ' A' ' 97' ' ' GLN . 6.7 mm-40 -124.87 -68.43 0.85 Allowed 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 126.827 2.051 . . . . 3.0 109.965 175.208 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 54.34 4.82 0.07 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 129.16 2.984 . . . . 5.3300000000000001 115.658 170.029 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.7 m -128.94 16.9 6.24 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.021 1.328 . . . . 7.0300000000000002 112.338 -168.32 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 24.1 t -104.05 -5.56 22.0 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 114.36 1.245 . . . . 9.0299999999999994 114.36 -178.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.2 m . . . . . 0 C--O 1.25 1.095 0 C-N-CA 127.469 2.307 . . . . 9.8900000000000006 110.161 -167.906 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 42.8 m . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 118.398 -0.811 . . . . 10.470000000000001 110.211 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -74.19 -111.68 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 106.376 -1.713 . . . . 6.0 106.376 136.838 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 90.2 m -68.07 -94.56 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.719 1.608 . . . . 4.5499999999999998 112.043 166.064 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -27.89 108.48 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 127.076 2.151 . . . . 3.3999999999999999 114.992 -170.547 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.7 p -65.29 156.29 32.47 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.232 1.013 . . . . 1.95 110.252 -173.494 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . 0.444 ' CD ' ' HZ3' ' B' ' 113' ' ' LYS . 2.8 tp10 -58.25 -33.82 69.78 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 118.555 0.616 . . . . 2.3500000000000001 112.39 179.767 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 tt -67.57 -44.11 78.99 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.769 1.628 . . . . 1.96 110.605 177.956 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -72.83 -46.01 55.33 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.35 -0.844 . . . . 2.77 111.287 -178.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . 0.444 ' HZ3' ' CD ' ' B' ' 110' ' ' GLU . 8.5 tmtt? -53.05 -39.23 63.1 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.828 1.651 . . . . 5.9500000000000002 111.101 165.503 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.08 -44.85 78.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 120.686 -1.259 . . . . 1.76 112.73 173.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 75.7 t -55.4 -41.5 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 121.132 1.787 . . . . 1.7 110.608 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 91.1 mt -56.35 -48.33 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 119.322 0.965 . . . . 1.8400000000000001 111.465 170.583 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 37.7 t -65.01 -36.58 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 119.887 1.221 . . . . 1.72 113.3 178.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.99 -45.83 80.19 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.13 -0.981 . . . . 1.8500000000000001 110.783 172.602 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 48.2 t -62.49 -40.67 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.105 1.362 . . . . 1.9399999999999999 111.647 176.116 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -64.67 -49.07 72.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.462 1.505 . . . . 3.02 111.347 176.163 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -80.65 14.0 2.3 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.232 1.013 . . . . 2.8100000000000001 113.672 -179.052 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -108.31 -58.14 2.03 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.271 1.428 . . . . 3.4500000000000002 111.321 163.963 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -64.35 -27.46 69.04 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 120.71 -1.244 . . . . 3.02 113.506 -175.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 17.3 mtpt -45.98 -37.41 6.52 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.186 1.18 . . . . 3.6600000000000001 114.186 164.62 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -90.74 -34.6 15.3 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.956 1.302 . . . . 3.9300000000000002 111.258 -176.431 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 67.3 t -68.4 -44.27 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 124.93 1.292 . . . . 3.5699999999999998 113.485 175.233 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 78.0 p 155.65 -94.77 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 130.417 3.487 . . . . 4.2199999999999998 110.532 -178.206 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -170.63 -66.93 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.568 1.147 . . . . 8.0399999999999991 112.301 -174.497 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -106.12 -36.16 7.0 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 122.127 0.965 . . . . 7.6699999999999999 111.851 -177.342 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 13.1 p -90.65 116.03 28.21 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.609 1.164 . . . . 5.1799999999999997 112.349 -174.585 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 74.0 mt -59.39 -43.79 92.87 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.294 0.638 . . . . 8.5800000000000001 112.633 177.521 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 87.6 t -134.2 78.31 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.801 1.24 . . . . 4.5700000000000003 111.129 -177.092 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -134.58 -12.45 2.34 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 115.245 1.572 . . . . 8.1999999999999993 115.245 165.84 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -143.76 -58.01 0.39 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.305 0.957 . . . . 7.5599999999999996 110.148 159.288 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 18.7 mtmt 79.24 -177.72 0.09 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.891 2.076 . . . . 7.7800000000000002 112.351 174.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 14.4 pt -87.6 161.59 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.619 0.768 . . . . 3.9399999999999999 111.993 167.509 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 51.5 m -93.45 138.66 31.54 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 108.621 -0.881 . . . . 2.6499999999999999 108.621 156.63 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . 0.428 ' HE2' ' CD2' ' B' ' 173' ' ' HIS . 78.5 mttt -55.03 -32.13 61.61 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 119.918 1.235 . . . . 3.1600000000000001 113.313 -173.762 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 50.1 p -64.82 -17.3 64.11 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.533 1.533 . . . . 2.21 114.798 176.078 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 43.4 m -85.8 -35.94 20.38 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.947 1.249 . . . . 1.3300000000000001 112.329 -179.608 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . 0.433 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 11.3 t80 -49.92 -54.14 21.59 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.542 1.137 . . . . 3.5800000000000001 111.047 173.756 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -62.11 -17.83 58.93 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.213 0.82 . . . . 2.8999999999999999 113.213 179.505 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -94.94 -43.83 7.99 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.671 1.588 . . . . 2.3100000000000001 112.516 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -49.39 -41.59 39.86 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.926 -1.109 . . . . 1.6899999999999999 110.483 162.275 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 17.2 mt -67.49 -8.25 32.11 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 116.389 1.996 . . . . 2.3300000000000001 116.389 171.073 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -93.88 -23.02 18.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.95 1.3 . . . . 2.6200000000000001 113.697 164.843 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.13 -60.99 1.43 Allowed 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.841 1.201 . . . . 2.5 113.54 -178.502 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -76.46 -10.68 59.57 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.619 -1.3 . . . . 3.1899999999999999 112.638 -174.573 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.88 31.75 5.24 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 128.012 2.525 . . . . 2.3599999999999999 111.678 175.142 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -69.16 -29.64 67.69 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.967 1.469 . . . . 1.28 114.967 -171.717 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -86.83 -24.98 24.77 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.391 0.996 . . . . 2.0299999999999998 111.416 -171.786 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 5.0 tpp -61.81 -17.54 56.57 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.189 0.996 . . . . 2.6800000000000002 112.719 167.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 16.8 tp -80.9 88.71 5.87 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 123.258 1.504 . . . . 3.8599999999999999 112.168 -169.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 40.2 t -71.27 65.37 0.41 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 113.825 -1.534 . . . . 4.8200000000000003 110.63 158.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 35.2 t70 95.38 156.09 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 129.37 3.068 . . . . 3.8500000000000001 115.936 166.761 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.6 m -34.16 -38.6 0.06 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 130.878 3.671 . . . . 2.9300000000000002 114.496 158.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -57.89 -43.49 94.79 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 120.1 1.318 . . . . 1.8999999999999999 111.748 176.131 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -68.93 -21.36 64.21 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 113.413 0.894 . . . . 4.1900000000000004 113.413 172.857 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -75.06 -45.45 41.41 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 121.182 1.81 . . . . 8.1799999999999997 112.741 167.617 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -53.18 -40.61 64.49 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.548 0.613 . . . . 4.71 111.419 175.367 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -51.85 -45.28 63.96 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.388 0.884 . . . . 2.4900000000000002 113.388 171.698 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -63.49 -38.65 91.96 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.175 0.99 . . . . 1.96 113.176 177.011 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -32.77 74.5 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.694 0.998 . . . . 2.4100000000000001 113.694 175.537 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -53.63 -40.95 66.23 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.423 1.01 . . . . 4.1900000000000004 111.795 173.138 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.38 -39.87 92.25 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.149 -0.932 . . . . 2.0099999999999998 111.416 179.202 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 24.8 mm -61.58 -46.92 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 123.887 0.875 . . . . 2.21 110.967 -178.107 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -69.29 -37.48 77.85 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.036 0.446 . . . . 2.8799999999999999 112.184 177.579 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 -64.61 -26.73 68.53 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 112.646 0.61 . . . . 4.71 112.646 176.706 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.55 -28.12 18.7 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.613 0.765 . . . . 3.5099999999999998 113.02 179.616 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.42 -37.95 40.55 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.715 0.806 . . . . 2.98 112.663 164.11 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -63.89 -10.67 22.14 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 115.5 1.667 . . . . 3.1299999999999999 115.5 173.681 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -131.46 6.54 4.45 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.86 1.43 . . . . 3.1000000000000001 114.86 -173.069 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . 0.428 ' CD2' ' HE2' ' B' ' 138' ' ' LYS . 8.2 t60 -156.99 114.92 3.2 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 116.121 1.897 . . . . 4.1500000000000004 116.121 -158.459 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.35 6.74 9.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 128.328 2.651 . . . . 5.4800000000000004 114.977 -170.137 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . 0.421 ' H ' ' CD2' ' B' ' 173' ' ' HIS . . . 92.04 10.94 60.66 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 125.689 1.614 . . . . 3.2000000000000002 112.952 -166.395 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -76.03 67.56 2.39 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.301 1.84 . . . . 7.0199999999999996 110.877 170.11 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 41.4 mm -52.7 133.65 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.431 1.092 . . . . 3.2400000000000002 110.483 175.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.74 164.99 16.49 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.094 1.758 . . . . 2.1299999999999999 110.678 -179.496 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -66.22 -43.21 87.34 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 122.171 0.986 . . . . 3.6000000000000001 111.534 169.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.15 -25.56 67.09 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.815 2.446 . . . . 3.0600000000000001 113.391 177.251 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -62.75 -59.68 4.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 118.76 0.709 . . . . 3.6800000000000002 110.269 175.525 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -52.82 -49.03 66.48 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.612 -0.68 . . . . 3.2400000000000002 110.653 178.327 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 21.0 t-105 -61.84 -48.48 80.38 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.447 0.536 . . . . 0.68999999999999995 112.447 -177.185 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.5 t -70.72 -27.15 63.76 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.078 -0.963 . . . . 2.5299999999999998 112.075 -179.279 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . 0.433 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 53.2 mt -72.99 -38.98 66.43 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 116.895 -1.526 . . . . 1.79 112.656 171.775 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 25.9 mm -52.96 -42.66 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 CA-C-N 121.683 2.038 . . . . 1.71 111.579 178.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.65 -14.32 64.79 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.556 1.074 . . . . 0.65000000000000002 114.688 177.305 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -79.27 -20.33 69.86 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 118.493 1.147 . . . . 0.75 112.916 176.289 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -101.36 -40.78 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 CA-C-N 118.317 1.058 . . . . 2.29 110.046 167.019 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 14.0 m -79.17 86.74 4.94 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.606 1.562 . . . . 1.8400000000000001 109.0 -178.724 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -164.21 -72.91 0.03 OUTLIER Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.39 1.472 . . . . 1.1699999999999999 113.204 -174.491 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -62.4 -45.69 14.16 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.999 2.466 . . . . 1.1200000000000001 111.913 178.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 21.0 pt -68.92 -17.7 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 113.889 1.07 . . . . 2.0 113.889 174.42 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -55.11 -56.23 22.24 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.216 1.371 . . . . 2.1400000000000001 113.629 -178.849 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -60.81 -35.02 75.44 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.685 -1.259 . . . . 4.1200000000000001 112.439 175.701 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 5.4 tt -61.48 -47.16 86.95 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.189 0.996 . . . . 2.29 110.249 178.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 45.9 mt -51.17 -59.83 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.386 1.074 . . . . 1.9299999999999999 110.835 171.545 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -71.13 -18.28 62.52 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.423 0.897 . . . . 2.9500000000000002 113.423 -174.264 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.328 5.0 pt-20 -85.39 -28.12 25.35 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.868 0.758 . . . . 2.8199999999999998 112.462 173.262 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . 0.414 ' C ' ' H ' ' B' ' 202' ' ' GLN . 6.3 mm100 -80.02 -35.43 37.31 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.059 1.344 . . . . 2.8399999999999999 114.579 174.407 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -72.6 8.75 1.31 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 123.527 1.632 . . . . 2.3399999999999999 112.266 176.325 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.414 ' H ' ' C ' ' B' ' 200' ' ' GLN . 6.9 mm-40 -125.41 -67.64 0.88 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 126.661 1.985 . . . . 3.4199999999999999 110.089 174.42 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 54.67 5.32 0.09 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 128.839 2.855 . . . . 5.3200000000000003 115.349 171.53 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 3.8 m -133.75 17.11 3.91 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.909 1.284 . . . . 6.5999999999999996 111.956 -166.372 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 29.4 t -99.4 -10.95 21.6 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.293 1.219 . . . . 8.7200000000000006 114.293 179.391 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 C--O 1.253 1.242 0 C-N-CA 126.674 1.99 . . . . 9.7899999999999991 110.365 -162.63 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 CA--C 1.501 -0.921 0 N-CA-C 108.501 -0.926 . . . . 12.779999999999999 108.501 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -132.76 -5.33 3.2 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 117.985 -1.486 . . . . 6.7000000000000002 114.709 -130.047 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 21.6 m -70.41 23.28 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.513 2.325 . . . . 4.4199999999999999 115.127 -176.027 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -22.37 97.15 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 127.929 2.492 . . . . 3.9900000000000002 114.489 -169.321 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 p -73.2 150.93 41.69 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.212 0.605 . . . . 1.98 110.362 -161.973 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -59.62 -34.19 72.45 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.59 1.086 . . . . 2.9300000000000002 113.507 -176.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.62 -56.86 13.9 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.161 -0.681 . . . . 2.48 109.161 172.066 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -62.58 -61.36 2.48 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 124.13 0.972 . . . . 3.04 110.318 -172.132 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -20.93 66.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.035 0.534 . . . . 6.0099999999999998 110.761 -172.597 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.13 -23.64 57.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 120.195 -1.566 . . . . 1.9299999999999999 113.541 172.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.8 t -57.09 -32.76 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.674 1.579 . . . . 1.8300000000000001 110.784 168.306 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.7 mt -56.08 -57.74 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 CA-C-N 118.661 0.664 . . . . 2.1299999999999999 109.869 167.542 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.1 t -55.7 -39.72 56.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 125.301 1.44 . . . . 2.21 112.377 -178.483 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 mp -67.13 -24.32 65.9 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.676 1.19 . . . . 1.8400000000000001 113.425 176.323 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.0 t -89.33 -45.9 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.824 0.738 . . . . 2.2200000000000002 111.537 175.692 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -45.94 -55.76 6.35 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.215 1.406 . . . . 3.3799999999999999 111.843 -178.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -47.5 -43.29 24.47 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.968 1.707 . . . . 3.25 114.515 178.705 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -81.83 -21.55 37.53 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.127 0.971 . . . . 3.2400000000000002 113.209 -174.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -85.77 -32.06 22.03 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.154 -0.966 . . . . 3.6600000000000001 112.454 165.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.8 tttp -50.39 -38.63 43.75 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.585 1.954 . . . . 5.1799999999999997 113.843 178.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -85.5 8.95 17.26 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.321 1.449 . . . . 3.4700000000000002 114.212 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.8 m -141.14 -174.37 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.541 1.536 . . . . 3.2400000000000002 110.37 178.006 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.4 p -172.09 -77.21 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.288 -0.882 . . . . 4.5199999999999996 111.779 178.2 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? 177.86 -27.12 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 129.644 3.178 . . . . 13.0 110.925 -165.233 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -89.26 70.75 8.25 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.684 1.194 . . . . 12.609999999999999 111.192 -179.521 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.5 m -173.73 158.52 3.31 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.024 1.73 . . . . 9.0199999999999996 110.779 179.008 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.8 mt -61.95 0.54 0.37 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 126.974 2.11 . . . . 15.52 115.898 -172.408 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.7 t -147.97 136.94 15.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 128.59 2.756 . . . . 5.7300000000000004 105.29 169.794 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.35 -36.09 52.78 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.372 1.069 . . . . 10.630000000000001 113.773 -174.72 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -131.14 124.16 30.13 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.547 1.939 . . . . 12.210000000000001 108.852 165.762 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -170.88 112.0 0.38 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.197 1.399 . . . . 7.5999999999999996 111.242 171.481 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.8 pt -75.33 -176.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.549 0.74 . . . . 3.3599999999999999 110.01 164.735 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.8 t -81.48 137.61 35.59 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.457 -1.402 . . . . 3.0699999999999998 108.285 157.026 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -58.47 -32.5 68.81 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.917 -1.114 . . . . 3.3799999999999999 110.986 170.219 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m -66.26 -18.68 65.5 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.849 1.659 . . . . 2.6499999999999999 114.182 170.052 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 53.2 m -69.21 -41.94 76.4 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.742 1.61 . . . . 1.4099999999999999 111.386 173.057 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -50.46 -50.42 52.41 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.664 1.186 . . . . 3.3500000000000001 113.009 -171.459 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -59.7 -25.66 64.96 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.835 1.654 . . . . 5.2000000000000002 113.757 178.586 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -98.96 -44.44 6.32 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 124.991 1.316 . . . . 2.7599999999999998 111.851 -175.641 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 17.9 ptm -57.42 -32.43 66.86 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.66 -1.275 . . . . 4.0499999999999998 111.848 169.514 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.3 mt -61.14 -14.1 22.4 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.388 1.625 . . . . 2.2599999999999998 115.388 166.109 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -109.44 -5.35 15.82 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 120.322 1.419 . . . . 3.2599999999999998 114.175 169.082 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.76 -74.72 0.5 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.74 1.155 . . . . 2.2000000000000002 109.824 166.445 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -59.1 -34.52 72.1 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.555 1.142 . . . . 3.3799999999999999 113.823 -177.284 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.18 9.47 34.12 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.243 1.572 . . . . 2.5 115.243 -173.583 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -48.16 -34.58 10.19 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.518 1.673 . . . . 1.3400000000000001 115.518 -172.181 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -62.01 -34.98 77.2 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.965 -1.085 . . . . 2.3199999999999998 112.931 -177.333 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.9 tpp -85.0 -3.04 58.63 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.949 1.7 . . . . 2.4700000000000002 112.871 -178.467 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.2 mp -96.61 112.32 24.12 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.182 1.393 . . . . 3.1200000000000001 111.351 -178.813 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 t -75.56 62.96 1.47 Allowed 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.418 -0.801 . . . . 4.9100000000000001 109.376 152.565 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.6 t70 38.29 -109.61 0.08 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.234 2.214 . . . . 7.1500000000000004 111.802 -166.661 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.84 -14.44 36.92 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 126.481 1.913 . . . . 3.2000000000000002 114.213 -173.896 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -63.85 -30.86 78.92 Favored Glycine 0 CA--C 1.533 1.166 0 CA-C-N 120.732 1.606 . . . . 3.1600000000000001 111.175 168.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -78.46 -75.65 0.22 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.16 0.584 . . . . 4.21 110.464 157.793 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.0 ttp-105 -51.91 -28.75 17.39 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 117.837 2.532 . . . . 6.3700000000000001 117.837 -161.816 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -53.69 -35.85 61.54 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 121.122 1.783 . . . . 4.5499999999999998 112.684 170.311 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.33 -26.37 68.4 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.796 1.406 . . . . 2.1200000000000001 114.796 172.888 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.33 -42.59 68.38 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.561 1.073 . . . . 1.8400000000000001 111.366 171.224 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -68.31 -29.67 68.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.747 1.219 . . . . 1.97 112.991 -175.778 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -48.69 -40.05 26.8 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.013 0.911 . . . . 4.1699999999999999 113.042 165.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.9 mt -78.55 -36.65 44.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.729 -1.123 . . . . 2.3399999999999999 111.672 -176.596 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.9 mm -54.68 -53.69 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 122.99 0.516 . . . . 2.2000000000000002 110.386 175.41 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -65.45 -34.42 78.25 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.284 0.846 . . . . 2.6400000000000001 113.284 -179.508 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -62.59 -29.22 70.44 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.312 1.045 . . . . 3.3999999999999999 112.584 176.201 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -88.56 -37.23 15.86 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.246 1.018 . . . . 3.7400000000000002 111.669 170.865 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.84 -24.43 67.74 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.914 -1.116 . . . . 3.3799999999999999 113.945 177.618 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.86 -11.99 21.9 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.927 1.455 . . . . 3.5600000000000001 114.927 169.823 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -160.31 -17.89 0.06 Allowed 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 118.609 2.818 . . . . 4.4000000000000004 118.609 -171.747 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -96.47 114.68 26.37 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 121.511 1.959 . . . . 5.3600000000000003 111.149 175.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -63.54 -18.27 63.67 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.943 2.497 . . . . 4.0499999999999998 115.631 -172.207 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 118.0 2.03 16.49 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.943 -0.921 . . . . 3.2000000000000002 113.269 -160.736 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -66.18 145.49 55.73 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.726 1.263 . . . . 5.25 110.057 137.731 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 13.6 mt -128.33 149.57 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 127.227 2.211 . . . . 3.6800000000000002 106.02 167.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.7 t -123.75 159.98 28.29 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 114.0 1.111 . . . . 2.21 114.0 -174.372 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -73.74 -30.56 62.89 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 120.49 -1.381 . . . . 3.5 113.647 -173.177 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -70.3 -25.61 63.41 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.169 1.388 . . . . 3.9399999999999999 112.739 168.882 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.5 tt0 -58.01 -58.19 9.5 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.276 1.03 . . . . 3.3500000000000001 111.33 -175.523 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -56.14 -46.86 79.09 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.963 -1.086 . . . . 3.3399999999999999 112.403 -176.287 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.8 t-105 -61.46 -45.94 92.16 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.856 -0.592 . . . . 0.71999999999999997 111.278 178.223 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -38.22 90.11 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.595 0.758 . . . . 2.5800000000000001 111.61 178.504 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.2 mt -60.75 -46.05 91.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 118.269 -0.872 . . . . 2.2000000000000002 111.754 174.782 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 31.0 mm -51.35 -40.56 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 CA-C-N 120.485 1.493 . . . . 1.78 112.872 -178.726 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.86 -16.81 57.35 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.079 0.847 . . . . 0.68000000000000005 114.452 177.151 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.4 -19.61 76.19 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 121.124 -1.221 . . . . 0.89000000000000001 113.358 172.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.8 mp -103.02 -48.67 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 118.695 1.248 . . . . 1.9399999999999999 109.879 171.083 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.6 m -72.44 53.76 0.31 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.587 2.355 . . . . 2.4300000000000002 110.077 163.634 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -127.46 -71.46 0.17 Allowed Glycine 0 CA--C 1.528 0.886 0 C-N-CA 128.422 2.915 . . . . 1.02 107.998 172.111 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.9 -52.3 0.7 Allowed 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.441 2.76 . . . . 1.0800000000000001 113.484 175.844 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -72.29 -18.95 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 119.632 1.105 . . . . 2.1699999999999999 113.716 -173.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -51.15 -59.63 3.98 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.191 1.397 . . . . 1.6399999999999999 112.325 -178.522 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -56.09 -45.29 79.43 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.477 0.547 . . . . 3.3500000000000001 112.477 175.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -56.97 -42.65 80.54 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 125.094 1.358 . . . . 2.1899999999999999 111.286 -174.704 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.2 mt -54.95 -55.92 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.776 0.83 . . . . 3.0099999999999998 110.756 176.374 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -63.43 -37.39 87.09 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.446 -0.784 . . . . 2.3500000000000001 112.189 -179.568 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -66.37 -32.57 74.04 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.004 0.921 . . . . 3.1099999999999999 110.932 177.117 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -69.97 -40.44 75.37 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 117.496 -1.24 . . . . 2.96 113.414 170.456 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -59.33 -41.5 89.29 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.2 1.364 . . . . 2.7400000000000002 111.432 177.578 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.02 -40.85 97.24 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.456 -0.778 . . . . 3.27 111.01 179.194 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -72.95 -15.0 61.57 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 114.381 -1.282 . . . . 5.8600000000000003 112.905 178.037 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.5 t 60.64 27.92 17.62 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.977 2.111 . . . . 7.6500000000000004 113.064 177.696 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.9 t -124.41 50.77 1.65 Allowed 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.411 1.263 . . . . 12.69 114.411 -153.343 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 26.3 t . . . . . 0 N--CA 1.484 1.228 0 N-CA-C 113.534 0.938 . . . . 16.5 113.534 160.226 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 CA--C 1.502 -0.887 0 N-CA-C 108.684 -0.858 . . . . 12.789999999999999 108.684 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -132.07 -6.2 3.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 118.453 -1.299 . . . . 6.6699999999999999 114.343 -130.943 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 41.0 m -72.78 35.22 0.07 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.911 2.084 . . . . 4.46 113.63 177.845 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -32.44 102.65 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.65 2.38 . . . . 3.8700000000000001 112.501 -174.194 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 3.1 p -74.3 152.08 39.71 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.434 0.294 . . . . 1.75 111.059 -160.06 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -60.1 -21.96 62.16 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.218 1.192 . . . . 2.3799999999999999 114.218 -177.61 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 tt -80.56 -48.04 13.31 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.767 0.827 . . . . 2.6299999999999999 110.183 171.614 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -67.36 -58.48 4.7 Favored 'General case' 0 C--N 1.333 -0.131 0 C-N-CA 123.404 0.682 . . . . 2.9199999999999999 111.036 -175.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -20.1 56.75 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.152 0.981 . . . . 5.5 112.072 -176.689 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.3 -34.33 74.52 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.321 -1.487 . . . . 1.76 113.425 170.183 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 58.6 t -58.02 -32.9 44.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.254 0.934 . . . . 1.6899999999999999 110.905 175.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 44.0 mt -55.92 -57.66 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 109.079 -0.711 . . . . 2.2599999999999998 109.079 168.735 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 72.3 t -60.74 -36.54 71.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 125.756 1.622 . . . . 2.2200000000000002 112.932 -176.251 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.65 -38.57 84.02 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.641 -0.662 . . . . 1.99 112.135 175.121 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 60.2 t -76.32 -39.05 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-N 118.503 0.592 . . . . 2.0600000000000001 110.955 178.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -51.93 -45.88 64.48 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.868 1.667 . . . . 2.7999999999999998 111.36 175.562 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -58.97 -33.77 71.04 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.362 1.465 . . . . 3.3300000000000001 114.405 175.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -80.82 -43.78 19.51 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.656 0.662 . . . . 3.3799999999999999 112.311 -179.541 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -72.3 -27.31 62.37 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.406 -0.809 . . . . 3.6200000000000001 112.654 176.452 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -42.2 -43.74 3.49 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.179 1.792 . . . . 4.4000000000000004 114.128 171.432 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 -97.77 18.67 15.18 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.132 1.373 . . . . 3.6000000000000001 113.732 -172.159 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 34.9 m -146.27 -176.51 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 126.152 1.781 . . . . 2.9900000000000002 110.278 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 16.6 p -173.05 -74.12 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.057 -1.027 . . . . 4.6299999999999999 111.797 174.272 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? 172.85 -26.4 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 130.3 3.44 . . . . 12.75 110.538 -163.301 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -89.71 70.09 7.73 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.096 1.358 . . . . 12.33 111.157 179.764 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 2.5 m -175.03 159.5 2.64 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.222 1.809 . . . . 9.0199999999999996 110.791 -178.72 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 28.1 mt -62.05 0.97 0.33 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 126.825 2.05 . . . . 15.470000000000001 115.705 -173.745 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 21.2 t -149.41 138.2 15.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 128.659 2.784 . . . . 5.7599999999999998 105.453 172.597 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.73 -37.41 59.18 Favored 'General case' 0 CA--C 1.55 0.958 0 N-CA-C 113.351 0.871 . . . . 10.57 113.351 -177.176 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -131.27 131.94 44.22 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.285 1.834 . . . . 12.220000000000001 108.493 165.268 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 3.5 tmmm? -177.75 113.17 0.08 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.528 1.931 . . . . 7.5599999999999996 110.613 171.791 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 43.3 pt -76.38 -175.69 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 122.988 0.515 . . . . 3.5 110.325 165.271 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 33.7 t -85.52 136.55 33.37 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.595 -1.316 . . . . 2.98 108.703 157.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 17.5 ttpt -59.47 -30.72 68.73 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.97 -1.081 . . . . 3.4199999999999999 111.628 174.638 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 1.7 m -67.62 -18.59 65.02 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.918 1.687 . . . . 2.5899999999999999 113.879 171.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.6 m -70.59 -40.78 73.05 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 120.29 1.405 . . . . 1.3600000000000001 112.316 175.168 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -51.21 -53.55 34.04 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.646 1.179 . . . . 3.4199999999999999 113.12 -173.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -54.75 -22.43 14.09 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.074 1.75 . . . . 5.3700000000000001 114.076 178.254 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -106.46 -38.24 6.25 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.999 1.32 . . . . 3.2599999999999998 113.064 -176.268 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -47.31 -43.16 22.4 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.778 1.231 . . . . 2.0099999999999998 110.847 161.613 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 25.5 mt -63.26 -12.1 26.48 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 116.174 1.916 . . . . 2.27 116.174 171.578 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -113.98 -8.13 13.09 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.106 1.521 . . . . 3.4500000000000002 115.106 167.672 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -76.41 0.44 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.363 0.983 . . . . 2.1600000000000001 110.015 167.225 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -58.92 -36.3 74.52 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.525 1.511 . . . . 3.5800000000000001 114.4 -178.856 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.25 9.5 43.26 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 115.359 1.614 . . . . 2.6099999999999999 115.359 -174.35 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -47.17 -33.62 5.43 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.197 1.925 . . . . 1.3899999999999999 116.197 -170.522 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -65.07 -35.38 80.98 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.942 1.246 . . . . 2.3599999999999999 113.341 -175.5 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 18.3 tpp -78.99 -8.76 59.2 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.304 1.442 . . . . 2.4700000000000002 113.142 -177.09 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.5 mp -92.34 114.43 26.98 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 120.58 -1.325 . . . . 3.1299999999999999 112.522 -172.185 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 29.8 t -73.93 60.75 0.76 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 115.784 -0.644 . . . . 4.9100000000000001 109.533 154.059 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 35.3 t70 36.86 -107.64 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.832 2.053 . . . . 6.7699999999999996 112.007 -165.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.04 -17.92 26.91 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 126.805 2.042 . . . . 3.29 113.853 -174.189 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -62.55 -29.33 73.23 Favored Glycine 0 N--CA 1.473 1.164 0 CA-C-N 120.908 1.685 . . . . 3.2400000000000002 111.259 169.614 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -81.18 -74.57 0.32 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.896 0.878 . . . . 3.9300000000000002 110.95 160.492 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 25.8 ttp-105 -53.69 -27.86 30.29 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 117.67 2.47 . . . . 6.3300000000000001 117.67 -164.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -54.12 -37.46 64.37 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 121.344 1.884 . . . . 4.5199999999999996 112.454 171.905 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.63 -26.54 63.83 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.747 1.388 . . . . 2.04 114.747 172.329 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.44 -43.24 50.72 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.895 1.278 . . . . 1.98 111.37 174.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.64 -28.35 67.65 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.678 1.191 . . . . 1.8899999999999999 112.354 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -50.24 -39.47 44.77 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 122.068 0.937 . . . . 4.1500000000000004 112.923 165.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 9.5 mt -77.21 -35.49 55.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.755 -1.111 . . . . 2.27 111.819 -174.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 37.7 mm -56.09 -52.14 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 122.781 0.432 . . . . 2.1099999999999999 110.208 176.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -65.42 -34.12 77.55 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.14 0.793 . . . . 2.5800000000000001 113.14 -179.633 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -62.3 -29.25 70.3 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.05 0.94 . . . . 3.3900000000000001 112.455 176.419 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -90.04 -34.76 15.83 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.513 1.125 . . . . 3.7999999999999998 111.654 171.606 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.28 -22.4 66.94 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.517 -1.364 . . . . 3.4199999999999999 114.135 175.319 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.34 -11.59 43.49 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.031 1.493 . . . . 3.46 115.031 168.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -162.05 -15.27 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.19 0 N-CA-C 119.097 2.999 . . . . 4.3399999999999999 119.097 -170.648 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -101.23 116.2 32.26 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.986 2.175 . . . . 5.5300000000000002 110.935 175.601 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -68.51 -11.5 59.94 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 128.406 2.682 . . . . 3.9199999999999999 116.732 -166.546 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 110.89 0.15 28.72 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-O 118.694 -1.059 . . . . 3.1099999999999999 113.283 -160.396 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -67.15 144.76 55.85 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 119.199 1.499 . . . . 5.3899999999999997 109.612 136.916 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 13.3 mt -129.89 146.16 34.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 C-N-CA 126.666 1.986 . . . . 3.9500000000000002 106.137 167.126 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.4 t -106.32 177.74 4.77 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.293 1.037 . . . . 2.0699999999999998 113.658 -176.895 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -80.81 -48.94 11.73 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.029 -1.045 . . . . 3.1499999999999999 111.954 171.53 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -64.35 -27.58 69.12 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.734 1.613 . . . . 3.71 112.451 176.726 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -54.4 -54.11 45.06 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.363 0.665 . . . . 3.3300000000000001 110.938 173.62 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -62.61 -47.16 84.99 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.801 -1.187 . . . . 3.71 112.324 -175.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 49.0 t-105 -60.58 -46.99 88.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 119.182 -0.437 . . . . 0.68999999999999995 111.228 178.236 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.99 -31.94 69.88 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.725 -0.655 . . . . 2.5 112.105 -178.469 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 28.2 mt -60.46 -47.86 84.27 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.129 0.877 . . . . 1.96 111.459 171.164 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.9 mm -53.15 -37.71 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 120.188 1.358 . . . . 2.0600000000000001 112.592 179.27 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -59.42 -19.86 48.94 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 118.925 0.784 . . . . 0.67000000000000004 113.898 175.216 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.33 -19.96 79.17 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-N 118.545 1.173 . . . . 0.87 113.846 173.239 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -106.06 -35.43 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.484 1.642 . . . . 1.9299999999999999 110.977 173.495 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 40.7 m -72.75 65.35 0.7 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.537 1.935 . . . . 2.3799999999999999 109.445 167.155 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -150.51 -78.87 0.02 OUTLIER Glycine 0 CA--C 1.529 0.929 0 C-N-CA 126.088 1.804 . . . . 1.1699999999999999 111.329 -174.711 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -63.26 -46.51 9.79 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.129 2.553 . . . . 1.28 112.446 179.288 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 5.8 pt -75.93 -23.34 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 N-CA-C 113.447 0.906 . . . . 2.3199999999999998 113.447 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -53.73 -56.67 15.36 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.475 1.11 . . . . 1.6599999999999999 112.173 -173.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -57.62 -46.5 84.02 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.88 0.696 . . . . 3.5099999999999998 112.88 174.61 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.4 tt -57.78 -40.35 79.62 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 125.351 1.461 . . . . 2.3700000000000001 111.304 -173.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 20.1 mt -56.21 -57.81 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.269 1.028 . . . . 3.1299999999999999 110.345 175.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -60.76 -36.83 79.93 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.522 -0.736 . . . . 2.3100000000000001 112.088 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -67.33 -33.49 75.36 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.7 0.8 . . . . 3.21 110.766 177.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -68.72 -40.72 79.79 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.123 1.369 . . . . 2.9700000000000002 113.019 171.873 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -61.23 -37.34 82.68 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 120.256 1.389 . . . . 2.6699999999999999 111.644 178.396 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.44 -41.8 84.15 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.624 -0.672 . . . . 3.1299999999999999 110.889 178.021 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -71.32 -15.34 62.4 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.545 -1.207 . . . . 5.8399999999999999 112.616 177.082 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 32.1 t 61.04 26.36 16.31 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 127.214 2.206 . . . . 7.5800000000000001 113.109 177.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 48.2 t -121.36 47.27 1.88 Allowed 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.335 1.235 . . . . 12.52 114.335 -154.479 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 28.6 t . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 118.139 -0.934 . . . . 16.32 111.844 156.139 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.476 0.867 0 CA-C-O 118.592 -0.718 . . . . 10.890000000000001 110.737 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 80.4 -22.09 0.29 Allowed 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 117.261 2.319 . . . . 8.9199999999999999 117.261 137.255 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.6 t -74.11 67.78 1.36 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.867 1.267 . . . . 6.1299999999999999 111.276 174.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 95.81 168.01 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 131.381 3.872 . . . . 3.5600000000000001 110.096 -175.854 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.8 p -106.6 162.04 14.1 Favored 'General case' 0 N--CA 1.485 1.32 0 O-C-N 121.284 -0.885 . . . . 1.6699999999999999 111.089 167.762 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -70.27 -23.37 62.87 Favored 'General case' 0 C--O 1.22 -0.458 0 O-C-N 121.47 -0.769 . . . . 2.9100000000000001 112.98 172.876 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -40.79 97.76 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.903 1.683 . . . . 1.8899999999999999 108.788 172.374 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -67.98 -63.85 0.98 Allowed 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 125.151 1.38 . . . . 2.6000000000000001 111.641 178.016 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -50.81 -27.75 7.94 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.012 1.733 . . . . 6.4100000000000001 114.05 170.827 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.34 -45.08 66.87 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 119.938 -1.726 . . . . 1.8 113.204 167.789 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 67.3 t -59.24 -32.81 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-N 121.046 1.748 . . . . 1.9399999999999999 110.86 170.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.6 mt -59.0 -60.14 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.362 -1.304 . . . . 1.8400000000000001 110.503 165.086 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.5 t -56.08 -33.9 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 126.218 1.807 . . . . 1.99 113.056 -176.439 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.75 -39.56 91.2 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.32 -0.863 . . . . 2.25 111.605 171.068 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 71.1 t -73.23 -40.35 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.657 1.183 . . . . 1.9299999999999999 111.545 174.198 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -54.85 -46.01 74.61 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.184 1.356 . . . . 5.6699999999999999 109.977 171.426 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -76.41 -24.05 54.04 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.143 1.164 . . . . 2.04 114.143 -177.193 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -75.32 -45.75 37.63 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.144 -1.598 . . . . 4.04 110.921 167.62 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -71.52 -21.17 61.95 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.718 1.007 . . . . 4.1600000000000001 113.718 -172.795 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -48.64 -20.08 0.42 Allowed 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 114.512 1.301 . . . . 5.04 114.512 169.172 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -100.56 -6.23 25.66 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.935 1.694 . . . . 4.1200000000000001 115.336 -179.364 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.8 m -120.41 -172.36 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 119.804 1.184 . . . . 3.9500000000000002 111.93 -175.316 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.8 p -121.36 -87.52 0.64 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.813 0.845 . . . . 4.2699999999999996 111.226 171.766 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.4 ttpt -160.9 -49.5 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.497 1.044 . . . . 7.2300000000000004 111.42 178.578 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -85.67 74.42 10.26 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.393 -0.817 . . . . 10.32 112.793 -178.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.3 t 93.43 139.05 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 128.437 2.695 . . . . 7.6799999999999997 114.144 164.143 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.6 mt -71.06 -48.33 53.31 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.877 0.871 . . . . 9.3599999999999994 111.536 -174.134 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 p -61.67 -30.69 48.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 124.668 1.187 . . . . 4.8499999999999996 112.976 177.511 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.93 -17.3 61.65 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.491 1.116 . . . . 7.9400000000000004 111.831 172.071 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -128.33 5.2 5.74 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.454 -1.404 . . . . 8.1999999999999993 114.413 -175.317 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.6 132.1 51.27 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.644 0.979 . . . . 7.1600000000000001 113.644 -164.155 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 12.1 pt -82.35 -141.85 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.479 1.111 . . . . 3.8399999999999999 112.063 -178.263 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.5 m -121.71 135.66 54.95 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.2 -0.938 . . . . 3.2200000000000002 111.037 -179.728 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -62.8 -32.73 73.97 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.078 -1.014 . . . . 3.6499999999999999 111.947 -178.771 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 m -57.34 -19.42 22.58 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.418 1.887 . . . . 2.96 115.109 169.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.7 m -82.81 -30.18 28.98 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.177 0.899 . . . . 1.8600000000000001 112.905 178.119 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.4 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 36.6 t80 -57.22 -47.88 80.21 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.533 1.515 . . . . 3.3399999999999999 112.317 -176.831 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -57.8 -23.09 50.84 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.086 1.354 . . . . 2.9399999999999999 114.215 174.435 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -100.18 -37.18 9.04 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.264 1.425 . . . . 3.2400000000000002 112.259 -175.474 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 3.5 ttm -48.32 -44.76 34.4 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.355 -1.466 . . . . 1.8799999999999999 110.283 157.539 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 26.3 mt -64.82 -33.33 75.74 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 114.827 1.417 . . . . 2.04 114.827 175.656 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -87.68 -11.55 48.02 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 120.358 1.436 . . . . 2.9500000000000002 114.028 -178.769 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.89 -64.2 1.08 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 126.388 1.875 . . . . 3.9100000000000001 111.691 173.514 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -74.52 -22.56 58.98 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 118.099 -0.953 . . . . 3.79 113.489 -173.377 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 24.2 mt -113.63 31.82 6.24 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.73 1.212 . . . . 3.3500000000000001 112.707 165.771 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -55.69 -31.1 62.14 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.348 -1.47 . . . . 1.6000000000000001 114.247 -175.404 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -78.55 -49.45 13.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.666 0.786 . . . . 2.1800000000000002 109.893 -168.703 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.4 mtm -79.35 -18.68 51.97 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.939 1.088 . . . . 3.4199999999999999 113.939 174.842 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mp -65.25 -48.99 71.35 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 120.208 1.367 . . . . 4.0099999999999998 110.355 161.45 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.6 m 73.81 -40.71 0.47 Allowed 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.684 1.994 . . . . 4.4400000000000004 114.623 168.427 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -157.47 161.49 38.88 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 123.845 1.783 . . . . 4.2000000000000002 112.614 -179.031 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -33.05 -44.77 0.12 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 130.605 3.562 . . . . 3.5499999999999998 114.445 163.194 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -67.46 -47.22 64.08 Favored Glycine 0 N--CA 1.468 0.777 0 C-N-CA 124.657 1.122 . . . . 2.4500000000000002 112.469 -174.943 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -65.22 -38.93 91.97 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 117.58 0.69 . . . . 2.7999999999999998 111.334 173.26 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.7 ttt-85 -58.28 -24.35 59.2 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.981 -1.074 . . . . 5.6799999999999997 113.392 177.77 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -57.16 -35.65 69.8 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.793 -1.192 . . . . 4.1500000000000004 112.927 170.648 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.42 -14.66 63.16 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.524 1.305 . . . . 2.0299999999999998 114.524 176.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.66 -54.14 4.91 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.698 1.199 . . . . 2.0099999999999998 111.872 165.288 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.14 -32.15 73.61 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.167 0.587 . . . . 2.02 112.402 -176.498 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -57.21 -30.14 64.3 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.223 -0.923 . . . . 3.4500000000000002 112.905 172.746 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.6 mt -75.41 -37.24 60.57 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.857 -0.527 . . . . 2.04 111.517 177.254 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.9 mm -56.54 -50.54 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 123.378 0.671 . . . . 2.1800000000000002 110.495 -177.764 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -64.28 -41.78 96.73 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.364 1.066 . . . . 2.4399999999999999 112.969 179.039 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -59.5 -32.5 70.35 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.107 1.363 . . . . 3.0499999999999998 112.6 174.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.42 -31.29 20.13 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.792 1.237 . . . . 3.3799999999999999 110.961 175.601 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.18 -35.3 79.85 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.702 1.601 . . . . 3.8300000000000001 114.528 -177.55 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.39 -10.6 3.31 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 114.432 1.271 . . . . 3.3799999999999999 114.432 171.357 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -131.14 -10.91 3.73 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.98 1.844 . . . . 3.3100000000000001 115.98 -167.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.84 134.89 11.11 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 121.803 2.092 . . . . 4.3799999999999999 114.674 -160.049 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -74.41 12.65 0.72 Allowed 'General case' 0 N--CA 1.479 0.976 0 O-C-N 120.172 -1.58 . . . . 5.1699999999999999 112.817 167.974 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.84 49.8 16.13 Favored Glycine 0 C--N 1.339 0.706 0 C-N-CA 124.474 1.035 . . . . 5.7300000000000004 111.07 -172.5 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.1 mmt85 -65.88 85.25 0.08 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 105.65 -1.982 . . . . 7.0499999999999998 105.65 159.784 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 9.3 mm -69.85 86.91 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 108.384 -0.969 . . . . 3.48 108.384 -173.021 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.4 m -66.61 159.26 27.9 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.141 0.976 . . . . 2.4300000000000002 110.315 171.776 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -51.76 -42.87 62.7 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 122.276 1.036 . . . . 4.0 110.873 171.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -74.98 -20.22 59.76 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 131.288 3.835 . . . . 3.6200000000000001 114.872 173.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -68.27 -55.04 13.56 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 122.003 2.183 . . . . 3.79 107.243 167.439 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -57.92 -52.45 65.43 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.049 -1.032 . . . . 2.77 112.712 176.657 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -64.25 -41.24 97.05 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.266 -0.897 . . . . 0.89000000000000001 113.065 -176.697 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.59 -37.37 73.9 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.19 0.904 . . . . 2.7200000000000002 111.054 177.652 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 64.6 mt -66.03 -40.32 90.95 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 117.947 -1.025 . . . . 2.1499999999999999 112.289 177.325 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 36.7 mm -56.46 -34.27 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-N 121.417 1.917 . . . . 1.8899999999999999 112.303 177.502 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -73.81 -1.88 59.84 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.247 1.403 . . . . 1.1499999999999999 114.917 176.178 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.72 -28.21 19.58 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-N 118.715 1.257 . . . . 0.67000000000000004 114.211 173.086 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -93.68 -40.23 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-N 118.417 1.109 . . . . 2.0800000000000001 110.104 172.724 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 11.5 m -75.65 124.58 27.48 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.357 1.463 . . . . 2.0699999999999998 108.415 176.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 139.25 -70.66 0.46 Allowed Glycine 0 N--CA 1.472 1.047 0 CA-C-O 117.918 -1.49 . . . . 1.8600000000000001 113.21 -176.023 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -59.87 -45.58 23.88 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.021 2.481 . . . . 1.1899999999999999 111.677 178.276 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -84.97 -5.46 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 113.403 0.89 . . . . 2.3100000000000001 113.403 175.225 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.05 81.9 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.815 1.188 . . . . 2.0899999999999999 112.711 -174.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -65.91 -36.62 83.9 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.106 -0.996 . . . . 4.3499999999999996 113.564 174.131 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -60.5 -38.64 84.96 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 117.87 -1.062 . . . . 2.8300000000000001 110.385 177.061 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.7 mt -49.25 -65.52 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 123.63 0.772 . . . . 2.21 111.133 170.247 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -61.72 -33.59 74.29 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.903 -0.498 . . . . 2.6000000000000001 111.994 -175.115 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.308 2.8 pt-20 -86.97 -9.91 54.46 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 119.029 -0.51 . . . . 3.23 112.244 -176.048 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.445 ' C ' ' H ' ' A' ' 99' ' ' GLN . 0.2 OUTLIER -78.05 -36.11 48.79 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.025 1.73 . . . . 3.0299999999999998 113.16 163.525 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -71.08 8.11 1.04 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 124.026 1.869 . . . . 2.4500000000000002 112.208 174.326 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.469 ' C ' ' H ' ' A' ' 101' ' ' SER . 15.0 mm-40 -130.03 -66.89 0.77 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 127.007 2.123 . . . . 3.3999999999999999 109.515 176.501 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . 0.255 10.0 pt20 53.42 -0.37 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 131.063 3.745 . . . . 6.1699999999999999 115.612 178.732 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.469 ' H ' ' C ' ' A' ' 99' ' ' GLN . 47.2 t -150.13 33.63 0.66 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.652 1.981 . . . . 5.96 110.653 -170.9 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.2 t -156.16 80.2 0.98 Allowed 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.973 -1.08 . . . . 7.46 110.626 -177.335 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.0 t . . . . . 0 C--O 1.255 1.378 0 CA-C-O 114.023 -2.894 . . . . 10.19 112.907 179.146 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 24.6 m . . . . . 0 N--CA 1.476 0.861 0 CA-C-O 118.807 -0.616 . . . . 10.390000000000001 110.571 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 82.62 -19.18 0.42 Allowed 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 117.156 2.28 . . . . 8.4399999999999995 117.156 136.662 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 49.7 t -70.98 73.56 0.61 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.018 1.327 . . . . 6.6500000000000004 111.968 175.793 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 95.48 164.17 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 131.68 3.992 . . . . 3.6099999999999999 110.49 -178.759 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.2 p -104.93 158.44 16.54 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.968 0.907 . . . . 1.8100000000000001 110.662 169.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -68.54 -25.27 64.84 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 118.945 0.793 . . . . 3.1499999999999999 112.366 175.544 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.03 -40.9 99.12 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 120.48 1.491 . . . . 1.79 108.895 172.784 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -67.58 -63.04 1.14 Allowed 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.788 1.235 . . . . 2.6200000000000001 111.781 177.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 36.7 tptt -49.9 -28.97 7.35 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 121.022 1.737 . . . . 7.1799999999999997 114.104 169.472 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.41 -46.46 66.81 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 119.69 -1.881 . . . . 1.8 113.237 167.536 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 85.9 t -56.9 -33.95 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 CA-C-N 121.626 2.012 . . . . 2.0299999999999998 110.868 170.37 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 17.7 mt -59.01 -61.08 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-O 117.684 -1.151 . . . . 1.9299999999999999 110.91 166.111 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 10.6 t -55.75 -35.83 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 126.444 1.898 . . . . 2.1400000000000001 112.519 -176.088 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.2 mp -63.35 -36.71 84.59 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.441 -0.787 . . . . 2.1099999999999999 111.323 173.088 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.8 t -80.3 -37.95 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 125.344 1.458 . . . . 2.23 111.768 176.083 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -53.4 -45.85 69.47 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.104 1.32 . . . . 5.5599999999999996 110.399 169.634 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -72.36 -18.24 61.77 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.088 1.144 . . . . 2.0099999999999998 114.088 -178.624 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -80.71 -48.13 13.0 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 120.338 -1.476 . . . . 3.4900000000000002 111.146 167.26 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -71.34 -20.76 62.13 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.262 0.838 . . . . 3.8399999999999999 113.262 -167.497 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -46.73 -19.71 0.1 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.49 1.516 . . . . 4.96 114.504 164.169 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -107.52 5.73 27.39 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.384 1.874 . . . . 4.0199999999999996 115.429 -178.513 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.2 m -139.24 -169.22 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 119.972 1.26 . . . . 3.2200000000000002 111.291 179.287 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 30.9 p -120.43 -84.32 0.66 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.734 1.152 . . . . 4.2999999999999998 113.697 177.394 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -165.07 -54.48 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.461 1.028 . . . . 7.0599999999999996 111.166 -178.517 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -80.75 68.71 7.09 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.901 0.88 . . . . 10.76 112.493 176.016 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 8.9 t 93.54 146.59 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 128.212 2.605 . . . . 7.3200000000000003 114.238 170.857 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 73.5 mt -72.24 -48.3 43.83 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.527 1.131 . . . . 9.6600000000000001 111.74 -176.624 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.77 -19.84 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.821 1.248 . . . . 4.8899999999999997 113.184 177.672 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -21.31 66.8 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.823 0.849 . . . . 8.1199999999999992 112.852 173.104 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -137.5 -1.58 2.06 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 115.283 1.586 . . . . 8.7599999999999998 115.283 -178.756 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.07 134.8 0.17 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.577 1.951 . . . . 6.9400000000000004 115.384 -177.732 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 9.7 pt -83.93 -123.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.864 0.866 . . . . 4.0800000000000001 113.058 -178.48 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 42.8 t -135.56 132.99 37.88 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.83 1.652 . . . . 3.3799999999999999 109.384 175.303 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -62.12 -18.38 60.67 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.217 1.007 . . . . 3.3799999999999999 112.999 177.352 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.4 m -70.69 -17.99 62.83 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.797 1.639 . . . . 2.8900000000000001 114.333 170.298 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 9.1 m -89.9 -19.51 24.48 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.957 1.095 . . . . 2.8599999999999999 113.957 177.556 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . 0.411 ' CZ ' HD13 ' B' ' 145' ' ' LEU . 59.5 t80 -53.89 -52.55 60.14 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 120.888 1.676 . . . . 3.7000000000000002 111.072 177.811 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 33.8 ptt180 -57.48 -24.65 57.05 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.722 1.609 . . . . 3.1400000000000001 114.468 174.283 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -100.95 -38.36 8.24 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.931 1.692 . . . . 3.5299999999999998 111.722 -168.813 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 6.3 tmm? -47.88 -43.93 29.04 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.393 -1.442 . . . . 1.75 110.969 152.726 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . 0.411 HD13 ' CZ ' ' B' ' 141' ' ' PHE . 93.9 mt -74.34 -24.75 59.24 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.769 1.396 . . . . 2.1600000000000001 114.769 178.095 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -83.64 -16.82 43.72 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.827 1.649 . . . . 2.7999999999999998 113.518 173.579 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -100.84 -63.61 1.12 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.928 1.691 . . . . 3.98 113.131 176.066 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -74.66 -17.08 60.74 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 119.434 1.015 . . . . 3.73 113.552 -173.252 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 46.0 mt -117.2 30.55 7.25 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.827 1.651 . . . . 3.1899999999999999 112.441 165.447 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -57.25 -28.72 63.19 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.231 -1.543 . . . . 1.6599999999999999 113.525 -176.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -76.95 -51.59 10.91 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.446 -0.784 . . . . 2.2200000000000002 109.374 -168.819 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 24.4 mtm -76.65 -17.32 59.22 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.943 1.09 . . . . 3.5099999999999998 113.943 174.391 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.3 mp -66.7 -51.14 59.43 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.172 1.351 . . . . 3.96 110.396 162.315 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 14.2 m 73.63 -48.92 0.68 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.754 2.022 . . . . 4.4000000000000004 113.733 171.436 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -145.01 162.75 36.16 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 123.884 1.802 . . . . 4.4299999999999997 113.409 175.69 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -32.79 -42.88 0.08 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 131.094 3.758 . . . . 3.7200000000000002 114.32 161.064 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -66.82 -34.1 86.19 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 124.399 1.0 . . . . 2.5600000000000001 113.336 -179.198 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -76.98 -41.83 41.38 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 117.818 0.809 . . . . 2.7599999999999998 111.068 172.708 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 10.2 ttt180 -51.15 -30.1 15.65 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 120.604 -1.31 . . . . 5.8899999999999997 114.017 174.156 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -50.86 -37.54 43.93 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.633 -1.292 . . . . 4.7599999999999998 112.5 173.014 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -71.78 -14.24 61.93 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 114.979 1.474 . . . . 2.0699999999999998 114.979 178.451 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.06 -52.73 6.06 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.374 0.988 . . . . 1.96 111.214 163.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -30.81 70.9 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.508 0.723 . . . . 1.96 111.858 -172.501 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -54.06 -33.01 56.34 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.297 -0.877 . . . . 3.4500000000000002 112.875 169.579 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 18.0 mt -77.21 -36.26 54.93 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 121.733 -0.604 . . . . 2.0899999999999999 111.339 -177.721 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 40.8 mm -55.51 -55.84 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 124.079 0.952 . . . . 2.1800000000000002 109.486 177.864 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -62.3 -34.99 77.66 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.183 0.808 . . . . 2.4900000000000002 113.183 -178.19 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -38.61 91.5 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.045 1.338 . . . . 3.6699999999999999 113.044 172.975 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.43 -35.89 18.02 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.431 1.093 . . . . 3.3100000000000001 110.674 -175.345 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -55.95 -40.75 73.65 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.85 1.26 . . . . 3.23 114.33 -175.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.61 -11.57 5.1 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 114.833 1.419 . . . . 2.9500000000000002 114.833 173.212 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -130.04 3.99 4.85 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.734 1.383 . . . . 3.0299999999999998 114.734 -168.91 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -152.14 102.52 2.8 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.216 -1.552 . . . . 4.2400000000000002 111.707 -167.882 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -78.8 69.59 5.0 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.707 2.003 . . . . 3.8100000000000001 112.952 -167.163 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 78.45 -11.43 24.97 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.946 1.736 . . . . 4.0700000000000003 114.588 175.066 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.51 162.84 3.51 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.231 1.812 . . . . 6.8899999999999997 111.297 176.631 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 17.8 mm -133.49 129.5 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.773 1.629 . . . . 4.1699999999999999 106.671 164.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.7 m -127.92 157.38 40.71 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.09 1.356 . . . . 4.0199999999999996 112.856 -170.033 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -68.35 -46.49 70.01 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.266 -0.897 . . . . 3.8700000000000001 113.176 -171.562 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -73.65 -35.18 65.23 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.59 2.356 . . . . 3.7999999999999998 111.739 178.087 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -55.55 -58.55 7.32 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.361 1.064 . . . . 3.0600000000000001 110.272 167.258 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -49.6 -51.03 40.26 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.569 -0.707 . . . . 3.6000000000000001 111.565 177.112 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 40.0 t-105 -66.88 -46.42 75.0 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.621 -0.674 . . . . 1.0 112.775 -177.767 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -69.04 -35.23 76.36 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.177 0.991 . . . . 2.6499999999999999 111.27 -176.267 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.1 mt -64.05 -37.87 89.0 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 118.152 -0.928 . . . . 2.0299999999999998 112.194 173.594 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 41.6 mm -57.08 -35.75 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 121.425 1.921 . . . . 1.9399999999999999 111.953 174.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -72.17 1.12 35.4 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 124.974 1.273 . . . . 1.1299999999999999 114.48 174.46 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -96.81 -30.27 7.65 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.289 1.424 . . . . 0.71999999999999997 114.654 173.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -87.51 -44.23 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 118.925 1.363 . . . . 2.0800000000000001 109.777 170.289 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.72 145.0 45.5 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.977 1.311 . . . . 2.1099999999999999 108.861 175.497 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . 122.55 -72.61 0.39 Allowed Glycine 0 CA--C 1.531 1.039 0 CA-C-O 117.791 -1.561 . . . . 2.2400000000000002 112.074 -176.395 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -62.19 -45.02 16.85 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.621 2.214 . . . . 1.2 111.524 179.935 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.5 pp -82.8 -5.83 9.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 113.397 0.888 . . . . 2.2200000000000002 113.397 174.257 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.16 -35.63 79.36 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.697 1.135 . . . . 2.1800000000000002 112.99 -175.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -65.19 -36.46 84.26 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 113.46 0.911 . . . . 4.7400000000000002 113.46 175.763 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.2 tt -61.8 -39.07 90.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.914 -1.041 . . . . 3.0699999999999998 110.408 177.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 32.6 mt -49.21 -65.54 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-O 121.632 0.729 . . . . 2.3599999999999999 111.231 171.56 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 64.9 t60 -63.13 -33.31 75.18 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.827 -0.545 . . . . 2.6400000000000001 111.467 -174.541 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.297 2.9 pt-20 -85.88 -10.04 55.98 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.523 0.564 . . . . 3.3500000000000001 112.523 -176.355 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . 0.451 ' C ' ' H ' ' B' ' 202' ' ' GLN . 0.1 OUTLIER -77.67 -36.37 51.41 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 126.197 1.799 . . . . 3.1899999999999999 113.278 164.408 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.09 7.6 1.19 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 126.673 1.989 . . . . 2.5899999999999999 112.064 174.215 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.467 ' C ' ' H ' ' B' ' 204' ' ' SER . 12.6 mm-40 -128.92 -66.94 0.8 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 127.005 2.122 . . . . 3.5899999999999999 109.319 176.209 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 53.04 2.83 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 130.572 3.549 . . . . 6.2199999999999998 115.379 177.862 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 204' ' ' SER . . . . . 0.467 ' H ' ' C ' ' B' ' 202' ' ' GLN . 45.0 t -154.76 30.57 0.41 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.821 1.648 . . . . 5.9800000000000004 110.873 -168.034 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 28.0 t -155.65 79.72 1.01 Allowed 'General case' 0 N--CA 1.47 0.531 0 O-C-N 120.862 -1.149 . . . . 7.3799999999999999 110.426 -176.341 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 18.9 t . . . . . 0 C--O 1.251 1.163 0 CA-C-O 114.469 -2.681 . . . . 10.029999999999999 111.831 176.52 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.9 m . . . . . 0 CA--C 1.502 -0.881 0 N-CA-C 108.848 -0.797 . . . . 11.220000000000001 108.848 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -131.01 -11.96 3.7 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 118.714 -1.194 . . . . 7.5199999999999996 113.577 -132.021 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.7 t 76.86 -8.17 1.73 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.265 2.226 . . . . 5.46 115.613 162.35 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -26.61 95.8 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 128.083 2.553 . . . . 3.9399999999999999 112.902 -175.998 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 56.3 p -76.11 167.43 21.87 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.767 0.827 . . . . 2.2000000000000002 111.759 -165.588 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -55.5 -49.82 71.56 Favored 'General case' 0 C--O 1.217 -0.651 0 CA-C-O 117.833 -1.08 . . . . 3.0 109.877 168.536 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.01 -48.74 61.37 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.44 1.018 . . . . 2.1899999999999999 110.538 178.494 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -68.39 -58.74 3.89 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 118.455 -0.784 . . . . 3.4199999999999999 111.252 -178.362 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -52.74 -27.49 17.93 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 120.194 1.361 . . . . 6.7599999999999998 112.751 173.333 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.29 -41.76 56.32 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 120.586 -1.321 . . . . 1.8200000000000001 112.702 172.949 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -56.08 -47.05 80.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 CA-C-N 120.503 1.502 . . . . 1.7 109.877 165.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.1 mt -53.08 -47.48 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.438 1.095 . . . . 1.8600000000000001 111.007 171.564 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.6 t -68.72 -33.73 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 120.099 1.318 . . . . 2.0299999999999998 113.055 178.329 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.84 -35.64 77.19 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.266 -1.521 . . . . 1.99 110.836 171.707 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 t -69.3 -39.44 79.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 125.517 1.527 . . . . 1.8100000000000001 110.999 174.138 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -62.2 -51.25 68.54 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.956 0.902 . . . . 3.1699999999999999 110.552 169.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.401 ' HA ' ' CD ' ' A' ' 21' ' ' LYS . 2.8 t30 -61.1 -18.37 57.59 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.104 1.15 . . . . 2.2000000000000002 114.104 -179.5 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -80.82 -68.47 0.68 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.402 0.681 . . . . 3.1699999999999999 111.974 162.949 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -64.23 -25.96 68.3 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.873 1.064 . . . . 2.98 113.873 -163.659 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.401 ' CD ' ' HA ' ' A' ' 18' ' ' ASN . 7.4 ptmt -51.54 -26.34 8.39 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 120.054 1.297 . . . . 2.7999999999999998 113.056 172.282 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -98.53 5.19 48.11 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.373 1.469 . . . . 3.3799999999999999 114.907 -175.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 18.0 m -137.7 153.55 28.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.374 1.069 . . . . 3.04 110.217 172.131 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.5 m -80.12 56.2 2.36 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 116.145 1.906 . . . . 4.1200000000000001 116.145 -170.742 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.3 tttp 78.61 -45.64 0.4 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 126.627 1.971 . . . . 5.6299999999999999 115.787 150.108 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -116.8 150.28 38.59 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.981 1.713 . . . . 6.6100000000000003 111.336 -173.114 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.7 m -55.0 -18.1 4.66 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.954 1.835 . . . . 9.3100000000000005 115.954 -173.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.8 mt -64.52 -31.13 72.21 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.423 -0.798 . . . . 9.3100000000000005 112.203 171.62 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.5 t 53.22 80.82 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 127.104 2.162 . . . . 6.4900000000000002 111.828 -176.617 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -58.27 -29.9 66.18 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.283 1.033 . . . . 9.6199999999999992 113.507 176.483 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -168.08 150.6 5.53 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 128.043 2.537 . . . . 7.3600000000000003 109.026 -178.875 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.47 154.43 35.5 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 126.562 1.945 . . . . 7.1100000000000003 110.235 -177.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 18.5 pt -62.24 155.14 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 N-CA-C 113.702 1.001 . . . . 4.3700000000000001 113.702 -179.437 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.4 m -76.28 139.82 41.27 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.198 -0.939 . . . . 3.0699999999999998 110.109 162.909 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -50.71 -28.63 9.44 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.318 1.447 . . . . 4.0300000000000002 114.405 -178.033 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.1 p -60.17 -21.93 62.28 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.952 1.464 . . . . 2.5699999999999998 114.952 172.937 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 62.1 m -71.85 -49.62 36.7 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 118.539 -0.743 . . . . 1.6599999999999999 112.377 176.082 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -49.52 -52.48 29.34 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.611 1.165 . . . . 3.3599999999999999 112.107 -178.027 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -57.54 -12.43 2.72 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.007 1.114 . . . . 3.1400000000000001 114.007 178.708 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -116.9 -23.38 8.08 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 114.841 1.423 . . . . 4.8899999999999997 114.841 174.284 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -53.37 -39.23 64.04 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 120.197 1.362 . . . . 2.0600000000000001 110.47 158.723 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 mt -59.72 -22.89 62.66 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 114.317 1.229 . . . . 2.3300000000000001 114.317 169.426 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -98.26 -16.27 19.48 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.88 1.272 . . . . 3.3500000000000001 113.056 -179.231 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -97.66 -70.76 0.71 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.817 0.847 . . . . 2.8799999999999999 110.721 169.324 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -62.19 -34.38 76.33 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.815 1.189 . . . . 3.6499999999999999 113.347 -177.109 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.8 19.38 20.56 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 114.33 1.233 . . . . 2.7400000000000002 114.33 -178.939 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -51.46 -34.26 34.58 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 115.057 1.503 . . . . 1.45 115.057 -171.823 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.463 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 9.0 m-70 -57.68 -27.64 63.08 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.834 2.054 . . . . 2.2400000000000002 113.988 -175.879 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 28.2 tpp -107.93 1.35 22.57 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.578 1.551 . . . . 2.8399999999999999 113.433 -169.21 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.1 mp -70.38 168.23 16.49 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.96 1.304 . . . . 3.21 112.004 175.11 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -164.34 102.28 0.84 Allowed 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.02 -1.675 . . . . 4.0 108.96 -168.535 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.48 ' CG ' ' H ' ' A' ' 53' ' ' THR . 17.6 t70 53.84 -166.83 0.08 Allowed 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 122.285 1.04 . . . . 4.5 110.648 -160.587 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.48 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 82.6 p -71.91 -27.65 62.97 Favored 'General case' 0 CA--C 1.518 -0.269 0 O-C-N 120.381 -1.449 . . . . 3.73 112.653 154.226 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.02 -42.12 53.85 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 124.617 1.104 . . . . 2.1099999999999999 112.817 -175.289 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -55.25 -55.69 28.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.464 1.106 . . . . 3.2200000000000002 111.62 169.167 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -55.65 -47.72 76.2 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.522 1.055 . . . . 6.0300000000000002 112.391 178.34 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -63.39 -19.12 64.39 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 120.758 -1.214 . . . . 4.0599999999999996 113.66 -175.114 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.14 -38.87 74.14 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.17 0.896 . . . . 1.96 112.023 166.522 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.15 99.58 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.594 0.758 . . . . 1.8600000000000001 112.093 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.73 -30.72 70.15 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.742 1.217 . . . . 2.79 113.792 175.317 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.2 mtmt -61.96 -34.82 76.82 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.851 -1.156 . . . . 4.75 111.762 170.714 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.0 mt -70.93 -40.04 72.32 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.466 0.706 . . . . 2.0499999999999998 111.954 175.368 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.8 mm -52.16 -53.28 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.55 0.74 . . . . 2.2999999999999998 110.612 177.933 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -71.35 -38.32 71.63 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 124.65 1.219 . . . . 3.2400000000000002 112.679 -176.753 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.4 t30 -54.83 -35.88 64.42 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.533 0.682 . . . . 3.3900000000000001 111.629 168.402 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.4 tp -86.23 -19.82 29.42 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 120.826 -1.171 . . . . 3.5600000000000001 113.319 -178.287 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -62.18 -22.7 66.11 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.281 0.845 . . . . 3.04 113.281 173.508 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.18 -6.24 41.39 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 114.506 1.299 . . . . 3.23 114.506 168.285 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -139.99 14.63 2.46 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 125.152 1.381 . . . . 2.6899999999999999 114.416 -168.313 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -128.35 88.56 2.77 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.471 -1.393 . . . . 6.6200000000000001 113.13 -163.226 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -67.84 32.35 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 128.049 2.54 . . . . 5.8399999999999999 114.623 178.643 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.49 -8.44 9.99 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 126.085 1.802 . . . . 2.6600000000000001 115.6 175.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.0 mmt-85 -78.84 -170.59 2.22 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.898 1.349 . . . . 7.3799999999999999 111.085 168.359 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.8 mm -137.7 135.75 45.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 104.872 -2.269 . . . . 3.4900000000000002 104.872 164.597 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.2 m -96.94 167.12 11.27 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.927 0.891 . . . . 2.9300000000000002 110.403 165.62 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -66.08 -58.75 4.78 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 120.655 -1.278 . . . . 3.3199999999999998 111.74 -178.883 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -69.3 -14.62 63.04 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.682 1.593 . . . . 2.6400000000000001 112.848 -173.586 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -53.69 -54.12 42.33 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.59 1.556 . . . . 3.2200000000000002 111.028 171.147 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -65.09 -42.37 94.1 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.086 -1.634 . . . . 4.6500000000000004 112.819 175.316 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.6 t-105 -60.79 -43.67 97.8 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.756 -0.59 . . . . 0.66000000000000003 111.305 -179.021 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.5 t -73.57 -26.98 61.08 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 117.306 -1.331 . . . . 2.79 111.939 176.91 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 22.2 mt -65.69 -43.0 90.57 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 120.39 1.45 . . . . 1.9199999999999999 112.582 169.568 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 38.0 mm -52.48 -36.47 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-N 120.801 1.637 . . . . 1.6799999999999999 112.018 176.066 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.24 -29.51 68.85 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-O 119.07 -0.85 . . . . 0.68999999999999995 113.573 175.185 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.09 -26.84 65.49 Favored Glycine 0 CA--C 1.534 1.25 0 CA-C-N 119.182 1.491 . . . . 0.56999999999999995 114.427 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -92.85 -35.6 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 CA-C-N 119.351 1.576 . . . . 1.9199999999999999 111.162 169.737 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.4 m -72.08 -37.46 69.59 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.194 1.398 . . . . 2.77 112.652 -177.598 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.84 -47.09 66.56 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 125.412 1.482 . . . . 2.3500000000000001 114.877 -177.543 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.74 -42.5 6.62 Favored 'Trans proline' 0 C--N 1.352 0.757 0 CA-C-N 120.976 2.388 . . . . 1.46 112.898 174.307 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.5 pt -84.58 -31.3 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 115.193 1.553 . . . . 2.3100000000000001 115.193 -171.28 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.25 71.12 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 120.13 1.332 . . . . 2.1200000000000001 113.579 -168.43 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -62.59 -23.38 67.0 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.403 0.89 . . . . 7.3099999999999996 113.403 175.578 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.61 -30.75 24.7 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.919 1.288 . . . . 3.2000000000000002 111.073 174.033 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.5 mt -51.68 -55.53 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.328 0.967 . . . . 2.21 111.004 174.27 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -52.69 -41.43 63.88 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.664 1.12 . . . . 3.9100000000000001 113.495 178.1 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -72.64 -8.36 54.91 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.014 0.925 . . . . 4.7400000000000002 112.488 -179.13 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -97.71 -35.01 10.7 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.594 1.958 . . . . 3.79 112.941 165.195 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -62.37 -5.33 2.37 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 120.358 1.435 . . . . 2.4199999999999999 112.586 163.97 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -110.3 -63.17 1.42 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.894 1.678 . . . . 2.5699999999999998 111.039 171.927 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 54.35 7.46 0.14 Allowed 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 128.827 2.851 . . . . 6.3399999999999999 115.791 177.95 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.7 m -158.14 44.8 0.32 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 127.147 2.179 . . . . 6.8899999999999997 108.785 177.81 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.5 t -82.29 5.59 19.61 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.069 -1.019 . . . . 9.0999999999999996 113.301 171.0 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 42.4 t . . . . . 0 C--O 1.25 1.117 1 C-N-CA 132.286 4.234 . . . . 10.81 108.368 -169.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 CA--C 1.503 -0.828 0 N-CA-C 109.518 -0.549 . . . . 11.27 109.518 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -135.27 -25.18 1.36 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.713 1.258 . . . . 6.54 111.619 -135.018 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 11.3 t 70.04 -0.36 2.79 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.975 2.11 . . . . 4.96 116.111 162.406 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -31.52 112.49 0.1 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 127.664 2.385 . . . . 3.6400000000000001 113.514 -176.385 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 71.7 p -83.64 155.0 23.41 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.194 0.998 . . . . 2.5899999999999999 111.191 -177.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . 0.484 ' CD ' ' HZ3' ' B' ' 113' ' ' LYS . 3.0 tp10 -53.69 -33.17 54.57 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.712 1.005 . . . . 2.46 113.712 178.894 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.82 -47.41 69.13 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.005 0.522 . . . . 3.0499999999999998 111.083 177.427 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -72.02 -52.7 15.71 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.53 -0.544 . . . . 3.0099999999999998 109.53 -177.211 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . 0.484 ' HZ3' ' CD ' ' B' ' 110' ' ' GLU . 6.6 tmtt? -54.0 -29.62 44.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.193 0.997 . . . . 5.8200000000000003 111.899 174.465 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.01 -32.79 71.14 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 119.697 -1.877 . . . . 1.6100000000000001 113.687 171.489 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 48.8 t -55.01 -43.5 69.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 120.613 1.551 . . . . 2.1299999999999999 109.673 174.195 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 48.2 mt -51.24 -55.49 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.197 0.599 . . . . 2.3799999999999999 110.32 171.924 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.53 -40.13 88.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 123.908 0.883 . . . . 1.8799999999999999 113.084 -177.11 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.3 -31.12 70.34 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.077 -1.014 . . . . 2.5299999999999998 111.541 176.752 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 41.5 t -73.56 -42.68 55.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.928 1.691 . . . . 1.8999999999999999 111.241 172.544 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . 0.421 ' CD ' ' HZ3' ' B' ' 124' ' ' LYS . 14.5 tm-20 -57.07 -50.48 72.64 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.606 1.162 . . . . 3.5499999999999998 111.66 173.939 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -65.9 -10.77 41.61 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 114.162 1.171 . . . . 2.5099999999999998 114.162 -173.838 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -87.82 -63.91 1.23 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.386 1.474 . . . . 3.2599999999999998 112.146 164.418 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -61.23 -29.94 70.14 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.693 0.997 . . . . 2.9100000000000001 113.693 -165.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . 0.421 ' HZ3' ' CD ' ' B' ' 120' ' ' GLU . 8.4 ptmt -50.67 -26.9 6.0 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 119.43 1.013 . . . . 2.6299999999999999 113.508 173.697 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -93.35 5.57 51.11 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.23 1.812 . . . . 3.3100000000000001 114.726 -179.517 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 13.2 m -138.76 150.89 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.97 1.259 . . . . 3.04 110.971 173.977 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 16.2 m -78.66 42.81 0.46 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 115.488 1.662 . . . . 4.0499999999999998 115.488 -177.31 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 5.3 ttpt 83.84 -52.01 0.14 Allowed 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.561 1.319 . . . . 5.5499999999999998 114.561 142.883 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -95.63 145.23 25.41 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.521 1.528 . . . . 6.54 110.916 177.615 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 5.8 m -55.55 -16.71 4.24 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 116.063 1.875 . . . . 9.1099999999999994 116.063 -177.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 91.5 mt -63.53 -33.98 76.78 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 118.947 0.794 . . . . 9.4000000000000004 111.792 169.494 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 22.3 t 57.58 86.79 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 127.264 2.225 . . . . 6.5999999999999996 111.933 -178.195 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -60.81 -28.99 69.2 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.837 0.855 . . . . 9.7699999999999996 113.135 171.88 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -171.46 151.89 3.13 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.154 2.581 . . . . 7.4699999999999998 109.657 -178.482 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.21 152.44 29.35 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.412 2.285 . . . . 7.1399999999999997 110.692 -178.632 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 14.4 pt -63.05 152.67 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 114.14 1.163 . . . . 4.5300000000000002 114.14 -178.369 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 73.5 m -74.63 139.7 43.79 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.378 -0.826 . . . . 3.0299999999999998 110.934 163.831 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -51.79 -24.78 6.44 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.59 1.556 . . . . 4.0 114.736 -174.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 62.1 p -58.19 -23.65 56.32 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.735 1.383 . . . . 2.77 114.735 171.649 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 61.1 m -74.35 -46.15 42.54 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.256 0.935 . . . . 1.6899999999999999 113.002 -179.407 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -53.23 -52.47 58.83 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.784 1.175 . . . . 3.5 112.263 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -57.37 -10.65 1.45 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.714 1.005 . . . . 3.29 113.714 177.535 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -117.83 -27.6 6.17 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 120.182 1.355 . . . . 4.3099999999999996 114.387 177.584 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.7 tmm? -53.01 -35.83 59.83 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 119.704 1.138 . . . . 1.97 111.375 161.732 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.29 -26.59 68.49 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.053 1.131 . . . . 2.3399999999999999 114.053 170.307 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -92.14 -24.17 19.18 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 121.208 -0.932 . . . . 3.0 112.951 179.494 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.72 -67.37 0.83 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.17 0.895 . . . . 2.3500000000000001 111.573 172.261 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -69.06 -29.17 67.24 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.378 1.251 . . . . 3.5299999999999998 114.378 -175.551 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.59 19.36 19.32 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.064 1.346 . . . . 2.6499999999999999 113.762 -179.693 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -45.07 -38.31 4.89 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 117.647 2.462 . . . . 1.6499999999999999 117.647 -165.467 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . 0.457 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 0.0 OUTLIER -61.92 -28.57 69.62 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.118 2.167 . . . . 2.6499999999999999 113.342 -178.407 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 40.6 tpp -77.94 -4.75 48.46 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.119 1.768 . . . . 2.8999999999999999 113.776 -174.11 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.79 177.21 7.07 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.136 1.375 . . . . 3.2599999999999998 112.95 -175.385 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 6.4 m -176.76 110.47 0.08 Allowed 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.567 2.347 . . . . 4.1900000000000004 107.956 -176.668 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . 0.453 ' CB ' ' H ' ' B' ' 157' ' ' GLY . 21.1 t0 48.39 -175.57 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.299 0 CA-C-O 123.844 1.783 . . . . 4.96 109.992 -147.597 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 65.4 p -56.9 -14.88 3.9 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 120.097 -1.627 . . . . 4.6799999999999997 112.836 142.144 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . 0.453 ' H ' ' CB ' ' B' ' 155' ' ' ASP . . . -51.92 -38.43 46.35 Favored Glycine 0 N--CA 1.476 1.324 0 C-N-CA 126.906 2.193 . . . . 2.3599999999999999 113.547 -177.179 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -62.8 -58.85 5.98 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.89 1.276 . . . . 3.23 111.547 169.283 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -50.85 -43.79 59.37 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.698 1.599 . . . . 6.0700000000000003 114.561 174.597 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 34.1 mtmt -60.22 -19.01 52.56 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.681 1.992 . . . . 5.6200000000000001 115.281 178.745 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -66.33 -41.42 89.64 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.392 1.077 . . . . 2.0600000000000001 112.041 167.777 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -61.25 -40.56 94.5 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.106 0.962 . . . . 1.79 111.159 176.503 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -56.88 -39.71 74.87 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.73 1.212 . . . . 2.21 113.054 173.775 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -59.53 -34.25 72.4 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.332 -0.855 . . . . 4.9199999999999999 111.962 174.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 8.8 mt -69.8 -42.99 73.01 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 118.656 -0.688 . . . . 2.04 112.03 174.07 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 35.3 mm -50.04 -53.86 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.889 0.768 . . . . 2.21 110.391 177.47 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -71.1 -38.22 72.38 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.059 1.344 . . . . 2.9500000000000002 112.961 -176.313 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -54.02 -33.86 58.37 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.559 0.695 . . . . 3.4199999999999999 111.862 167.462 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 9.2 tp -93.59 -14.21 26.78 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 120.63 -1.294 . . . . 3.2000000000000002 113.964 -179.439 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -65.02 -16.59 63.62 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.573 0.749 . . . . 3.1000000000000001 112.978 171.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.23 -6.92 58.66 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.464 1.283 . . . . 3.0899999999999999 114.464 165.086 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -142.97 27.56 1.62 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.182 1.393 . . . . 2.6699999999999999 114.294 -164.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -143.56 93.81 2.52 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 120.049 -1.657 . . . . 6.5599999999999996 111.621 -170.406 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -68.68 31.23 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 128.258 2.623 . . . . 5.7599999999999998 114.009 179.041 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.63 -11.93 6.59 Favored Glycine 0 CA--C 1.534 1.223 0 O-C-N 119.802 -1.811 . . . . 2.5800000000000001 114.999 178.905 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 35.2 mmt-85 -83.75 144.81 29.09 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.539 1.67 . . . . 7.4699999999999998 109.745 163.247 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 7.4 mm -93.79 135.29 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 106.97 -1.493 . . . . 3.75 106.97 163.653 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 18.5 m -98.18 159.07 15.17 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.256 1.422 . . . . 3.0499999999999998 110.941 166.685 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -62.97 -54.38 39.28 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.33 -1.482 . . . . 3.0600000000000001 112.311 -174.651 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -68.63 -14.02 62.74 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.64 1.976 . . . . 2.9700000000000002 113.301 -176.215 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -56.69 -54.06 50.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.159 1.784 . . . . 3.2200000000000002 111.168 174.137 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -57.19 -44.7 83.85 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 120.624 -1.297 . . . . 3.6699999999999999 112.311 173.068 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -62.66 -43.25 99.28 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 121.985 -0.447 . . . . 0.65000000000000002 111.845 -178.028 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.9 t -75.3 -26.07 58.42 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 117.409 -1.281 . . . . 2.6899999999999999 112.496 175.927 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 54.0 mt -68.8 -41.12 79.14 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.677 1.58 . . . . 1.79 112.395 171.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 21.9 mm -51.58 -36.72 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 CA-C-N 120.509 1.504 . . . . 1.71 112.417 177.612 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -57.28 -32.3 63.56 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 118.505 0.593 . . . . 0.65000000000000002 113.688 173.77 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -73.13 -19.24 79.56 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-N 118.793 1.296 . . . . 0.63 114.903 -179.785 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -98.21 -35.62 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 CA-C-N 119.019 1.409 . . . . 1.76 111.147 167.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 68.6 m -75.1 -41.88 57.74 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.913 1.685 . . . . 2.7799999999999998 113.177 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -54.48 -42.58 76.01 Favored Glycine 0 CA--C 1.537 1.461 0 CA-C-O 118.086 -1.397 . . . . 2.3100000000000001 115.74 -174.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.09 -44.29 7.53 Favored 'Trans proline' 0 C--N 1.354 0.832 0 CA-C-N 121.0 2.4 . . . . 1.29 112.444 174.374 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 35.0 pt -90.38 -24.7 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 115.607 1.706 . . . . 2.3900000000000001 115.607 -168.271 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -56.35 -36.16 68.46 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.767 1.227 . . . . 1.9399999999999999 113.834 -171.072 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.0 ptpp? -57.62 -31.67 66.47 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.735 1.214 . . . . 6.6799999999999997 113.107 173.175 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.66 -30.11 25.12 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.454 1.502 . . . . 3.1499999999999999 110.947 179.115 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 65.0 mt -52.36 -52.81 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.183 0.993 . . . . 2.02 110.508 172.207 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -46.79 -50.26 18.57 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 118.761 0.709 . . . . 4.0 112.786 173.132 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -68.32 -12.99 61.94 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.813 1.245 . . . . 4.5499999999999998 113.657 -177.018 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -98.57 -30.34 12.55 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.461 1.504 . . . . 3.1400000000000001 113.58 170.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -68.18 -17.44 64.33 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 120.552 1.524 . . . . 2.3199999999999998 111.555 165.901 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -93.87 -54.87 3.44 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.18 -0.95 . . . . 2.3900000000000001 111.787 174.084 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 55.82 6.22 0.2 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 129.115 2.966 . . . . 7.0800000000000001 116.043 176.583 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 74.5 m -162.49 44.04 0.13 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 127.122 2.169 . . . . 6.0999999999999996 109.608 -178.561 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 20.1 t -86.78 5.44 36.44 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.162 1.171 . . . . 8.2899999999999991 114.162 176.459 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.25 1.128 0 C-N-CA 130.824 3.649 . . . . 10.050000000000001 109.938 -171.259 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.9 t . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 104.928 -2.249 . . . . 9.5399999999999991 104.928 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.458 ' CG ' ' H ' ' A' ' 4' ' ' CYS . 37.8 t70 -63.41 -132.18 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.415 0 N-CA-C 109.217 -0.66 . . . . 6.9900000000000002 109.217 117.324 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.458 ' H ' ' CG ' ' A' ' 3' ' ' ASP . 35.3 t -80.81 -93.84 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 O-C-N 119.736 -1.852 . . . . 4.5199999999999996 110.288 170.25 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 95.87 124.1 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.766 1 C-N-CA 131.79 4.036 . . . . 3.3700000000000001 108.586 -163.404 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 31.5 p -76.23 154.68 35.06 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.566 0.747 . . . . 1.71 110.15 174.194 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -62.33 -31.76 72.42 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-O 118.818 -0.61 . . . . 2.46 111.897 178.14 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.68 -42.52 88.69 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 120.065 1.302 . . . . 1.9099999999999999 110.224 176.508 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -62.91 1.25 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.822 1.249 . . . . 2.8399999999999999 110.443 179.295 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -52.39 -33.87 45.44 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 114.404 1.261 . . . . 6.8099999999999996 114.404 172.971 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.24 -49.01 66.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 119.938 1.245 . . . . 1.5600000000000001 111.808 173.008 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 52.8 t -57.22 -35.08 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 120.017 1.28 . . . . 1.96 110.439 173.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.6 mt -59.65 -47.64 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 O-C-N 121.483 -0.761 . . . . 2.1600000000000001 112.305 168.209 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.3 t -64.61 -34.65 71.17 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 CA-C-N 120.279 1.399 . . . . 1.95 113.414 175.006 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -63.23 -41.81 99.15 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 120.636 -1.29 . . . . 2.0 111.04 171.643 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.2 t -62.56 -40.19 87.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 123.774 0.83 . . . . 1.76 110.881 173.689 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -66.04 -36.64 83.8 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.644 1.111 . . . . 3.1299999999999999 113.129 173.609 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -62.11 -23.07 66.32 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.756 1.162 . . . . 2.0600000000000001 113.556 -177.883 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -81.91 -50.19 9.46 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.037 1.335 . . . . 3.1299999999999999 112.797 171.213 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -75.74 -16.44 60.14 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.667 1.358 . . . . 3.71 114.667 -174.019 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -66.87 -25.66 66.51 Favored 'General case' 0 CA--C 1.553 1.059 0 O-C-N 120.218 -1.552 . . . . 3.6200000000000001 112.116 161.075 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -97.89 -36.25 10.23 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 115.277 1.584 . . . . 4.29 115.277 -178.018 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.1 p -130.29 159.57 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 CA-C-N 120.509 1.504 . . . . 4.9500000000000002 112.238 172.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.9 t 87.78 -163.43 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 127.872 2.469 . . . . 6.7999999999999998 112.713 174.145 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt 51.84 -71.09 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 130.462 3.505 . . . . 7.4500000000000002 114.621 168.758 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -61.68 -17.56 56.02 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.614 2.366 . . . . 11.960000000000001 112.729 169.887 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.6 m -159.66 151.26 20.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.181 1.793 . . . . 7.7800000000000002 111.409 171.821 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.8 mt -72.59 -69.33 0.41 Allowed 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.35 -0.611 . . . . 8.9199999999999999 109.35 159.035 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.7 t -143.34 93.13 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.697 1.199 . . . . 5.7800000000000002 109.405 -177.836 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -139.47 39.82 2.05 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 127.255 2.222 . . . . 10.130000000000001 112.077 169.773 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 55.49 36.31 26.88 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.209 1.404 . . . . 9.7899999999999991 113.711 -179.295 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.66 -24.0 65.24 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 120.887 -1.133 . . . . 10.56 112.034 -175.339 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.0 tt -127.7 164.08 29.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 126.503 1.921 . . . . 4.5300000000000002 109.296 167.415 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.2 m -143.04 168.6 19.34 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.507 -1.371 . . . . 3.5299999999999998 109.245 159.08 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -59.26 -34.95 72.86 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.274 -1.516 . . . . 3.4900000000000002 112.048 -173.237 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 p -57.21 -21.28 32.42 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.358 1.863 . . . . 2.29 114.57 171.823 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 m -74.65 -39.8 61.84 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.19 -0.944 . . . . 1.8799999999999999 112.395 171.275 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -58.27 -49.72 76.12 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.742 1.155 . . . . 3.5 113.066 -175.36 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -53.18 -23.02 7.43 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.001 0.92 . . . . 3.3599999999999999 112.874 172.918 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -99.68 -45.82 5.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.931 1.693 . . . . 3.54 113.244 -170.271 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 16.7 ptm -52.53 -37.16 56.99 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.979 0.809 . . . . 4.2400000000000002 110.444 161.154 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.8 mt -58.72 -64.17 1.03 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.954 0.902 . . . . 2.0600000000000001 111.865 167.306 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -70.0 -12.17 61.42 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.585 1.538 . . . . 3.0499999999999998 115.12 -173.458 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.1 -49.21 6.32 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.506 1.048 . . . . 2.5800000000000001 112.419 170.616 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -80.97 -36.48 30.78 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 120.06 1.3 . . . . 2.7200000000000002 112.529 -175.091 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.8 mt -103.81 27.32 7.65 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.957 1.303 . . . . 3.21 112.666 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -58.5 -16.77 16.76 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 115.766 1.765 . . . . 1.54 115.766 -169.407 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.12 -36.15 15.0 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 119.517 1.053 . . . . 2.21 113.089 174.858 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.8 ttm -71.31 -22.27 61.95 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.909 1.284 . . . . 3.3799999999999999 112.292 176.316 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.9 mp -61.9 90.35 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 123.528 1.632 . . . . 3.48 111.046 171.114 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.6 m -74.39 75.77 1.9 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 113.535 -1.666 . . . . 4.6699999999999999 109.701 173.818 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.9 t70 71.77 169.89 0.32 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 128.312 2.645 . . . . 4.04 112.999 -176.064 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m -30.77 -45.86 0.07 Allowed 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 127.376 2.27 . . . . 3.1000000000000001 111.989 150.062 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.56 -50.17 54.43 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.433 1.492 . . . . 1.8700000000000001 113.654 177.223 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -62.65 -41.67 99.18 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.794 1.297 . . . . 3.98 112.001 172.208 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 44.2 ttt-85 -57.01 -40.49 76.74 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.735 0.698 . . . . 6.5700000000000003 112.521 173.729 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.29 -19.06 64.25 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 120.443 1.474 . . . . 4.2800000000000002 113.609 176.164 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.09 -17.61 54.84 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.127 1.158 . . . . 1.96 114.127 170.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.29 -53.11 9.31 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.481 1.112 . . . . 1.9299999999999999 110.525 160.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -57.01 -35.77 69.63 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.086 0.954 . . . . 2.2999999999999998 112.923 -176.451 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.9 ptmm? -57.59 -23.83 52.98 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 120.377 -1.452 . . . . 4.8799999999999999 114.763 171.654 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.2 mt -82.84 -37.05 24.92 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.465 -0.772 . . . . 2.7799999999999998 112.308 174.676 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.2 mm -52.53 -51.56 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.766 1.226 . . . . 1.95 110.823 -178.326 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -55.14 -48.93 73.0 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 122.176 0.988 . . . . 3.8799999999999999 112.359 177.426 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 -66.01 -21.19 66.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.744 1.218 . . . . 3.8999999999999999 113.316 -178.691 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.47 -34.9 14.63 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.849 0.75 . . . . 3.25 112.533 178.428 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -61.88 -25.36 67.5 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.3 -0.875 . . . . 3.23 112.511 164.695 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.67 -14.01 62.3 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 114.484 1.29 . . . . 2.5499999999999998 114.484 167.251 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -123.91 -19.47 5.68 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 116.119 1.896 . . . . 2.6200000000000001 116.119 -173.411 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.93 127.02 22.49 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.08 1.763 . . . . 4.3499999999999996 112.435 -171.488 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -85.91 -7.66 58.54 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.804 1.409 . . . . 4.6600000000000001 114.804 -169.353 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 130.8 -13.65 5.55 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 124.762 1.172 . . . . 2.77 113.628 -163.116 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.5 mmt-85 -76.61 147.03 37.86 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.244 1.522 . . . . 5.6399999999999997 109.467 153.273 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 37.4 mm -133.22 146.2 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 127.458 2.303 . . . . 3.4700000000000002 107.317 -178.307 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 10.6 m -109.44 151.52 26.58 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 118.977 0.808 . . . . 2.3900000000000001 110.289 173.809 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -55.72 -40.46 72.46 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-O 122.658 1.218 . . . . 3.4700000000000002 111.137 172.918 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.8 -32.2 65.45 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 129.772 3.229 . . . . 3.0499999999999998 112.782 178.688 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -54.76 9.76 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.395 1.478 . . . . 3.25 110.0 -170.4 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -52.77 -43.46 65.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.092 0.557 . . . . 2.98 112.028 174.169 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.7 t-105 -63.26 -48.14 79.44 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.709 -0.62 . . . . 0.87 111.375 177.532 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 88.5 m -58.37 -37.45 75.24 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.501 1.921 . . . . 3.2400000000000002 111.694 176.453 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 75.2 mt -62.14 -50.5 71.64 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 118.25 -0.881 . . . . 2.27 111.955 174.114 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.0 mm -52.62 -41.84 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 CA-C-N 120.215 1.37 . . . . 2.1000000000000001 113.441 -173.591 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.28 -19.46 59.66 Favored Glycine 0 N--CA 1.475 1.282 0 C-N-CA 123.637 0.637 . . . . 0.97999999999999998 113.499 177.993 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.0 -11.63 85.4 Favored Glycine 0 CA--C 1.534 1.252 0 CA-C-O 117.85 -1.528 . . . . 1.1399999999999999 114.993 173.979 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.3 -45.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 119.796 1.798 . . . . 2.73 111.036 175.939 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 40.6 m -76.28 87.19 3.09 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 105.997 -1.853 . . . . 1.9299999999999999 105.997 172.688 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -160.4 -77.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.916 0 CA-C-O 118.038 -1.423 . . . . 1.1599999999999999 112.549 -167.762 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -61.57 -33.37 87.27 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 122.856 2.371 . . . . 1.1499999999999999 112.311 175.263 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.3 pt -75.85 -16.9 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 114.047 1.128 . . . . 2.1800000000000002 114.047 173.885 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.12 -65.05 0.63 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.997 1.271 . . . . 3.0099999999999998 112.958 -169.47 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp -55.2 -40.75 71.13 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.349 -0.845 . . . . 4.8099999999999996 113.185 178.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.69 -38.27 74.89 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.648 0.779 . . . . 2.6400000000000001 111.216 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 51.2 mt -54.93 -62.43 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 118.973 0.806 . . . . 2.3700000000000001 111.111 171.117 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.456 ' CE1' ' HZ3' ' B' ' 128' ' ' LYS . 76.0 t60 -57.11 -27.98 62.26 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.299 0.852 . . . . 1.73 113.299 -179.764 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -81.36 -25.89 35.98 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.048 -1.033 . . . . 3.4399999999999999 112.261 177.605 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.421 ' C ' ' H ' ' A' ' 99' ' ' GLN . 19.8 mm100 -74.96 -33.49 61.92 Favored 'General case' 0 C--O 1.227 -0.086 0 N-CA-C 113.776 1.028 . . . . 2.2599999999999998 113.776 178.783 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -70.47 6.69 1.29 Allowed 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 123.305 1.526 . . . . 2.3399999999999999 112.031 172.151 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.421 ' H ' ' C ' ' A' ' 97' ' ' GLN . 2.1 mm-40 -115.52 -56.51 2.34 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 126.416 1.887 . . . . 2.73 110.306 170.599 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -62.06 -13.45 26.38 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.376 1.25 . . . . 5.8899999999999997 114.376 178.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.4 t -121.26 25.12 9.69 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.115 1.366 . . . . 8.5500000000000007 112.177 169.153 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.9 t -75.59 1.52 14.17 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.874 1.435 . . . . 11.050000000000001 114.874 -179.403 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 30.8 m . . . . . 0 C--O 1.254 1.312 0 C-N-CA 130.036 3.334 . . . . 13.119999999999999 109.913 178.491 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 107.372 -1.344 . . . . 10.220000000000001 107.372 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . 0.513 ' CG ' ' H ' ' B' ' 107' ' ' CYS . 28.2 t70 -31.46 176.83 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.579 0 N-CA-C 115.147 1.536 . . . . 6.4900000000000002 115.147 111.824 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . 0.513 ' H ' ' CG ' ' B' ' 106' ' ' ASP . 44.4 t -51.86 -57.19 10.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.52 2.728 . . . . 4.3099999999999996 113.128 174.865 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 65.37 -179.69 0.19 Allowed 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.561 1.945 . . . . 3.4900000000000002 114.238 -175.201 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.4 p -85.27 159.79 19.99 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.575 -0.703 . . . . 1.9099999999999999 109.311 160.42 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -59.61 -45.06 93.05 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.599 -0.715 . . . . 2.79 111.657 174.505 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.59 -43.04 75.63 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.581 1.082 . . . . 2.0899999999999999 111.211 -174.46 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -56.75 7.6 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.993 0.517 . . . . 2.77 110.239 -177.381 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -50.2 -37.61 36.05 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.755 1.222 . . . . 5.9000000000000004 112.268 172.103 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.35 -44.67 74.76 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 120.37 -1.456 . . . . 1.54 113.51 172.588 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 79.6 t -61.72 -34.53 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 CA-C-N 121.009 1.731 . . . . 1.99 111.017 172.399 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 44.4 mt -56.03 -52.48 49.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.681 1.128 . . . . 1.76 110.913 165.154 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 9.3 t -58.03 -41.37 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 119.407 1.003 . . . . 1.6200000000000001 112.657 178.569 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.37 -39.36 94.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.02 0.928 . . . . 2.04 112.298 175.007 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 99.2 t -70.93 -44.86 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-O 118.455 -0.783 . . . . 1.75 110.895 177.873 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -61.24 -39.2 89.44 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.552 1.069 . . . . 4.2000000000000002 112.042 178.625 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . 0.525 HD22 ' HG3' ' B' ' 148' ' ' GLU . 6.9 t30 -67.51 -14.85 63.3 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.523 1.305 . . . . 2.3500000000000001 114.523 -177.469 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -102.11 -40.18 6.94 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.55 1.54 . . . . 3.6499999999999999 113.155 174.881 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -68.69 -26.08 65.11 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 120.862 -1.149 . . . . 3.54 112.827 175.874 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 42.2 pttt -59.23 -34.78 72.61 Favored 'General case' 0 CA--C 1.551 0.994 0 O-C-N 119.444 -2.035 . . . . 3.5800000000000001 112.248 164.298 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -81.86 -33.46 30.6 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 116.993 -1.479 . . . . 3.8300000000000001 114.876 178.95 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 9.6 p -138.52 138.89 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 CA-C-N 120.573 1.533 . . . . 4.8300000000000001 113.162 176.576 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.7 t 103.51 -168.03 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 129.904 3.282 . . . . 6.9400000000000004 111.919 174.634 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . 0.456 ' HZ3' ' CE1' ' A' ' 95' ' ' HIS . 35.4 ttpt 54.83 -69.67 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 130.227 3.411 . . . . 6.8700000000000001 114.756 165.492 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -59.79 -21.69 61.15 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.329 1.852 . . . . 11.6 112.353 173.197 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 40.9 m -166.16 135.11 3.09 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 127.529 2.331 . . . . 8.3699999999999992 109.121 164.16 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -68.31 -64.5 0.85 Allowed 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 110.039 -0.356 . . . . 8.8300000000000001 110.039 172.245 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 50.1 t -140.88 89.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 C-N-CA 124.407 1.083 . . . . 6.0300000000000002 109.463 176.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -129.88 17.98 5.65 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.195 1.798 . . . . 10.470000000000001 111.547 157.548 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 68.43 61.53 0.37 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.437 1.895 . . . . 9.5899999999999999 110.422 -167.36 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.29 -15.56 63.33 Favored 'General case' 0 CA--C 1.552 1.055 0 O-C-N 120.851 -1.156 . . . . 10.609999999999999 112.482 179.2 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 5.3 tt -143.92 171.77 7.3 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 128.417 2.687 . . . . 4.29 109.334 175.022 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 74.2 m -142.55 163.53 32.59 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.049 1.74 . . . . 3.5800000000000001 108.722 155.992 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 38.4 mmtm -56.15 -32.6 64.44 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.523 -1.36 . . . . 3.9100000000000001 112.699 -174.219 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 9.1 p -56.7 -23.0 39.14 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.032 1.733 . . . . 2.2200000000000002 113.854 174.497 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 6.0 m -76.56 -26.61 55.29 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.882 -1.137 . . . . 1.5800000000000001 113.159 173.518 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -65.17 -53.51 43.82 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.73 1.605 . . . . 3.1699999999999999 111.656 -179.212 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 6.3 ptt180 -52.14 -25.26 8.51 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.581 1.152 . . . . 3.0800000000000001 112.622 176.128 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.27 -45.08 7.31 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.269 1.827 . . . . 3.48 112.077 -173.115 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.3 tmm? -49.95 -44.08 50.41 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.13 0.972 . . . . 2.3300000000000001 110.232 162.283 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.9 mt -55.01 -63.62 1.1 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.666 1.587 . . . . 1.9099999999999999 111.967 166.945 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -68.56 -15.16 63.44 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 115.338 1.607 . . . . 2.96 115.338 -174.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.92 -48.12 7.43 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.462 1.028 . . . . 2.3599999999999999 112.331 172.362 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.525 ' HG3' HD22 ' B' ' 121' ' ' ASN . 50.6 mm-40 -87.36 -33.88 19.0 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.68 1.127 . . . . 2.79 113.043 -172.861 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.5 mt -101.62 27.38 6.42 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.899 1.28 . . . . 3.3300000000000001 112.317 176.22 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -60.76 -12.59 11.1 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 116.166 1.913 . . . . 1.4399999999999999 116.166 -169.662 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -92.1 -59.77 2.02 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.606 1.162 . . . . 1.95 111.587 -175.281 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 27.7 ttp -61.44 -13.58 21.56 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 114.917 1.451 . . . . 2.7999999999999998 114.917 169.315 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.9 tp -58.39 91.44 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.726 1.61 . . . . 3.2799999999999998 110.185 176.306 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 63.7 m -82.92 70.22 9.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.489 1.116 . . . . 4.8300000000000001 110.879 -167.571 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 25.9 t70 74.62 167.22 0.29 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 128.316 2.646 . . . . 4.1500000000000004 112.695 -175.159 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -27.6 -47.34 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.4 0 C-N-CA 127.792 2.437 . . . . 3.3599999999999999 112.697 151.549 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.06 -52.42 52.94 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-N 120.232 1.378 . . . . 2.1200000000000001 113.756 -178.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.19 -38.8 80.74 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.913 0.885 . . . . 3.6099999999999999 111.325 173.818 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.2 ttt-85 -62.06 -45.87 91.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.719 0.808 . . . . 5.5199999999999996 113.099 172.444 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -21.72 66.05 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 120.024 -1.672 . . . . 4.5 113.182 -177.709 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -61.3 -28.79 69.45 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 117.325 -1.322 . . . . 2.0 113.476 167.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.27 73.18 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.199 1.0 . . . . 2.3100000000000001 111.484 167.089 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -62.88 -32.78 74.1 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.656 0.783 . . . . 2.1200000000000001 111.944 -175.057 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt -47.17 -42.25 19.34 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 122.402 1.096 . . . . 3.2799999999999998 113.663 166.845 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 5.5 mt -78.67 -42.2 29.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 113.973 -1.467 . . . . 2.0899999999999999 110.551 -174.41 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.9 mm -46.48 -56.85 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.302 1.441 . . . . 1.8999999999999999 111.67 175.08 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -58.76 -40.73 84.74 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.592 1.187 . . . . 3.71 112.47 -177.145 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -77.24 -18.46 57.62 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.131 1.372 . . . . 4.2999999999999998 112.455 -175.776 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.57 -36.24 15.43 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.781 0.833 . . . . 3.4399999999999999 112.329 173.288 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -58.88 -35.99 73.91 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.3 0.955 . . . . 3.77 111.946 166.761 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -60.1 -15.97 27.95 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.846 1.424 . . . . 2.7000000000000002 114.846 169.906 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -120.5 -14.53 8.66 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 115.573 1.694 . . . . 2.7400000000000002 115.573 -176.254 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -138.89 108.13 6.09 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.777 1.626 . . . . 4.6299999999999999 112.407 -166.73 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . 0.431 ' C ' ' H ' ' B' ' 176' ' ' ARG . 27.1 t0 -76.77 56.15 1.14 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 128.357 2.663 . . . . 4.29 112.484 -169.501 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 67.87 -14.14 0.61 Allowed Glycine 0 N--CA 1.479 1.563 0 O-C-N 119.854 -1.779 . . . . 2.5600000000000001 114.145 -171.388 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . 0.431 ' H ' ' C ' ' B' ' 174' ' ' ASP . 8.9 mmt-85 -73.1 141.89 47.54 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.83 1.652 . . . . 6.0099999999999998 107.726 164.797 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 40.6 mm -126.32 141.81 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.078 1.351 . . . . 3.2999999999999998 108.812 -168.879 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 70.8 m -99.74 155.13 17.79 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 117.891 0.314 . . . . 2.6000000000000001 111.68 173.839 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -63.32 -50.47 69.9 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.943 -1.098 . . . . 3.8199999999999998 110.509 172.585 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -70.19 -6.45 34.56 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.668 1.187 . . . . 4.46 113.203 -178.066 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -59.3 -57.78 11.53 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.196 0.998 . . . . 3.1499999999999999 109.937 171.551 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -52.11 -48.79 64.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.545 0.738 . . . . 3.3300000000000001 112.035 176.378 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 21.0 t-105 -59.0 -49.82 76.45 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 119.244 -0.407 . . . . 0.88 111.729 178.979 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.5 m -55.32 -43.61 75.06 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.75 1.62 . . . . 2.71 111.865 174.611 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 48.9 mt -69.36 -38.37 78.06 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 118.177 -0.915 . . . . 2.1400000000000001 113.271 179.745 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 30.2 mm -56.79 -41.34 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 120.542 1.519 . . . . 1.8899999999999999 111.662 178.26 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.74 -18.8 57.43 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-O 119.365 -0.686 . . . . 0.72999999999999998 114.174 -179.258 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.8 -11.7 83.6 Favored Glycine 0 CA--C 1.535 1.334 0 CA-C-N 118.866 1.333 . . . . 0.69999999999999996 114.076 175.133 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.7 mp -108.54 -45.04 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.657 1.183 . . . . 2.0699999999999998 110.325 171.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 23.6 m -80.57 77.51 7.37 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 125.17 1.388 . . . . 1.97 107.982 176.292 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -158.44 -74.39 0.02 OUTLIER Glycine 0 CA--C 1.53 1.03 0 C-N-CA 125.502 1.525 . . . . 1.1599999999999999 112.019 -172.084 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -63.11 -34.81 68.03 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.004 2.469 . . . . 1.0800000000000001 113.418 177.851 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.9 pt -83.67 -6.92 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 114.035 1.124 . . . . 1.8999999999999999 114.035 174.722 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -50.07 -55.26 15.58 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.093 1.357 . . . . 2.8500000000000001 113.919 -172.758 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 mtpp -66.51 -39.63 88.77 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-O 116.987 -1.483 . . . . 6.3499999999999996 112.86 174.336 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.5 tt -50.29 -41.81 51.39 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 120.783 1.629 . . . . 2.7999999999999998 111.675 177.896 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 85.1 mt -52.15 -54.99 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.351 1.06 . . . . 2.23 112.432 169.028 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 57.8 t60 -73.33 -20.15 60.86 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.454 0.909 . . . . 2.5299999999999998 113.454 -178.067 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.07 -44.29 69.41 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.923 0.889 . . . . 3.7400000000000002 109.487 168.09 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -60.64 -44.07 96.81 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.755 1.222 . . . . 2.46 113.387 -176.277 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -70.69 1.46 5.3 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 122.529 1.157 . . . . 2.5600000000000001 112.825 -179.235 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -116.21 -53.5 2.54 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 120.725 -1.234 . . . . 3.1499999999999999 109.755 175.38 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -14.74 54.62 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 114.598 -1.183 . . . . 4.2400000000000002 114.167 178.604 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 33.6 t -121.7 28.64 7.55 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.383 1.873 . . . . 8.4199999999999999 112.853 168.759 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 32.8 t -72.67 2.29 6.8 Favored 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 115.817 1.784 . . . . 11.449999999999999 115.817 -178.021 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 35.5 m . . . . . 0 C--O 1.253 1.278 0 C-N-CA 128.858 2.863 . . . . 13.77 111.063 179.277 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.7 m . . . . . 0 CA--C 1.506 -0.723 0 CA-C-O 119.6 -0.238 . . . . 11.9 110.515 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -95.86 -106.1 0.15 Allowed 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 106.868 -1.53 . . . . 7.9699999999999998 106.868 140.443 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 74.2 m -89.65 -36.06 15.47 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.933 1.693 . . . . 4.3099999999999996 112.081 169.621 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -56.12 133.71 52.29 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.592 0.757 . . . . 3.6000000000000001 109.605 168.938 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.6 p -62.37 151.82 35.79 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.511 1.05 . . . . 1.76 109.521 174.73 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -58.87 -49.61 77.13 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.876 0.735 . . . . 2.4900000000000002 109.169 177.717 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -43.92 -49.47 8.42 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.381 1.873 . . . . 2.3799999999999999 111.499 176.331 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -56.53 4.93 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.875 -0.516 . . . . 3.0299999999999998 111.807 -171.089 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.8 mmtt -59.15 -22.16 60.49 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.856 -1.153 . . . . 7.6900000000000004 113.455 170.163 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.06 -46.35 68.06 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 120.566 -1.334 . . . . 1.5900000000000001 112.181 168.105 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 96.5 t -59.58 -39.85 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 121.081 1.764 . . . . 2.3300000000000001 110.318 170.596 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 mt -55.47 -47.07 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 118.558 -0.734 . . . . 2.5299999999999998 111.344 169.358 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.55 -37.64 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.137 1.375 . . . . 1.95 112.753 175.978 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.43 -37.29 86.73 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.8 1.182 . . . . 1.9099999999999999 111.009 172.67 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 74.2 t -72.04 -40.9 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.833 0.853 . . . . 1.99 110.697 174.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -55.51 -60.1 3.89 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.72 1.146 . . . . 3.04 110.709 172.325 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.47 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -63.85 -30.6 71.67 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.151 0.797 . . . . 2.9100000000000001 113.151 -170.101 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -67.98 -60.64 2.35 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.589 0.755 . . . . 3.23 110.951 169.815 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -60.97 -26.12 67.33 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 118.146 -0.93 . . . . 3.5499999999999998 112.388 -176.158 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.47 ' HE2' ' HA ' ' A' ' 18' ' ' ASN . 10.7 ttmm -43.88 -42.17 5.59 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.805 2.042 . . . . 3.5699999999999998 112.81 167.596 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -82.69 -19.0 38.92 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.014 1.116 . . . . 4.2300000000000004 114.014 178.315 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.7 t -85.08 169.43 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 126.57 1.948 . . . . 3.2799999999999998 110.387 -179.101 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.7 m -85.05 -16.12 41.77 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 116.126 -1.892 . . . . 4.0899999999999999 116.088 175.375 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.1 tttp 110.51 -37.41 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 130.813 3.645 . . . . 5.9900000000000002 112.265 -167.705 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -95.68 142.43 28.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.256 1.422 . . . . 8.2300000000000004 111.507 -178.98 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 72.3 p -81.35 -115.77 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.079 0.952 . . . . 8.0600000000000005 110.872 175.205 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 40.9 mt 60.36 4.73 0.72 Allowed 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 116.321 1.971 . . . . 8.5600000000000005 116.321 163.135 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.0 t 68.4 98.12 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 131.144 3.778 . . . . 5.7999999999999998 111.716 174.212 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.64 2.63 8.25 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.347 1.24 . . . . 8.75 114.347 -177.297 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 28.3 m-20 71.8 -3.24 2.24 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 127.314 2.246 . . . . 9.9100000000000001 114.485 173.059 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -64.21 -19.72 65.54 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.742 1.617 . . . . 11.109999999999999 114.409 -164.214 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.8 tt -128.51 152.71 37.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 126.306 1.842 . . . . 3.5299999999999998 107.578 156.068 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 t -147.84 -175.63 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 122.036 0.922 . . . . 4.7699999999999996 110.84 167.897 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -29.36 24.4 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.651 2.38 . . . . 3.2200000000000002 114.498 -176.188 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.5 p -61.18 -26.27 67.6 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.157 1.383 . . . . 2.7400000000000002 114.349 172.515 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.4 m -91.3 -40.9 11.23 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.316 1.228 . . . . 1.51 114.316 -175.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -54.82 -52.22 63.38 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.217 0.917 . . . . 3.5499999999999998 113.226 -167.06 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -54.37 -30.74 52.84 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.594 1.558 . . . . 3.8599999999999999 113.862 173.529 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -87.76 -50.83 6.21 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.574 1.149 . . . . 3.1099999999999999 109.782 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -47.49 -45.16 26.03 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.627 1.171 . . . . 2.0899999999999999 111.915 167.437 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 mt -54.85 -31.2 59.23 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.497 1.295 . . . . 1.99 114.497 177.383 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.97 -4.11 58.84 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 120.168 1.349 . . . . 2.3300000000000001 113.651 178.133 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.14 -43.68 7.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.004 1.321 . . . . 2.6499999999999999 111.373 168.243 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.458 ' OE2' ' HE3' ' A' ' 21' ' ' LYS . 7.4 mm-40 -97.71 -25.79 14.97 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.487 0.921 . . . . 2.9399999999999999 113.487 -166.231 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.63 34.71 5.08 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.211 1.404 . . . . 2.9700000000000002 110.621 -176.984 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -83.66 -5.95 59.32 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 117.243 2.312 . . . . 1.4199999999999999 117.243 -149.052 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -94.16 -50.27 5.36 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 120.223 1.374 . . . . 2.3100000000000001 109.93 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.9 tpp -46.46 -40.57 12.54 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.58 1.952 . . . . 3.0800000000000001 112.527 164.751 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -84.59 91.29 7.86 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-O 122.834 1.302 . . . . 4.3399999999999999 110.159 177.297 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.9 t -91.04 -90.69 0.15 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.445 -1.252 . . . . 4.1500000000000004 109.926 -176.137 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -72.65 156.51 38.9 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.604 1.161 . . . . 3.8999999999999999 113.682 -178.452 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.7 m -63.87 -30.0 71.13 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.322 1.449 . . . . 3.1699999999999999 111.667 171.494 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.11 -37.7 92.03 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.296 1.427 . . . . 2.52 112.525 168.066 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.34 -36.19 74.08 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.044 0.922 . . . . 3.5699999999999998 111.601 171.241 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 48.1 mtt85 -65.73 -24.26 66.93 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.509 0.929 . . . . 8.3100000000000005 113.509 176.169 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt -59.07 -17.21 23.82 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.868 -1.145 . . . . 5.1900000000000004 113.725 166.121 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.47 -19.2 53.61 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.267 1.58 . . . . 2.04 115.267 169.2 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.17 -55.29 4.84 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.739 1.216 . . . . 1.9199999999999999 110.422 163.565 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -64.08 -28.89 70.09 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 113.996 1.109 . . . . 2.77 113.996 -176.962 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.3 ptmm? -53.02 -33.58 52.39 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 120.074 1.306 . . . . 4.5499999999999998 112.596 167.688 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.5 mt -77.16 -41.43 41.74 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 122.138 -0.351 . . . . 2.0499999999999998 111.459 -179.839 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.3 mm -53.3 -56.12 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 C-N-CA 124.102 0.961 . . . . 2.3799999999999999 110.191 -179.827 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -57.44 -40.43 78.42 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.7 0.8 . . . . 2.3599999999999999 112.906 -179.018 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -64.34 -38.92 92.75 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 112.935 0.717 . . . . 5.04 112.935 175.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.42 -38.92 16.87 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.412 0.685 . . . . 3.3300000000000001 111.962 -173.074 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.5 -22.52 66.18 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.829 0.851 . . . . 2.9199999999999999 112.826 177.137 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.37 -17.31 61.83 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.314 1.227 . . . . 3.7000000000000002 114.314 168.503 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -128.63 -8.93 5.08 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 115.158 1.54 . . . . 3.3500000000000001 115.158 -166.545 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -137.87 107.68 6.28 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.489 1.495 . . . . 5.3200000000000003 111.929 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.0 p-10 -78.6 77.23 5.09 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.482 1.513 . . . . 4.0899999999999999 112.423 -174.714 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.86 10.7 77.52 Favored Glycine 0 N--CA 1.476 1.332 0 C-N-CA 124.117 0.865 . . . . 2.9199999999999999 114.587 175.197 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -64.87 153.64 39.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.557 1.543 . . . . 6.5300000000000002 111.921 179.132 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -140.65 86.57 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 124.819 1.247 . . . . 5.3899999999999997 107.883 175.573 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.7 t -89.66 149.63 22.71 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 125.296 1.438 . . . . 1.9299999999999999 112.085 169.6 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -58.27 -41.51 84.48 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.756 -0.59 . . . . 4.2199999999999998 111.907 169.536 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -79.04 -23.2 44.43 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.084 0.772 . . . . 4.0999999999999996 113.084 -174.269 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -54.83 -59.04 5.26 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.262 -1.014 . . . . 3.4199999999999999 108.262 167.08 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -55.45 -43.78 75.75 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.234 -0.916 . . . . 4.6500000000000004 113.006 179.57 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -65.76 -49.26 69.02 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.304 -0.873 . . . . 1.1299999999999999 112.957 -178.861 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 4.6 t -67.97 -25.65 65.54 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.114 0.87 . . . . 3.02 112.498 178.379 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.51 -49.61 68.32 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.277 -0.868 . . . . 1.8100000000000001 111.362 171.541 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 34.4 mm -54.85 -40.34 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 CA-C-N 120.561 1.528 . . . . 1.7 113.538 -177.553 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.69 -28.24 71.23 Favored Glycine 0 CA--C 1.529 0.939 0 CA-C-O 119.477 -0.624 . . . . 0.65000000000000002 112.751 175.048 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.05 -14.66 74.36 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-O 117.63 -1.65 . . . . 0.83999999999999997 116.535 -174.683 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.4 mp -87.33 -31.36 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-N 119.637 1.719 . . . . 2.1099999999999999 110.795 163.193 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.1 m -71.55 168.92 16.56 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.195 1.798 . . . . 3.3399999999999999 108.712 176.342 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.69 -73.07 0.3 Allowed Glycine 0 CA--C 1.531 1.078 0 CA-C-O 117.821 -1.544 . . . . 2.0299999999999998 113.03 179.763 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -63.72 -43.64 16.05 Favored 'Trans proline' 0 C--N 1.351 0.666 0 CA-C-N 120.539 2.169 . . . . 1.5900000000000001 110.138 174.584 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.1 pt -67.43 -22.55 28.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 113.62 0.97 . . . . 2.8100000000000001 113.62 170.875 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.73 -55.7 31.53 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.976 1.262 . . . . 2.4199999999999999 112.7 -171.79 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -29.3 70.23 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.831 -1.168 . . . . 4.5899999999999999 112.389 176.712 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.44 -41.45 72.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.343 1.457 . . . . 2.52 110.572 -177.195 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 62.9 mt -48.98 -60.17 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 2.1299999999999999 109.585 165.256 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -55.9 -44.66 78.45 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-O 118.38 -0.819 . . . . 1.98 111.7 -177.978 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -55.36 -43.08 74.74 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.137 1.335 . . . . 4.1299999999999999 112.805 173.483 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 24.2 mm100 -79.26 -30.54 43.11 Favored 'General case' 0 CA--C 1.527 0.079 0 N-CA-C 113.95 1.092 . . . . 2.7000000000000002 113.95 -172.553 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -71.89 -32.92 67.91 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.873 1.215 . . . . 2.4300000000000002 111.15 170.317 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.57 -40.91 96.4 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 121.132 -0.98 . . . . 2.8900000000000001 110.674 173.778 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -68.88 -16.09 63.67 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 115.43 -0.805 . . . . 5.3399999999999999 112.279 171.517 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.0 m 47.64 48.95 16.82 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.565 2.346 . . . . 9.0199999999999996 112.1 -170.388 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.0 t -135.63 69.99 1.43 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.899 1.679 . . . . 12.66 108.293 -164.723 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 54.5 p . . . . . 0 C--O 1.254 1.294 0 C-N-CA 126.267 1.827 . . . . 16.719999999999999 112.706 -177.468 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 39.2 m . . . . . 0 CA--C 1.505 -0.754 0 CA-C-O 119.361 -0.352 . . . . 12.19 111.419 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . 0.458 ' CG ' ' H ' ' B' ' 107' ' ' CYS . 17.2 t70 -83.98 -118.67 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.133 0 O-C-N 124.755 1.285 . . . . 7.7800000000000002 107.54 144.558 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . 0.458 ' H ' ' CG ' ' B' ' 106' ' ' ASP . 73.8 m -106.52 -26.2 11.51 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.599 2.36 . . . . 4.6299999999999999 111.354 -176.426 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -56.14 139.11 48.46 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 118.722 -0.656 . . . . 3.7400000000000002 109.505 156.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 26.9 p -61.8 147.65 45.7 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.234 0.925 . . . . 1.72 109.703 171.641 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.44 -48.09 72.11 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.772 -0.633 . . . . 2.8799999999999999 110.348 173.612 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -47.92 -49.91 28.58 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.797 1.639 . . . . 1.8999999999999999 111.976 177.183 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.42 -54.23 8.8 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.422 -0.799 . . . . 2.98 111.091 -171.727 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 28.0 mmtt -56.36 -24.79 46.47 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.883 -1.135 . . . . 8.3100000000000005 113.48 169.064 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.86 -45.27 75.05 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.652 -1.28 . . . . 1.6499999999999999 112.62 168.027 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 93.7 t -57.66 -38.08 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 CA-C-N 120.834 1.652 . . . . 2.1699999999999999 110.468 169.117 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 2.3 mt -59.71 -49.49 83.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 121.481 -0.762 . . . . 2.3999999999999999 112.23 170.031 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.9 t -60.81 -38.8 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.777 1.631 . . . . 1.8899999999999999 112.256 178.472 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.79 -40.47 97.42 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.401 1.0 . . . . 2.0699999999999998 111.048 172.438 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 66.8 t -66.67 -41.35 88.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-O 117.467 -1.254 . . . . 1.95 110.957 177.156 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -67.56 -39.41 84.93 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 121.185 1.811 . . . . 4.4400000000000004 113.982 169.399 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -61.55 -24.39 66.6 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.35 -1.469 . . . . 3.4900000000000002 113.162 177.216 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -81.01 -66.19 0.92 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.736 1.214 . . . . 3.1800000000000002 112.559 164.345 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -60.29 -31.39 70.21 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 118.195 -0.907 . . . . 3.5899999999999999 112.774 -167.862 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -52.24 -31.72 33.63 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.278 1.399 . . . . 3.3700000000000001 113.4 175.034 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -82.66 -16.56 47.8 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.803 -1.185 . . . . 3.4399999999999999 113.605 177.213 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 25.6 t -99.37 157.2 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 127.105 2.162 . . . . 3.6000000000000001 108.976 -176.981 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 65.1 m -101.15 56.89 0.85 Allowed 'General case' 0 N--CA 1.483 1.211 0 O-C-N 120.542 -1.349 . . . . 4.1500000000000004 112.135 166.101 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 34.1 tttp 77.87 -44.24 0.41 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 116.126 1.899 . . . . 5.8899999999999997 116.126 151.341 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -86.66 148.9 25.26 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.349 1.46 . . . . 8.3900000000000006 112.389 179.16 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 68.8 p -85.74 -125.86 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.714 1.206 . . . . 8.4299999999999997 111.408 178.968 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 61.9 mt 64.0 -19.1 0.07 Allowed 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 127.608 2.363 . . . . 9.0 116.284 173.478 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 48.7 t 99.64 125.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.345 1 C-N-CA 132.87 4.468 . . . . 5.5700000000000003 108.176 -174.972 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 21.3 mmmt -123.78 -16.71 6.58 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 115.561 1.689 . . . . 7.4900000000000002 115.561 -169.373 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 55.0 m-20 57.61 19.96 5.86 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.5 1.52 . . . . 10.050000000000001 112.717 -170.02 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -80.55 -29.27 37.12 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 120.59 -1.319 . . . . 10.84 112.394 -168.364 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 10.2 tt -140.03 157.95 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 C-N-CA 126.75 2.02 . . . . 3.4300000000000002 107.316 169.168 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 9.1 t -148.43 -175.19 4.82 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 122.759 1.266 . . . . 4.7199999999999998 111.157 171.229 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.17 -35.69 27.26 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.981 2.912 . . . . 3.1800000000000002 114.349 -177.824 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 26.8 p -58.83 -26.47 64.19 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.089 1.356 . . . . 2.5499999999999998 114.409 173.821 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 19.3 m -91.53 -40.33 11.42 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.394 1.078 . . . . 1.5800000000000001 113.756 -178.848 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -55.45 -51.59 66.41 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.789 1.177 . . . . 3.6499999999999999 113.473 -166.476 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.35 -32.29 48.47 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.202 1.401 . . . . 3.6899999999999999 114.024 171.28 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -84.06 -52.49 6.26 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.021 1.328 . . . . 3.02 109.459 -173.183 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 13.9 tmm? -44.96 -45.08 10.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.138 1.775 . . . . 2.1699999999999999 112.395 165.501 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.2 mt -58.86 -27.91 65.59 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.614 1.166 . . . . 2.0800000000000001 114.112 179.622 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -92.53 3.84 54.73 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.894 1.225 . . . . 2.3999999999999999 113.862 173.191 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -44.44 5.84 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.044 0.938 . . . . 2.5299999999999998 111.614 165.605 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.01 -18.59 19.32 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 113.735 1.013 . . . . 2.8799999999999999 113.735 -170.935 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.85 26.77 8.03 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.311 1.845 . . . . 2.9700000000000002 111.574 -179.365 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -71.93 1.93 6.38 Favored 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 117.832 2.531 . . . . 1.4399999999999999 117.832 -157.94 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -99.64 -57.82 2.06 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.701 1.201 . . . . 2.4100000000000001 110.007 178.025 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.1 ttp -65.36 -27.65 68.73 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.28 1.032 . . . . 3.0 113.058 168.223 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 6.1 mp -98.53 82.04 2.8 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.799 1.182 . . . . 5.0 110.871 157.445 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 6.3 t -104.52 -64.06 1.15 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.892 2.077 . . . . 5.4199999999999999 110.785 178.345 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -72.57 140.93 48.38 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.15 0.98 . . . . 4.25 112.433 176.58 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 77.0 m -71.91 -26.09 62.17 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.572 1.949 . . . . 3.4700000000000002 112.72 175.98 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -61.61 -45.69 95.8 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-N 119.222 0.919 . . . . 2.3799999999999999 111.064 165.927 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.14 -37.41 82.74 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.796 0.839 . . . . 3.5499999999999998 111.739 169.598 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 -64.81 -25.56 67.96 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.779 1.172 . . . . 8.3599999999999994 113.642 177.881 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.7 mtmt -58.63 -17.78 25.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.141 1.337 . . . . 5.3700000000000001 113.465 167.739 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.6 -19.13 56.07 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 115.315 1.598 . . . . 2.1200000000000001 115.315 168.511 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.82 -55.71 4.79 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.207 1.003 . . . . 2.0600000000000001 110.382 163.136 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -64.6 -28.96 69.98 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.734 1.013 . . . . 2.98 113.734 -175.425 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 5.5 ptmm? -52.53 -32.97 43.26 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 119.654 1.115 . . . . 4.71 112.412 168.722 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 48.8 mt -76.96 -42.44 39.08 Favored 'General case' 0 C--O 1.224 -0.265 0 O-C-N 121.704 -0.622 . . . . 2.0800000000000001 111.675 -179.653 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 35.6 mm -52.01 -53.68 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 125.099 1.36 . . . . 2.6000000000000001 110.485 -179.179 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -59.53 -42.51 92.48 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.214 0.82 . . . . 2.3799999999999999 113.214 -179.949 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -64.62 -30.0 71.02 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.293 0.637 . . . . 5.0300000000000002 112.709 175.682 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -85.8 -47.24 9.91 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.17 0.988 . . . . 3.8399999999999999 112.026 -176.8 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -63.78 -23.3 67.31 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.197 0.908 . . . . 3.0800000000000001 112.692 178.358 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -67.71 -15.01 63.43 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.63 1.344 . . . . 3.6000000000000001 114.63 170.656 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -136.53 -20.43 1.36 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.619 1.711 . . . . 3.4500000000000002 115.619 -169.009 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -122.46 99.75 6.58 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.716 -1.24 . . . . 6.0700000000000003 111.666 -167.758 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -77.6 76.95 4.13 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.818 1.247 . . . . 3.9199999999999999 113.687 -169.996 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 72.2 11.51 75.38 Favored Glycine 0 N--CA 1.477 1.37 0 O-C-N 120.943 -1.098 . . . . 2.96 114.345 176.75 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -65.93 152.16 45.13 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.772 1.629 . . . . 6.4000000000000004 111.935 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 2.5 mp -140.23 78.64 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.779 1.232 . . . . 5.2800000000000002 108.353 174.605 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 27.7 t -82.61 151.67 26.24 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.5 1.12 . . . . 1.8700000000000001 112.171 169.261 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -57.84 -42.11 83.74 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.621 -0.674 . . . . 4.2199999999999998 111.545 170.04 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.95 -22.71 39.38 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.031 0.752 . . . . 3.8199999999999998 113.031 -173.061 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -56.59 -53.11 61.42 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.714 -0.847 . . . . 3.7200000000000002 108.714 166.276 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -58.16 -46.87 84.96 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.274 -0.891 . . . . 4.54 112.484 176.505 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 49.7 t-105 -65.4 -47.78 75.11 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 120.924 -1.11 . . . . 1.04 113.369 -176.373 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.6 t -63.44 -32.86 74.41 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.481 1.037 . . . . 2.6000000000000001 111.914 176.321 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 67.6 mt -61.54 -49.47 76.55 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.263 -0.898 . . . . 2.0299999999999998 112.249 173.711 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.2 mm -57.14 -40.12 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 CA-C-N 120.418 1.463 . . . . 1.97 113.023 -176.712 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.02 -29.74 75.3 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 119.206 -0.774 . . . . 0.81999999999999995 112.735 174.803 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.84 -16.16 75.81 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.404 1.478 . . . . 0.83999999999999997 116.297 -173.807 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.1 mp -86.68 -31.41 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 CA-C-N 119.249 1.524 . . . . 2.2400000000000002 110.82 164.297 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.5 m -74.01 171.13 14.03 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.988 1.715 . . . . 3.0499999999999998 108.546 178.209 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . 115.43 -73.86 0.25 Allowed Glycine 0 N--CA 1.473 1.153 0 CA-C-O 117.752 -1.582 . . . . 2.2000000000000002 113.399 179.532 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.27 -41.0 22.98 Favored 'Trans proline' 0 C--N 1.351 0.687 0 CA-C-N 121.276 2.538 . . . . 1.4399999999999999 110.348 175.616 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 12.4 pt -69.26 -21.2 24.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 113.577 0.955 . . . . 2.75 113.577 170.727 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -60.26 -45.73 92.27 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.185 1.357 . . . . 2.1499999999999999 112.628 -178.448 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -65.68 -35.52 81.01 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 120.68 -1.262 . . . . 4.29 112.89 170.521 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.4 mt -64.35 -41.79 96.57 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.696 -1.145 . . . . 3.0499999999999998 111.172 179.317 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 75.1 mt -49.57 -58.1 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 119.625 1.102 . . . . 2.5 110.1 164.569 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -58.44 -36.23 73.33 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 118.433 -0.794 . . . . 2.0499999999999998 112.611 -172.372 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -68.57 -49.78 56.8 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.669 1.988 . . . . 4.0099999999999998 112.693 171.84 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -70.47 -32.17 69.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.368 1.067 . . . . 2.5899999999999999 113.466 -172.124 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -66.55 -35.71 80.9 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 119.951 1.251 . . . . 2.5 111.207 170.952 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -65.95 -42.38 90.07 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 120.643 -1.285 . . . . 2.6899999999999999 110.588 178.146 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -68.72 -11.68 60.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.417 1.887 . . . . 4.8899999999999997 112.754 177.735 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 10.3 m 52.58 48.2 23.07 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.72 2.408 . . . . 8.7100000000000009 111.793 -173.991 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 32.4 t -145.34 69.89 1.25 Allowed 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 122.376 1.084 . . . . 12.550000000000001 109.648 -159.553 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 81.3 p . . . . . 0 C--O 1.251 1.166 0 CA-C-O 115.647 -2.12 . . . . 16.32 110.807 177.364 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 N--CA 1.476 0.866 0 CA-C-O 121.202 0.525 . . . . 10.83 109.624 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -112.91 61.27 0.64 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 124.758 2.218 . . . . 9.1099999999999994 111.361 -138.283 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 60.8 m -75.22 36.81 0.12 Allowed 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 110.271 -3.149 . . . . 3.75 115.167 -169.328 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.92 159.93 22.29 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.442 2.297 . . . . 3.3199999999999998 108.376 163.543 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.47 153.25 35.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.458 -1.401 . . . . 2.2000000000000002 110.425 178.385 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -63.96 -34.13 77.28 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 119.648 1.113 . . . . 2.0600000000000001 111.437 174.443 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.01 -45.81 87.29 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 120.108 1.322 . . . . 2.2000000000000002 109.375 177.049 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -66.13 -55.74 14.91 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.94 1.296 . . . . 3.02 112.057 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -58.64 -29.72 66.76 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 120.868 -1.145 . . . . 6.0800000000000001 112.099 172.284 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.38 -41.37 76.57 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 119.649 -1.907 . . . . 1.8300000000000001 112.488 169.078 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.409 ' HA ' ' HG ' ' A' ' 15' ' ' LEU . 85.9 t -56.66 -37.54 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 CA-C-N 119.733 1.151 . . . . 1.8600000000000001 110.773 167.887 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.1 mt -55.92 -56.75 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 CA-C-N 120.924 1.693 . . . . 2.3999999999999999 111.852 166.073 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.1 t -52.85 -43.75 46.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 119.382 0.992 . . . . 1.8500000000000001 112.218 -177.773 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.409 ' HG ' ' HA ' ' A' ' 12' ' ' VAL . 1.8 pp -71.44 -18.94 62.29 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.161 1.171 . . . . 5.2300000000000004 114.161 177.956 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.2 t -81.95 -43.52 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.291 0.95 . . . . 2.0600000000000001 110.261 179.177 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -56.68 -41.45 77.33 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.227 0.467 . . . . 3.3799999999999999 110.593 171.988 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -66.75 -23.8 66.13 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 115.397 1.629 . . . . 2.6299999999999999 115.397 -178.243 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -79.61 -52.91 7.39 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.567 -0.708 . . . . 3.1400000000000001 111.852 170.97 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -68.22 -30.75 69.9 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 117.995 -1.002 . . . . 3.0 113.668 -172.065 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.39 -26.31 66.56 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.492 1.293 . . . . 4.79 114.492 172.638 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -93.1 -31.14 14.93 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.76 1.022 . . . . 3.48 113.76 177.847 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 18.9 m -88.36 -159.69 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 121.605 -0.684 . . . . 3.52 110.736 174.68 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.9 m -73.36 -10.74 60.06 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 118.0 2.593 . . . . 5.4299999999999997 118.0 -164.212 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 46.8 tptt 112.72 -69.25 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 130.623 3.569 . . . . 5.5800000000000001 109.63 -157.649 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -130.49 -82.52 0.54 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.555 1.142 . . . . 7.7699999999999996 111.487 -173.731 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.4 m -155.29 6.17 0.23 Allowed 'General case' 0 N--CA 1.479 1.024 0 O-C-N 120.59 -1.319 . . . . 7.4500000000000002 114.268 -178.733 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 90.8 mt -76.56 -17.53 59.17 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.47 1.285 . . . . 9.6799999999999997 114.47 -174.087 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . 0.276 2.7 t 41.45 65.71 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 127.451 2.3 . . . . 5.5300000000000002 114.357 -177.494 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -84.62 -8.11 59.01 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.364 -1.289 . . . . 10.49 112.058 157.458 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -171.86 162.49 6.1 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 128.151 2.58 . . . . 8.0 110.247 178.148 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 15.4 ptmm? -167.98 158.02 10.21 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.508 2.323 . . . . 7.4900000000000002 112.438 179.396 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 7.2 pt -74.13 162.16 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-O 122.459 1.123 . . . . 4.0 112.872 165.781 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.3 t -78.93 150.52 32.08 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.169 -0.923 . . . . 3.6699999999999999 110.576 154.762 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -43.55 -32.3 0.9 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.745 1.618 . . . . 3.1600000000000001 113.075 171.659 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 82.4 p -67.92 -18.09 64.67 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 115.68 1.733 . . . . 2.3900000000000001 115.68 -178.952 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.7 m -65.61 -43.49 89.46 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 121.114 1.779 . . . . 1.73 112.128 177.986 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -50.4 -53.02 32.45 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.29 1.036 . . . . 3.2599999999999998 112.866 -178.327 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -61.52 -17.93 56.91 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.318 0.858 . . . . 3.0800000000000001 113.318 179.481 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -95.66 -42.3 8.46 Favored 'General case' 0 C--O 1.225 -0.184 0 C-N-CA 124.699 1.2 . . . . 3.4399999999999999 112.329 178.438 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -44.39 -53.39 6.89 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.26 1.024 . . . . 2.1000000000000001 109.544 162.363 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.8 mt -52.84 -15.88 0.86 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.12 2.168 . . . . 2.04 116.568 174.071 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.21 1.09 10.78 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.667 1.576 . . . . 3.29 114.187 174.746 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.92 -43.99 6.51 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.985 0.914 . . . . 2.8900000000000001 111.766 164.643 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -88.03 -40.36 13.91 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.977 1.711 . . . . 3.2400000000000002 112.496 -179.08 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.84 25.19 10.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.592 1.557 . . . . 3.02 112.253 -175.68 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -67.5 -23.84 65.51 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 120.917 -1.114 . . . . 1.74 113.708 -174.23 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -86.13 -20.55 28.49 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.245 0.93 . . . . 2.3799999999999999 112.128 -169.026 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.7 mtm -98.23 -8.24 27.72 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 114.954 1.464 . . . . 3.8100000000000001 114.954 168.275 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tp -77.72 71.47 4.2 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 120.445 1.475 . . . . 3.3100000000000001 111.821 -176.43 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.0 m -70.69 3.56 3.08 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 117.416 2.376 . . . . 4.2300000000000004 117.416 -166.587 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -177.32 158.39 1.44 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 127.333 2.253 . . . . 5.5899999999999999 110.502 -179.418 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 53.8 m -58.24 -30.47 66.56 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.783 2.033 . . . . 4.1299999999999999 112.405 171.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.8 -33.41 68.0 Favored Glycine 0 N--CA 1.472 1.085 0 CA-C-N 120.48 1.491 . . . . 2.6200000000000001 113.605 175.938 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -64.63 -45.69 85.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.327 0.651 . . . . 3.8999999999999999 110.938 171.684 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.1 mmm-85 -61.94 -43.87 97.95 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 120.662 -1.274 . . . . 6.0599999999999996 113.638 169.082 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -53.35 -34.96 59.61 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 121.554 1.979 . . . . 4.3399999999999999 111.916 173.879 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.44 -17.55 60.77 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 115.013 1.486 . . . . 2.4100000000000001 115.013 174.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -80.22 -48.7 12.7 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.374 0.988 . . . . 1.79 110.822 163.794 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -63.06 -39.6 95.2 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.352 1.061 . . . . 2.5899999999999999 111.943 -174.826 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.401 ' HZ1' ' CD2' ' A' ' 62' ' ' LEU . 5.4 ptmm? -52.43 -29.12 22.88 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 113.841 1.052 . . . . 4.5899999999999999 113.841 172.588 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.401 ' CD2' ' HZ1' ' A' ' 61' ' ' LYS . 17.1 mt -78.85 -36.45 42.32 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 124.045 0.938 . . . . 2.0099999999999998 111.986 -177.704 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.0 mm -57.69 -51.07 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.608 1.163 . . . . 1.99 109.835 -178.199 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -70.55 -31.62 68.73 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.882 1.273 . . . . 2.6000000000000001 112.959 -179.708 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -65.47 -35.39 80.76 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.626 0.77 . . . . 3.98 112.158 167.568 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.7 tp -75.11 -20.48 59.42 Favored 'General case' 0 C--O 1.221 -0.421 0 O-C-N 120.9 -1.125 . . . . 3.9500000000000002 111.562 174.216 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -70.43 -5.14 26.31 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 115.585 1.698 . . . . 2.7200000000000002 115.585 170.275 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.77 -2.83 31.65 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 113.444 0.905 . . . . 3.9900000000000002 113.444 157.321 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -143.02 179.61 6.94 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 127.264 2.225 . . . . 3.25 110.815 -169.662 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 26.9 t60 101.03 71.64 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 128.231 2.613 . . . . 6.5599999999999996 112.31 159.149 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.86 46.7 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 130.325 3.45 . . . . 6.4400000000000004 114.692 -169.534 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.28 -14.75 2.21 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 126.262 1.886 . . . . 3.8999999999999999 114.275 -176.074 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.2 mmt85 -90.37 -167.53 1.86 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.662 1.985 . . . . 8.3800000000000008 112.059 -177.538 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.7 mm -139.65 132.06 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 127.637 2.375 . . . . 4.2599999999999998 106.542 175.434 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 71.0 m -113.26 146.83 38.7 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.833 0.853 . . . . 2.9700000000000002 110.727 162.584 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -60.65 -38.02 83.48 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.348 0.87 . . . . 3.3999999999999999 113.348 -174.935 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -71.97 -8.83 56.77 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.317 1.047 . . . . 4.4800000000000004 112.883 -176.443 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.82 -56.33 18.42 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.119 0.872 . . . . 3.9900000000000002 111.095 175.526 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -58.58 -33.2 69.69 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.207 -1.558 . . . . 3.8100000000000001 112.212 176.007 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 23.5 t-105 -67.72 -59.49 3.28 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.951 0.723 . . . . 1.45 112.951 178.108 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.9 t -60.28 -23.9 64.52 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.023 1.329 . . . . 2.73 112.147 178.181 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 65.0 mt -73.97 -46.67 42.46 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 117.807 -1.092 . . . . 1.72 113.44 169.355 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 8.2 mm -55.05 -40.8 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 CA-C-N 121.732 2.06 . . . . 2.2000000000000002 112.423 -178.298 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.74 -21.79 63.46 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-N 118.251 0.478 . . . . 0.59999999999999998 113.39 177.135 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.8 -19.45 76.79 Favored Glycine 0 CA--C 1.532 1.143 0 O-C-N 121.236 -1.155 . . . . 0.67000000000000004 114.068 177.963 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -110.2 -34.19 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.904 1.281 . . . . 2.29 111.502 170.495 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.5 m -77.4 85.18 3.8 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.285 1.434 . . . . 1.6399999999999999 108.226 177.667 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -170.33 -68.4 0.04 OUTLIER Glycine 0 CA--C 1.532 1.134 0 C-N-CA 126.077 1.799 . . . . 1.27 111.846 -172.753 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -59.28 -67.83 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.654 2.903 . . . . 1.3 110.877 168.563 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.8 pt -65.84 -20.78 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 117.717 -1.135 . . . . 2.3300000000000001 113.614 177.677 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.54 71.19 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.632 1.56 . . . . 1.97 112.32 173.677 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -63.67 -41.23 98.21 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.848 -1.157 . . . . 5.21 112.585 173.9 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.81 -35.17 75.81 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.219 1.008 . . . . 2.3900000000000001 112.722 178.945 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.2 mt -55.45 -52.71 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 120.854 -1.154 . . . . 2.23 110.161 171.173 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -67.27 -35.71 80.08 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.683 0.623 . . . . 1.8100000000000001 112.683 -176.237 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.263 4.6 pt-20 -75.41 -19.67 59.37 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 119.582 1.083 . . . . 3.0499999999999998 112.514 174.748 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.49 -43.64 22.79 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 117.56 -1.209 . . . . 2.3399999999999999 114.212 172.72 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -61.65 -17.85 57.09 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 119.785 1.175 . . . . 2.3700000000000001 111.762 177.286 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.459 ' C ' ' H ' ' A' ' 101' ' ' SER . 0.0 OUTLIER -98.5 -66.38 0.9 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.325 1.45 . . . . 2.8199999999999998 110.058 176.175 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 57.31 -11.02 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.151 1 C-N-CA 133.235 4.614 . . . . 5.5 116.075 173.499 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.459 ' H ' ' C ' ' A' ' 99' ' ' GLN . 21.1 t -123.35 3.45 9.13 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.57 0.952 . . . . 6.5899999999999999 113.57 -159.6 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 84.93 106.0 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.353 2.661 . . . . 9.2400000000000002 110.851 -172.781 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 5.5 p . . . . . 0 C--O 1.25 1.104 0 C-N-CA 129.775 3.23 . . . . 11.300000000000001 109.931 -172.887 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 70.1 m . . . . . 0 N--CA 1.477 0.893 0 N-CA-C 109.945 -0.391 . . . . 10.51 109.945 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -117.3 62.56 0.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 125.031 2.348 . . . . 8.8100000000000005 111.188 -138.654 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 66.7 m -76.43 -5.54 47.81 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 109.755 -3.384 . . . . 3.73 115.512 -168.14 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -75.54 137.74 41.05 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.29 1.036 . . . . 3.6400000000000001 109.59 167.309 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 22.3 p -70.48 152.55 43.9 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 119.81 1.186 . . . . 1.9099999999999999 111.339 -172.931 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -59.31 -36.08 74.98 Favored 'General case' 0 C--O 1.221 -0.443 0 O-C-N 121.526 -0.734 . . . . 2.1299999999999999 111.851 -177.42 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -44.72 89.19 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.497 1.044 . . . . 2.4500000000000002 111.149 175.261 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -65.68 -56.46 12.0 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.077 0.951 . . . . 2.8399999999999999 111.004 -179.569 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.0 tmtt? -58.33 -27.72 64.41 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 120.941 -1.099 . . . . 5.2699999999999996 112.611 172.137 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.98 -42.14 76.96 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 119.344 -2.097 . . . . 1.6399999999999999 113.08 167.842 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 22.1 t -59.81 -31.08 46.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 CA-C-N 120.299 1.409 . . . . 2.0800000000000001 111.663 168.746 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 69.9 mt -58.57 -60.68 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 O-C-N 120.354 -1.467 . . . . 2.2000000000000002 111.217 163.097 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 32.9 t -52.94 -44.28 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 124.41 1.084 . . . . 1.9399999999999999 112.652 -175.601 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 2.6 pp -70.65 -25.11 62.85 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.32 -0.863 . . . . 5.25 112.777 -179.007 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 42.4 t -78.0 -31.66 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 124.199 1.0 . . . . 1.96 110.57 178.045 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -54.14 -49.86 68.25 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.719 0.808 . . . . 2.8399999999999999 110.284 164.801 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -63.82 -19.26 64.88 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 115.165 1.543 . . . . 2.2799999999999998 115.165 -178.804 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -80.97 -62.11 1.76 Allowed 'General case' 0 C--O 1.237 0.434 0 O-C-N 121.308 -0.87 . . . . 3.5699999999999998 112.266 173.471 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -69.61 -21.22 63.59 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 113.598 0.962 . . . . 2.9700000000000002 113.598 -171.393 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.42 -20.8 66.53 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.429 1.27 . . . . 4.0800000000000001 114.429 168.497 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 14.3 m-30 -106.3 -36.68 6.78 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.707 1.203 . . . . 3.2999999999999998 114.055 177.785 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 15.8 m -79.94 -169.23 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.168 0.894 . . . . 3.8500000000000001 111.449 172.309 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 3.4 m -70.71 -7.28 43.55 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 118.972 2.952 . . . . 5.5599999999999996 118.972 -162.697 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 40.8 tptt 109.39 -73.66 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 130.591 3.556 . . . . 5.79 110.87 -161.797 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -123.65 -87.88 0.62 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.051 0.94 . . . . 7.5599999999999996 112.111 -173.956 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 14.2 m -155.41 1.43 0.17 Allowed 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 115.312 1.597 . . . . 7.5199999999999996 115.312 178.989 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.41 -34.33 77.93 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.307 0.958 . . . . 9.8599999999999994 112.948 176.951 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . 0.263 7.5 t 61.21 71.49 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 127.423 2.289 . . . . 5.5499999999999998 112.401 -172.552 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -79.62 -17.42 53.86 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.192 0.997 . . . . 10.67 112.864 164.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -173.14 170.77 4.28 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 129.507 3.123 . . . . 8.0500000000000007 109.337 176.108 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -165.29 161.98 19.49 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.612 1.965 . . . . 7.46 113.079 -175.48 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 7.8 pt -75.6 161.09 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 122.248 1.023 . . . . 3.98 112.041 162.645 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 36.0 t -82.48 154.11 25.28 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.189 -0.914 . . . . 3.5099999999999998 109.907 157.601 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -49.49 -34.42 16.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.211 1.004 . . . . 3.21 112.027 170.679 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 99.7 p -61.73 -15.75 43.4 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.194 1.183 . . . . 2.21 114.194 177.669 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 69.7 m -65.89 -37.2 85.5 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.931 1.242 . . . . 1.73 112.208 169.442 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -58.42 -49.23 78.03 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.184 1.357 . . . . 3.98 113.295 -173.793 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 16.2 ptt85 -57.54 -12.44 2.73 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.286 1.034 . . . . 4.5700000000000003 113.215 174.243 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -109.82 -42.79 4.16 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 125.93 1.692 . . . . 3.3100000000000001 114.303 179.374 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -40.95 -49.88 3.26 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.885 1.674 . . . . 2.3300000000000001 110.217 163.135 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.6 mt -61.63 -24.64 66.85 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 114.633 1.346 . . . . 2.2400000000000002 114.633 177.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -103.83 2.78 33.13 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.411 1.46 . . . . 2.9900000000000002 114.124 175.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.09 -44.17 4.44 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.448 1.099 . . . . 2.4500000000000002 113.22 167.246 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -96.9 -15.58 21.12 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.803 1.241 . . . . 3.6400000000000001 114.222 -178.777 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.91 26.17 8.28 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.286 1.834 . . . . 2.5899999999999999 112.271 176.265 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -68.76 -16.12 63.71 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 116.046 1.869 . . . . 1.3200000000000001 116.046 -167.868 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -93.54 -38.23 11.49 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 119.644 1.111 . . . . 2.3799999999999999 110.509 -175.141 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 36.5 mtm -77.64 -10.19 59.38 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 113.914 1.079 . . . . 3.8100000000000001 113.914 167.808 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.49 44.04 0.07 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.692 1.997 . . . . 2.9300000000000002 111.946 167.413 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.78 29.72 0.26 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.84 1.656 . . . . 4.7400000000000002 113.598 -167.801 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -174.41 163.89 3.75 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.308 2.643 . . . . 6.6200000000000001 108.886 -161.991 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 47.2 m -107.43 -17.94 13.99 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 125.384 1.474 . . . . 3.7200000000000002 112.816 178.054 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -65.77 -41.69 95.57 Favored Glycine 0 CA--C 1.528 0.878 0 CA-C-N 119.234 0.924 . . . . 2.6600000000000001 112.036 175.44 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -57.53 -43.25 84.18 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 117.816 0.808 . . . . 4.0800000000000001 112.643 174.066 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.39 -50.27 72.08 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 124.133 0.973 . . . . 5.7999999999999998 112.957 171.395 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -61.57 -33.01 73.14 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.835 0.743 . . . . 3.73 112.02 177.838 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . 0.406 ' HA ' ' HG2' ' B' ' 164' ' ' LYS . . . -68.07 -15.74 63.72 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.395 1.257 . . . . 2.27 114.395 173.722 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.44 -44.97 23.38 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.957 0.799 . . . . 1.8500000000000001 110.955 164.301 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -61.91 -40.23 94.74 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.978 0.911 . . . . 2.7200000000000002 112.375 -175.722 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . 0.406 ' HG2' ' HA ' ' B' ' 161' ' ' ALA . 2.9 ptmm? -52.95 -26.31 14.71 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.133 1.16 . . . . 5.0199999999999996 114.133 170.053 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 44.5 mt -83.08 -29.96 28.37 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 118.08 -0.962 . . . . 2.6899999999999999 112.797 176.886 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 41.0 mm -58.33 -55.01 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 118.922 0.783 . . . . 2.29 108.933 177.868 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -61.53 -34.14 75.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.777 1.029 . . . . 3.1400000000000001 113.777 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -70.24 -33.7 71.96 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.598 1.159 . . . . 3.9100000000000001 111.979 175.147 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 24.3 tp -78.5 -21.96 48.16 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 123.87 0.868 . . . . 3.8100000000000001 111.205 172.275 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.52 -8.85 50.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.939 1.696 . . . . 2.96 115.455 174.48 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -73.31 -3.45 27.11 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 113.84 1.052 . . . . 3.9500000000000002 113.84 158.874 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -142.87 179.72 6.85 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 127.187 2.195 . . . . 3.21 111.402 -169.447 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 27.1 t60 100.71 80.42 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 128.461 2.704 . . . . 6.3399999999999999 112.027 160.364 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -72.57 42.57 0.1 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 129.036 2.935 . . . . 6.5 114.404 -167.773 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 75.93 -17.73 3.58 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 126.127 1.822 . . . . 3.71 114.671 -179.499 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -87.57 -155.89 0.32 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.8 1.64 . . . . 8.4900000000000002 111.727 177.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.4 mm -145.98 136.09 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 128.213 2.605 . . . . 4.2300000000000004 106.134 178.406 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.5 m -113.88 153.14 29.71 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.606 0.762 . . . . 2.96 111.257 159.894 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -65.17 -42.43 93.68 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 112.743 0.646 . . . . 3.0800000000000001 112.743 -176.268 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -68.97 -14.27 62.94 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.877 1.271 . . . . 4.3300000000000001 113.087 -173.986 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -56.59 -57.98 10.02 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.8 0.84 . . . . 4.1100000000000003 109.822 174.157 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -54.12 -39.71 66.67 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.026 -1.047 . . . . 3.96 112.611 178.354 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -70.68 -53.9 13.93 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.749 0.648 . . . . 1.8100000000000001 112.749 -179.259 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -62.75 -20.42 64.93 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.701 1.2 . . . . 2.6400000000000001 113.117 -178.24 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 95.9 mt -76.38 -41.11 49.08 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.83 -1.169 . . . . 1.76 113.933 168.143 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 13.8 mm -58.39 -46.26 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 CA-C-N 120.935 1.698 . . . . 1.9299999999999999 112.278 -173.976 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.65 -21.72 60.9 Favored Glycine 0 CA--C 1.533 1.2 0 CA-C-N 118.441 0.564 . . . . 0.69999999999999996 113.4 177.33 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.05 -8.78 65.45 Favored Glycine 0 CA--C 1.535 1.287 0 O-C-N 121.078 -1.248 . . . . 0.89000000000000001 114.183 175.845 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.2 mp -120.39 -37.76 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 126.035 1.734 . . . . 2.5800000000000001 111.544 166.222 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 8.0 m -78.87 78.76 5.3 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.223 1.809 . . . . 1.6499999999999999 108.088 177.974 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -169.06 -65.78 0.03 OUTLIER Glycine 0 CA--C 1.524 0.627 0 CA-C-O 118.282 -1.288 . . . . 1.26 111.127 -174.644 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -57.74 -62.89 0.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.906 2.404 . . . . 1.0900000000000001 110.817 166.05 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.1 pp -74.96 -14.66 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.903 1.229 . . . . 2.0800000000000001 113.142 -177.535 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.28 -36.41 84.02 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.599 0.592 . . . . 2.1899999999999999 112.599 176.514 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -62.93 -41.4 99.47 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 120.624 -1.298 . . . . 5.1900000000000004 111.454 171.417 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.97 -37.09 73.56 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.261 1.424 . . . . 2.6499999999999999 113.019 174.14 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 84.9 mt -54.35 -54.15 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 O-C-N 121.094 -1.004 . . . . 2.1000000000000001 110.755 169.032 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -67.71 -34.62 77.24 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.478 0.918 . . . . 1.72 113.478 -175.495 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -74.14 -20.24 60.3 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 118.521 -0.752 . . . . 3.6600000000000001 112.268 173.758 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -78.61 -40.85 33.28 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 114.996 1.48 . . . . 2.21 114.996 172.924 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -62.98 -13.65 37.79 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 120.72 1.6 . . . . 2.3599999999999999 112.144 174.133 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.479 ' C ' ' H ' ' B' ' 204' ' ' SER . 0.0 OUTLIER -101.08 -71.5 0.71 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.308 1.443 . . . . 3.21 109.616 175.974 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 57.35 -14.73 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.229 1 C-N-CA 134.251 5.02 . . . . 5.25 116.092 172.814 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 204' ' ' SER . . . . . 0.479 ' H ' ' C ' ' B' ' 202' ' ' GLN . 21.8 t -119.14 7.24 11.3 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 124.381 1.072 . . . . 6.4100000000000001 113.037 -159.911 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 4.9 t 85.98 108.12 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 128.667 2.787 . . . . 9.3000000000000007 110.51 -171.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 4.6 p . . . . . 0 C--O 1.25 1.1 0 C-N-CA 129.619 3.168 . . . . 10.84 110.983 -177.832 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 106.58 -1.637 . . . . 8.4199999999999999 106.58 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -62.02 -106.42 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 107.999 -1.112 . . . . 6.4000000000000004 107.999 110.811 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 88.7 m -119.89 -91.68 0.55 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.689 1.996 . . . . 4.0099999999999998 109.001 157.137 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 137.62 157.54 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.227 1 C-N-CA 133.579 4.751 . . . . 3.6000000000000001 109.808 -177.511 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -88.16 146.01 25.62 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.893 -0.78 . . . . 1.8400000000000001 108.893 159.01 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -67.26 -23.9 65.74 Favored 'General case' 0 C--O 1.212 -0.899 0 CA-C-O 117.325 -1.322 . . . . 2.9300000000000002 112.172 177.978 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -49.82 72.96 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 121.828 2.104 . . . . 2.27 109.5 173.487 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -66.52 -55.13 16.95 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 119.294 -0.384 . . . . 2.8599999999999999 111.752 -176.45 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.2 tptt -63.33 -25.51 68.34 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.868 -1.145 . . . . 7.4000000000000004 113.823 175.121 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.7 -43.94 78.9 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.082 -1.637 . . . . 1.8100000000000001 112.571 166.072 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 19.0 t -56.89 -39.93 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.317 1.417 . . . . 1.71 110.262 170.212 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.6 mt -58.61 -52.39 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-O 118.052 -0.975 . . . . 2.1400000000000001 111.281 169.623 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.3 t -57.39 -36.34 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 125.248 1.419 . . . . 1.6200000000000001 112.585 178.868 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.25 -41.01 74.07 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 121.268 -0.895 . . . . 2.02 111.877 174.128 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.16 -44.82 95.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.077 0.551 . . . . 1.6799999999999999 111.041 176.076 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -62.72 -41.6 99.23 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 119.074 -0.488 . . . . 3.54 110.719 173.707 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -62.4 -23.91 67.1 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.408 1.262 . . . . 2.1499999999999999 114.408 -174.585 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -78.02 -59.13 2.91 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.206 1.002 . . . . 3.02 111.063 169.666 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -62.31 -31.88 72.55 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.543 0.942 . . . . 3.54 113.543 -174.967 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.2 ptmt -56.4 -22.14 29.62 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 120.241 1.382 . . . . 3.6099999999999999 114.148 176.746 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -88.72 -12.69 41.57 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.137 1.162 . . . . 4.0199999999999996 114.137 175.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 28.8 m -117.43 169.85 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 120.094 1.316 . . . . 3.5699999999999998 111.78 -179.004 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.2 m -85.75 137.61 32.68 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.214 -0.929 . . . . 4.1500000000000004 113.203 177.193 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.551 ' HZ3' ' C ' ' B' ' 206' ' ' SER . 18.6 tptm 14.74 62.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 128.45 2.7 . . . . 6.6600000000000001 115.786 157.129 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 63.69 9.63 4.49 Favored 'General case' 0 CA--C 1.557 1.212 0 C-N-CA 127.598 2.359 . . . . 7.96 113.983 171.084 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.2 m -90.94 49.43 1.65 Allowed 'General case' 0 CA--C 1.542 0.668 0 O-C-N 119.957 -1.715 . . . . 5.1299999999999999 114.389 -156.618 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -60.51 21.48 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 130.785 3.634 . . . . 8.3699999999999992 117.868 -167.995 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.6 p -157.72 -36.7 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 C-N-CA 130.027 3.331 . . . . 5.2699999999999996 111.56 -176.463 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.88 -25.65 34.84 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 115.031 1.493 . . . . 9.3599999999999994 115.031 177.489 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -164.23 151.8 12.16 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.009 1.324 . . . . 7.3700000000000001 111.62 172.721 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.54 163.32 27.43 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.128 1.158 . . . . 7.6600000000000001 114.128 -163.553 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 31.6 pt -87.62 151.95 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.646 0.778 . . . . 4.04 110.147 161.023 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.5 m -88.07 159.14 18.38 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.055 -1.028 . . . . 3.1000000000000001 111.347 171.611 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -43.2 -35.07 1.27 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.365 1.866 . . . . 3.46 115.574 -179.451 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.5 m -56.42 -29.98 62.23 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.897 1.443 . . . . 2.4900000000000002 114.897 174.153 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.1 m -81.33 -18.88 44.16 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.754 1.02 . . . . 1.49 113.754 -173.362 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -64.85 -51.7 60.62 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.421 1.01 . . . . 3.4900000000000002 110.932 174.164 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.4 ptt180 -65.23 -31.77 73.09 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.319 0.647 . . . . 2.8300000000000001 112.458 179.673 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -70.45 -52.28 23.27 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.494 1.118 . . . . 3.8999999999999999 110.057 174.741 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -50.25 -43.23 52.98 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 121.179 -0.951 . . . . 2.1600000000000001 111.88 172.072 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.6 mt -62.28 -15.31 46.7 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 115.921 1.823 . . . . 2.1000000000000001 115.921 174.617 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -106.66 -7.75 17.21 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.314 1.416 . . . . 2.7599999999999998 114.144 169.705 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -56.26 4.33 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.647 1.112 . . . . 4.0800000000000001 110.97 160.809 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -85.64 -48.42 8.89 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.26 0.624 . . . . 2.6299999999999999 111.624 -167.868 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 tt -106.14 50.24 0.78 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.14 1.376 . . . . 3.25 110.841 -168.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -94.5 -20.96 19.2 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 117.267 2.321 . . . . 1.3500000000000001 117.267 -170.758 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.15 -26.8 39.18 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 121.786 2.085 . . . . 2.2000000000000002 112.962 -177.071 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.1 tpp -65.94 24.84 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 128.965 2.906 . . . . 2.71 115.66 175.949 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.2 mp -109.62 128.3 55.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 128.108 2.563 . . . . 3.6200000000000001 110.874 -173.611 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.415 ' H ' ' ND2' ' A' ' 55' ' ' ASN . 4.7 m -106.22 -17.68 14.23 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.741 1.216 . . . . 4.3200000000000003 112.789 172.765 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -177.15 166.58 2.39 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 129.24 3.016 . . . . 4.2999999999999998 108.289 -173.389 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -27.59 -50.32 0.06 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 128.787 2.835 . . . . 2.8100000000000001 112.754 156.415 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.31 -38.48 49.76 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.725 1.631 . . . . 1.73 114.484 -176.943 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.415 ' ND2' ' H ' ' A' ' 51' ' ' SER . 2.8 m120 -60.78 -33.01 72.32 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.317 1.058 . . . . 3.8799999999999999 112.003 178.55 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.72 -39.7 18.2 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.754 1.222 . . . . 9.5199999999999996 112.876 171.016 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.3 mmmt -61.38 -30.41 70.52 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.902 1.228 . . . . 4.1299999999999999 112.814 179.862 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -48.78 -47.49 41.85 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.954 0.902 . . . . 2.3799999999999999 112.789 165.73 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.41 -41.66 98.72 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.077 1.351 . . . . 1.75 112.241 174.692 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -61.41 -36.68 80.99 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.348 0.659 . . . . 2.27 112.566 178.077 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.9 mtmt -52.3 -37.77 56.65 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.437 1.017 . . . . 4.2800000000000002 112.499 174.378 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.5 mt -72.27 -31.53 65.85 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.551 1.54 . . . . 1.73 112.992 -179.024 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.46 -36.26 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 118.555 0.616 . . . . 2.0899999999999999 111.125 175.476 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -64.76 -50.25 67.56 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.29 1.436 . . . . 3.73 111.047 173.596 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -56.05 -29.95 61.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.99 0.916 . . . . 4.2199999999999998 112.301 178.147 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.5 mt -89.25 -18.2 27.51 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 114.763 1.394 . . . . 4.0 114.763 177.189 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.36 -22.18 66.87 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.382 0.992 . . . . 3.8500000000000001 112.665 169.999 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.9 -18.74 46.17 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.363 1.616 . . . . 3.2400000000000002 115.363 168.892 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -129.95 -19.1 3.29 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 116.179 1.918 . . . . 3.1800000000000002 116.179 -166.008 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -144.28 154.44 43.07 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.6 1.091 . . . . 5.2999999999999998 113.267 -155.037 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.7 t0 99.38 158.38 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 129.848 3.259 . . . . 8.3800000000000008 108.903 -176.404 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 74.1 -54.68 2.26 Favored Glycine 0 CA--C 1.533 1.186 0 O-C-N 120.561 -1.337 . . . . 4.2000000000000002 110.999 -160.417 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -105.32 142.82 34.42 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.429 1.492 . . . . 7.3700000000000001 110.541 158.311 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.6 mm -104.67 149.05 8.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 N-CA-C 107.769 -1.197 . . . . 3.2000000000000002 107.769 163.229 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.4 t -125.41 145.55 50.01 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.28 1.032 . . . . 1.97 108.563 174.064 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -72.63 -51.72 18.4 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 122.418 1.104 . . . . 3.4199999999999999 111.475 -170.51 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -42.66 -38.01 1.9 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 129.866 3.266 . . . . 3.2400000000000002 114.416 170.799 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -67.53 -37.82 83.32 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.658 0.984 . . . . 4.9299999999999997 113.658 -177.288 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -60.83 -47.92 84.15 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 120.54 1.518 . . . . 2.8500000000000001 111.248 172.437 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -63.44 -39.59 94.89 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 119.102 -0.475 . . . . 0.58999999999999997 110.817 -179.509 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 95.2 m -57.22 -52.74 64.12 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.425 1.49 . . . . 2.9900000000000002 110.296 171.15 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 27.8 mt -52.5 -44.33 65.61 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 118.247 -0.882 . . . . 2.1000000000000001 113.293 178.378 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 30.3 mm -55.49 -37.0 43.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 120.072 1.305 . . . . 1.75 111.955 -175.585 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.09 -15.68 58.8 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.031 0.824 . . . . 0.59999999999999998 114.447 176.773 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.73 -16.2 77.88 Favored Glycine 0 CA--C 1.534 1.236 0 CA-C-N 118.699 1.25 . . . . 0.85999999999999999 113.682 172.006 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 mp -103.42 -53.31 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-N 118.638 1.219 . . . . 1.98 109.368 167.669 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.1 m -73.92 61.75 0.81 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 128.002 2.521 . . . . 2.1299999999999999 109.326 171.25 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -139.14 -78.3 0.06 OUTLIER Glycine 0 CA--C 1.527 0.812 0 C-N-CA 125.87 1.7 . . . . 1.0900000000000001 110.017 174.066 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -58.8 -49.19 12.16 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.122 2.548 . . . . 1.0800000000000001 111.669 179.034 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -75.95 -10.98 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 114.105 1.15 . . . . 1.99 114.105 176.32 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.59 -38.12 74.01 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.213 -0.929 . . . . 2.3399999999999999 112.641 -176.155 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -59.94 -39.73 86.54 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 120.432 1.469 . . . . 3.4100000000000001 111.165 165.309 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.78 -38.13 74.92 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 124.301 1.041 . . . . 2.3300000000000001 111.374 -178.667 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.5 mt -50.17 -57.77 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.623 1.101 . . . . 2.0499999999999998 111.076 169.963 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 79.1 t60 -75.68 -5.15 44.17 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 114.148 1.166 . . . . 1.76 114.148 -176.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.265 1.9 pt-20 -107.52 -11.43 15.49 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 119.841 -1.787 . . . . 3.2000000000000002 114.014 167.461 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.443 ' C ' ' H ' ' A' ' 99' ' ' GLN . 8.0 tp60 -83.63 -45.45 13.45 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.877 1.671 . . . . 2.9100000000000001 110.13 171.144 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -73.71 11.49 0.83 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 123.879 1.799 . . . . 2.8799999999999999 111.524 176.185 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.443 ' H ' ' C ' ' A' ' 97' ' ' GLN . 16.0 mm-40 -120.35 -70.81 0.77 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.862 2.065 . . . . 2.2200000000000002 110.411 165.878 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 50.13 7.65 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 130.316 3.446 . . . . 4.6200000000000001 115.566 -178.184 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.404 ' H ' ' C ' ' A' ' 99' ' ' GLN . 33.4 t -157.84 19.88 0.26 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.836 1.254 . . . . 6.7400000000000002 111.933 -164.624 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.1 p -83.08 0.9 42.9 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.469 1.907 . . . . 8.7799999999999994 115.992 -172.39 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.538 ' C ' ' HZ3' ' B' ' 128' ' ' LYS . 41.0 m . . . . . 0 N--CA 1.481 1.111 0 C-N-CA 122.916 0.486 . . . . 11.220000000000001 110.653 -142.783 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 12.2 m . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 106.248 -1.76 . . . . 8.0299999999999994 106.248 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -65.36 -100.33 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 117.937 -1.505 . . . . 6.2999999999999998 107.168 110.83 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 67.1 m -122.59 -84.68 0.66 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.513 1.925 . . . . 3.9900000000000002 109.413 159.84 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 124.08 165.79 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.366 1 C-N-CA 134.321 5.048 . . . . 3.8599999999999999 108.806 -174.648 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.3 p -99.63 150.37 22.33 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.068 0.849 . . . . 1.9099999999999999 109.477 162.343 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -69.57 -22.6 63.52 Favored 'General case' 0 C--O 1.212 -0.88 0 CA-C-O 117.545 -1.217 . . . . 2.96 112.643 178.232 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -53.79 53.38 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 121.954 2.161 . . . . 2.1899999999999999 109.084 171.915 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -53.45 52.4 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 122.763 0.425 . . . . 2.5600000000000001 110.897 -177.367 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -65.35 -27.37 68.53 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 120.969 -1.082 . . . . 8.2899999999999991 113.858 177.045 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.19 -39.89 90.01 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.042 -1.661 . . . . 1.71 113.156 165.217 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 34.8 t -57.54 -39.79 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 120.718 1.599 . . . . 1.71 110.126 169.354 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 2.9 mt -58.38 -54.05 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-O 118.332 -0.842 . . . . 2.4199999999999999 112.254 169.041 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 20.4 t -56.47 -44.04 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 125.903 1.681 . . . . 1.78 112.922 179.467 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.2 mp -64.46 -44.73 90.16 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.492 1.117 . . . . 2.04 110.967 178.244 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 55.8 t -65.73 -40.97 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 118.692 -0.67 . . . . 1.8500000000000001 111.157 179.409 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.64 -42.76 84.07 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.773 0.715 . . . . 3.3799999999999999 111.608 168.292 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.35 -23.98 67.09 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.016 1.487 . . . . 2.1499999999999999 115.016 -175.344 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -79.36 -59.4 2.77 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.4 0.68 . . . . 3.3500000000000001 111.065 168.71 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -61.98 -31.71 72.1 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.563 0.949 . . . . 3.52 113.563 -173.69 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -55.68 -21.25 17.33 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.318 1.447 . . . . 3.2599999999999998 114.159 176.708 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -89.06 -15.38 34.16 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.096 1.147 . . . . 3.8300000000000001 114.096 175.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 33.0 m -115.59 169.48 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-N 119.723 1.147 . . . . 3.5899999999999999 111.919 -178.12 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 16.3 m -85.58 131.39 34.37 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 121.353 -0.842 . . . . 4.0499999999999998 112.755 176.09 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . 0.538 ' HZ3' ' C ' ' A' ' 103' ' ' SER . 19.4 tptm 27.71 56.95 0.09 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.731 2.012 . . . . 6.7300000000000004 115.272 147.579 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 66.51 7.77 5.3 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 127.589 2.356 . . . . 7.96 113.781 171.155 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 58.7 m -89.93 49.26 1.69 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.141 -1.599 . . . . 5.1600000000000001 114.043 -156.42 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 3.8 mt -61.97 23.38 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 130.525 3.53 . . . . 8.5099999999999998 117.41 -169.149 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 2.5 p -158.65 -36.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 C-N-CA 129.851 3.26 . . . . 5.1500000000000004 111.622 -177.568 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.83 -25.29 32.77 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 115.066 1.506 . . . . 9.25 115.066 177.817 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -163.79 152.75 13.96 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.032 1.333 . . . . 7.4699999999999998 111.865 173.358 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . 0.404 ' HZ1' ' CG ' ' B' ' 174' ' ' ASP . 0.0 OUTLIER -163.87 161.48 23.08 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.551 1.315 . . . . 7.6500000000000004 114.551 -164.13 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 30.8 pt -85.85 155.32 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.708 0.803 . . . . 4.1500000000000004 109.468 159.191 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 47.0 m -92.85 163.63 13.64 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.939 -1.101 . . . . 3.0600000000000001 111.704 172.161 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -39.28 -41.05 0.84 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.691 1.996 . . . . 3.6800000000000002 115.338 178.393 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.1 m -57.92 -29.56 65.21 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.349 1.24 . . . . 2.5 114.349 179.154 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 36.8 m -79.58 -21.13 45.43 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.777 1.029 . . . . 1.52 113.777 -173.866 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -64.7 -52.42 57.26 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.187 0.903 . . . . 3.0099999999999998 110.829 174.517 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -65.87 -31.72 72.83 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 122.974 0.51 . . . . 3.25 112.296 179.487 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -69.05 -51.22 41.18 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.888 0.875 . . . . 3.9700000000000002 110.409 174.163 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -51.8 -42.82 62.77 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.552 1.141 . . . . 2.1699999999999999 112.434 173.107 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 15.2 mt -60.12 -13.59 12.77 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.87 1.668 . . . . 2.2000000000000002 115.492 173.415 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.26 -2.85 15.56 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.367 1.439 . . . . 2.7200000000000002 114.061 170.488 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.52 -56.38 3.77 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.381 0.991 . . . . 4.1200000000000001 110.756 159.653 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -88.38 -43.41 11.52 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 122.011 -0.43 . . . . 2.6299999999999999 111.358 -166.578 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 tt -111.33 46.95 1.05 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.067 1.747 . . . . 3.2599999999999998 110.643 -169.795 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -93.7 -14.21 26.6 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 116.303 1.964 . . . . 1.3799999999999999 116.303 -170.872 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.57 -19.06 26.81 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 121.082 1.765 . . . . 2.2599999999999998 112.311 -178.67 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.7 tpp -72.48 24.38 0.05 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 127.405 2.282 . . . . 2.8199999999999998 114.158 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 9.6 mp -110.51 128.42 55.62 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.681 2.392 . . . . 3.4500000000000002 110.761 -169.809 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 4.2 m -103.33 -21.58 13.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.665 1.186 . . . . 4.4199999999999999 112.327 171.737 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -173.66 167.94 4.45 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.126 2.971 . . . . 4.5700000000000003 107.978 -173.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -27.7 -49.64 0.05 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 128.491 2.716 . . . . 3.0699999999999998 112.546 156.265 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.59 -38.83 36.5 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 126.017 1.77 . . . . 1.8700000000000001 114.825 -177.63 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -62.1 -35.42 78.63 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.517 1.158 . . . . 3.8700000000000001 111.855 179.567 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.01 -36.43 23.14 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.623 1.169 . . . . 9.9900000000000002 112.544 172.37 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -61.06 -30.35 70.28 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.725 1.148 . . . . 4.2400000000000002 113.171 175.566 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -52.7 -44.07 66.07 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.193 0.997 . . . . 2.2200000000000002 112.816 167.577 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -65.01 -42.84 94.1 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.161 1.384 . . . . 1.7 111.446 173.323 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -61.29 -35.95 78.73 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.582 0.956 . . . . 2.0499999999999998 113.582 178.314 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -51.95 -37.98 54.87 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.411 1.005 . . . . 4.2300000000000004 112.192 172.786 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 17.9 mt -72.03 -39.21 69.29 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 125.28 1.432 . . . . 1.72 113.015 -178.14 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 30.7 mm -52.27 -34.68 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 125.101 1.361 . . . . 1.96 111.98 175.825 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -61.94 -52.24 64.85 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.715 1.206 . . . . 3.8799999999999999 111.617 173.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -63.2 -32.44 73.84 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.608 1.163 . . . . 4.5999999999999996 112.478 177.649 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.09 -26.0 64.71 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.661 1.984 . . . . 4.4900000000000002 111.947 172.43 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.06 -25.35 64.41 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.866 1.061 . . . . 3.6899999999999999 113.866 172.242 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.65 -24.1 39.22 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.076 1.139 . . . . 3.2000000000000002 114.076 174.23 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -121.92 -19.36 6.72 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 116.248 1.944 . . . . 3.1099999999999999 116.248 -167.138 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -138.49 158.41 44.31 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.08 1.309 . . . . 5.3099999999999996 114.147 -157.276 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . 0.404 ' CG ' ' HZ1' ' B' ' 135' ' ' LYS . 5.5 t0 98.35 157.9 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 129.698 3.199 . . . . 8.2699999999999996 108.633 -179.231 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.65 -58.23 2.1 Favored Glycine 0 CA--C 1.532 1.113 0 O-C-N 120.635 -1.291 . . . . 4.2199999999999998 110.716 -159.493 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 -101.06 139.14 37.16 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.639 1.176 . . . . 7.3200000000000003 110.662 157.886 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 42.0 mm -102.17 144.74 12.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 107.623 -1.251 . . . . 3.4500000000000002 107.623 164.599 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.1 t -117.53 144.07 45.46 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.321 -0.992 . . . . 2.02 108.321 172.192 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -74.31 -52.84 11.05 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 122.891 1.329 . . . . 3.4900000000000002 111.163 -171.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -42.89 -35.34 1.17 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 129.979 3.312 . . . . 3.1899999999999999 114.927 168.056 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -67.31 -38.5 85.05 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.904 0.705 . . . . 4.6600000000000001 112.904 -178.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -58.81 -48.34 81.63 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.122 -1.612 . . . . 3.0600000000000001 111.168 172.202 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 27.7 t-105 -63.38 -41.29 98.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.85 0.46 . . . . 0.63 110.898 -178.706 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 90.1 m -56.06 -52.44 64.27 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.391 1.477 . . . . 2.98 110.354 172.102 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 25.8 mt -56.6 -43.37 80.07 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 113.684 0.994 . . . . 2.0 113.684 179.635 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 28.5 mm -53.33 -38.85 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-N 120.22 1.373 . . . . 1.77 111.685 -178.254 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.61 -16.89 59.43 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.17 0.891 . . . . 0.56000000000000005 114.295 177.89 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.72 -13.88 80.71 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 118.682 1.241 . . . . 0.89000000000000001 113.713 172.685 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -102.57 -54.85 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-N 118.758 1.279 . . . . 1.9199999999999999 109.007 165.16 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 24.7 m -73.71 64.52 0.93 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 127.316 2.246 . . . . 2.1899999999999999 108.935 171.582 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -143.64 -79.78 0.05 OUTLIER Glycine 0 CA--C 1.524 0.6 0 C-N-CA 125.601 1.572 . . . . 1.1200000000000001 109.892 177.396 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -60.33 -46.72 16.9 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.027 2.485 . . . . 1.27 111.894 178.57 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.9 pt -77.42 -10.29 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 N-CA-C 114.023 1.12 . . . . 2.1899999999999999 114.023 176.764 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.45 -39.21 81.54 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 120.791 -1.193 . . . . 2.25 113.022 -176.804 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -59.4 -46.15 89.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.911 -1.118 . . . . 3.4500000000000002 111.289 167.291 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 9.3 tt -53.07 -41.81 65.24 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 124.013 0.925 . . . . 3.0 111.487 179.199 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 88.9 mt -49.76 -59.39 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-N 119.521 1.055 . . . . 2.04 111.544 171.2 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -70.94 -15.92 62.62 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.809 -1.182 . . . . 1.8300000000000001 113.429 -178.361 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -78.97 -12.67 60.04 Favored 'General case' 0 CA--C 1.551 0.984 0 O-C-N 120.468 -1.395 . . . . 3.6899999999999999 112.187 167.534 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -111.72 -31.75 6.87 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.954 1.702 . . . . 4.3399999999999999 114.439 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -63.77 -6.65 6.02 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 121.241 1.837 . . . . 2.6200000000000001 111.922 164.37 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . 0.483 ' C ' ' H ' ' B' ' 204' ' ' SER . 21.9 mm-40 -108.12 -80.16 0.57 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.356 1.462 . . . . 2.4700000000000002 111.272 168.206 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 57.91 -10.53 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 130.783 3.633 . . . . 4.5499999999999998 115.433 -178.028 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 204' ' ' SER . . . . . 0.483 ' H ' ' C ' ' B' ' 202' ' ' GLN . 28.6 t -130.37 8.69 5.08 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.06 1.744 . . . . 6.5099999999999998 112.154 -173.238 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 32.7 p -76.25 -7.12 54.18 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.811 1.244 . . . . 8.5899999999999999 114.036 175.642 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 206' ' ' SER . . . . . 0.551 ' C ' ' HZ3' ' A' ' 25' ' ' LYS . 24.1 m . . . . . 0 N--CA 1.477 0.911 0 C-N-CA 123.364 0.666 . . . . 10.65 110.136 -146.5 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.572 0.225 . . . . 12.15 110.59 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -129.12 -9.6 4.79 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 122.125 0.965 . . . . 9.2300000000000004 113.587 -161.134 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.4 m 139.6 -47.01 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 1 C-N-CA 135.204 5.401 . . . . 4.54 106.28 -162.721 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.83 12.48 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 127.848 2.459 . . . . 3.5299999999999998 117.13 -175.426 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.3 p 53.19 -172.4 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.33 2.652 . . . . 2.3900000000000001 111.21 -162.465 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -94.04 -40.63 9.98 Favored 'General case' 0 C--O 1.222 -0.388 0 O-C-N 120.902 -1.124 . . . . 2.77 110.865 158.044 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.12 -38.83 74.02 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.763 0.825 . . . . 2.1000000000000001 111.02 -171.087 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -69.53 -62.92 1.19 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 118.631 -0.7 . . . . 2.5299999999999998 111.105 -178.66 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -54.43 -29.76 50.38 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 120.429 1.468 . . . . 6.8899999999999997 113.743 172.495 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.36 -43.78 69.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 120.186 1.357 . . . . 1.71 111.254 173.341 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.0 t -57.24 -42.61 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 121.008 1.731 . . . . 1.8999999999999999 110.429 168.089 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.7 mt -55.32 -46.87 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-N 119.712 1.142 . . . . 2.1000000000000001 111.55 171.344 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.0 t -64.41 -41.34 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 120.234 1.379 . . . . 1.95 112.57 178.541 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.7 mp -64.21 -35.84 82.13 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.384 0.673 . . . . 1.9099999999999999 111.308 175.01 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.1 t -73.66 -35.72 44.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.707 1.603 . . . . 1.96 112.176 175.018 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -61.04 -58.02 10.17 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.309 1.044 . . . . 3.73 109.987 176.435 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -55.77 -14.96 2.62 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.17 1.544 . . . . 2.29 115.17 179.764 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -80.03 -66.07 0.92 Allowed 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.367 -1.458 . . . . 3.27 111.613 162.592 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -62.41 -26.95 68.76 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.174 1.176 . . . . 3.9700000000000002 114.174 -172.724 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HE3' ' CE1' ' A' ' 22' ' ' TYR . 5.7 ttpp -50.47 -19.94 1.0 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.802 2.041 . . . . 6.1399999999999997 115.108 174.793 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.548 ' CE1' ' HE3' ' A' ' 21' ' ' LYS . 91.5 m-85 -103.7 -11.73 17.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.103 1.361 . . . . 4.0499999999999998 114.103 177.15 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.4 m -91.54 -174.83 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 118.927 0.785 . . . . 4.0099999999999998 110.877 176.036 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.4 m -141.2 124.64 16.67 Favored 'General case' 0 C--O 1.238 0.476 0 O-C-N 120.501 -1.374 . . . . 4.8700000000000001 109.665 152.543 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.8 tptt 51.25 28.16 4.01 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.059 1.344 . . . . 8.3399999999999999 113.166 174.317 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 81.19 2.74 1.59 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 127.765 2.426 . . . . 8.9199999999999999 115.058 168.449 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.8 t -144.41 -41.05 0.26 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.436 1.273 . . . . 6.8899999999999997 114.436 -175.739 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -17.88 63.6 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.896 1.073 . . . . 11.92 113.896 -172.622 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.1 t 21.4 70.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 129.575 3.15 . . . . 9.2100000000000009 114.256 -173.232 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.1 mmmm -61.7 -37.87 85.75 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.311 -0.868 . . . . 12.23 113.333 -170.213 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -78.76 -32.83 46.79 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 118.74 -0.648 . . . . 11.029999999999999 111.403 -178.972 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 34.0 mttp 73.73 72.87 0.12 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.493 1.917 . . . . 10.119999999999999 109.416 179.436 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.8 tt -75.93 66.92 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 123.207 1.48 . . . . 3.4399999999999999 108.961 174.2 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -64.44 165.64 9.52 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 114.803 -1.089 . . . . 3.0499999999999998 109.06 169.42 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -45.37 -33.75 2.68 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.941 1.089 . . . . 3.6099999999999999 113.941 173.486 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 6.9 m -58.44 -33.76 70.07 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.893 1.442 . . . . 2.7799999999999998 114.893 174.707 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.0 m -85.62 -37.64 19.29 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.087 0.858 . . . . 1.53 111.72 -177.859 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -58.57 -49.52 77.12 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.295 -0.878 . . . . 3.8500000000000001 111.818 179.177 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -59.78 -29.65 68.35 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.107 1.151 . . . . 4.4400000000000004 114.107 177.771 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -86.29 -51.1 6.46 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.746 1.618 . . . . 3.3900000000000001 110.312 -176.242 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 15.4 tmm? -51.25 -37.27 46.16 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.751 1.22 . . . . 1.73 112.439 170.411 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.8 mt -70.29 -4.44 22.0 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 116.282 1.956 . . . . 2.4100000000000001 116.282 174.618 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -103.7 -4.29 23.92 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.489 1.495 . . . . 2.73 114.009 163.11 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -54.11 3.53 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.19 0.996 . . . . 2.8599999999999999 113.027 168.776 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -84.91 -22.45 29.28 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.199 1.555 . . . . 3.1400000000000001 115.199 -166.205 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 mt -126.73 50.55 1.93 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.889 2.076 . . . . 3.02 108.504 -177.488 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -91.13 -23.14 20.37 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.519 1.303 . . . . 1.6000000000000001 114.519 -166.323 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -90.91 -33.93 15.41 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.285 1.034 . . . . 1.95 112.464 -170.785 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.7 ptp -66.91 -4.51 9.61 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.343 1.457 . . . . 3.21 114.275 173.756 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.3 tp -76.11 117.57 17.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 125.961 1.704 . . . . 3.9300000000000002 111.837 -161.163 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.1 m -75.61 56.62 0.91 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.89 -1.131 . . . . 5.1900000000000004 111.348 161.19 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.613 ' CG ' ' H ' ' A' ' 53' ' ' THR . 33.4 t70 52.32 -150.52 0.32 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 127.806 2.443 . . . . 4.6600000000000001 113.913 175.467 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.613 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 52.7 p -54.82 -32.46 60.47 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 127.953 2.501 . . . . 3.4199999999999999 112.092 170.192 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.91 -50.89 52.9 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 124.431 1.015 . . . . 1.78 111.583 174.949 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.23 -36.95 82.75 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 117.492 0.646 . . . . 4.2000000000000002 112.603 173.481 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -56.01 -34.15 65.54 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.417 -1.427 . . . . 7.0300000000000002 113.089 -178.369 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -64.37 -22.25 66.89 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.858 1.429 . . . . 5.1299999999999999 114.858 173.165 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.83 -17.93 59.65 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.589 1.156 . . . . 1.8300000000000001 114.081 169.143 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -79.41 -51.04 9.91 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.257 0.935 . . . . 1.8600000000000001 110.804 163.971 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -70.49 -23.31 62.65 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.757 1.021 . . . . 2.3199999999999998 113.757 -174.918 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -56.43 -30.06 62.37 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.524 1.511 . . . . 4.0199999999999996 112.464 167.091 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 15.7 mt -81.01 -32.65 34.12 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.663 0.785 . . . . 2.1800000000000002 112.109 -179.039 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 27.0 mm -60.36 -49.68 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.115 1.366 . . . . 2.27 111.489 174.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -64.05 -38.01 89.5 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.347 0.659 . . . . 2.8999999999999999 112.074 175.794 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -61.97 -30.95 71.27 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.95 0.9 . . . . 4.0999999999999996 112.876 175.221 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.7 mt -88.51 -19.4 26.47 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 114.847 1.425 . . . . 3.6400000000000001 114.847 169.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -20.26 64.13 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.884 1.674 . . . . 3.6400000000000001 112.122 170.481 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.37 -17.68 51.23 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.556 1.687 . . . . 2.75 115.556 166.61 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -118.22 -21.83 7.99 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.673 1.578 . . . . 3.0899999999999999 114.476 -174.272 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.05 160.61 42.98 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.503 1.047 . . . . 4.5499999999999998 112.115 -162.674 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.461 ' CG ' ' H ' ' A' ' 72' ' ' GLY . 12.0 p-10 -98.27 -116.05 0.14 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.432 1.893 . . . . 6.1200000000000001 111.829 -175.108 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.461 ' H ' ' CG ' ' A' ' 71' ' ' ASP . . . -90.24 -3.33 72.73 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 125.425 1.488 . . . . 5.1200000000000001 113.471 159.07 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.4 mmt-85 -84.48 165.44 18.1 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.314 1.557 . . . . 8.9600000000000009 112.304 164.538 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.3 pp -149.56 156.06 7.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 130.264 3.426 . . . . 4.4699999999999998 107.787 174.109 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.4 t -97.77 175.32 6.21 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.588 1.155 . . . . 2.1200000000000001 112.27 167.047 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -66.51 -54.61 21.97 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.366 1.066 . . . . 3.9300000000000002 112.643 178.295 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.52 -30.42 70.62 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 126.232 1.813 . . . . 2.98 111.655 -175.936 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -64.3 -54.38 34.09 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 117.79 -1.1 . . . . 3.9399999999999999 111.014 175.415 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -50.9 -48.14 60.53 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 120.642 1.564 . . . . 3.9199999999999999 111.955 177.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.8 t-105 -60.94 -43.13 99.08 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 119.292 -0.385 . . . . 0.76000000000000001 111.54 179.659 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 87.2 m -60.87 -39.5 89.4 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.398 1.479 . . . . 2.8399999999999999 111.966 173.17 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 94.1 mt -60.68 -55.39 33.81 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-O 118.121 -0.942 . . . . 2.04 110.35 177.013 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.4 mm -47.52 -42.36 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 CA-C-N 119.583 1.083 . . . . 2.0299999999999998 112.919 -176.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.15 -30.06 69.77 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-O 118.943 -0.92 . . . . 0.71999999999999997 113.292 177.479 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.14 -21.64 64.81 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 118.259 -1.301 . . . . 0.57999999999999996 115.423 -177.366 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.0 mp -86.14 -39.67 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 CA-C-N 119.231 1.515 . . . . 2.3599999999999999 110.587 168.537 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 33.8 m -69.73 -39.91 76.53 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.979 1.711 . . . . 3.2599999999999998 111.549 -174.671 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -27.49 -67.02 0.07 OUTLIER Glycine 0 CA--C 1.535 1.332 0 C-N-CA 128.241 2.829 . . . . 2.27 116.391 -175.396 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.8 -33.56 2.18 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.147 2.565 . . . . 1.04 113.41 -173.626 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.4 pt -82.72 -20.97 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 118.981 0.81 . . . . 2.6099999999999999 113.177 -175.987 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -52.68 -50.29 63.58 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.072 2.149 . . . . 1.77 113.107 -178.175 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.405 ' HE3' ' CD2' ' B' ' 129' ' ' TYR . 49.9 mtpt -48.11 -53.7 15.73 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.744 0.783 . . . . 4.7000000000000002 110.981 172.888 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.95 -38.35 76.1 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 118.211 -0.9 . . . . 3.27 111.549 -172.925 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 25.7 mt -47.6 -62.87 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.458 1.103 . . . . 2.8100000000000001 111.4 165.996 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -59.8 -42.37 93.28 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.959 0.8 . . . . 1.98 111.245 -177.164 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.394 3.3 pt-20 -77.32 -9.01 58.57 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 121.226 -0.921 . . . . 2.8700000000000001 112.534 -178.505 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -88.17 -26.59 22.34 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 116.589 2.07 . . . . 2.3399999999999999 116.589 165.096 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -68.74 0.25 4.51 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 120.62 1.554 . . . . 2.9399999999999999 111.576 169.866 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -129.01 -64.11 0.93 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.682 2.393 . . . . 3.7999999999999998 110.84 -176.213 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . 0.263 7.7 pt20 55.32 21.42 4.14 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 128.5 2.72 . . . . 5.2300000000000004 115.529 173.037 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.1 m -152.54 37.32 0.52 Allowed 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.361 -1.462 . . . . 6.6200000000000001 111.496 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.5 t -112.95 15.62 19.64 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.481 1.112 . . . . 8.8200000000000003 112.872 176.771 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 75.0 m . . . . . 0 C--O 1.246 0.878 0 C-N-CA 129.815 3.246 . . . . 10.26 109.151 -177.3 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 105' ' ' SER . . . . . 0.43 ' H3 ' ' CD ' ' B' ' 110' ' ' GLU . 9.2 m . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 110.158 -0.312 . . . . 12.300000000000001 110.158 . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -129.01 -11.0 4.79 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 113.971 1.1 . . . . 8.9800000000000004 113.971 -157.958 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 63.5 m 116.94 -27.92 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.903 1 C-N-CA 133.339 4.655 . . . . 4.7000000000000002 108.126 -156.777 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -70.82 19.91 0.05 OUTLIER 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 128.085 2.554 . . . . 3.4199999999999999 115.446 179.538 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 14.2 p 47.41 -161.0 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 127.974 2.509 . . . . 2.3900000000000001 111.081 -153.93 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . 0.43 ' CD ' ' H3 ' ' B' ' 105' ' ' SER . 5.8 tp10 -102.28 -33.99 9.39 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 120.082 1.31 . . . . 2.6200000000000001 111.487 149.071 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.11 -42.17 72.61 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.337 0.655 . . . . 1.9299999999999999 109.763 -169.727 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -64.43 -64.11 0.96 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.499 -1.238 . . . . 2.5499999999999998 111.485 176.464 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -51.84 -31.79 29.18 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 121.762 2.074 . . . . 7.5999999999999996 114.095 177.155 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.55 -41.34 60.75 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.789 1.177 . . . . 1.71 112.501 174.983 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 39.5 t -60.0 -42.91 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-N 120.55 1.523 . . . . 2.1699999999999999 110.107 166.71 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 6.3 mt -54.36 -48.79 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-O 117.812 -1.089 . . . . 2.3500000000000001 109.919 171.061 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.6 t -60.59 -43.06 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 120.643 1.565 . . . . 2.2000000000000002 112.859 177.677 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 3.6 mp -60.44 -41.99 95.19 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.958 0.799 . . . . 2.1099999999999999 111.997 173.939 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 40.2 t -69.39 -41.23 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 125.477 1.511 . . . . 2.23 111.985 177.659 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.91 -57.07 14.18 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 124.401 1.081 . . . . 4.1100000000000003 108.326 179.235 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -52.43 -24.75 8.41 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.461 1.282 . . . . 2.29 114.461 -178.775 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -74.08 -62.96 1.33 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.453 1.024 . . . . 3.5099999999999998 112.079 168.672 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -62.49 -25.77 68.18 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.298 0.851 . . . . 4.0199999999999996 113.298 -176.294 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -43.56 -30.27 0.57 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.345 2.658 . . . . 4.2400000000000002 115.338 172.062 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -96.21 -13.3 23.58 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.999 1.111 . . . . 3.9399999999999999 113.999 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . 0.256 4.4 m -87.38 -161.74 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 121.893 0.854 . . . . 4.0 111.898 -174.179 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 3.3 m -156.4 124.42 5.63 Favored 'General case' 0 C--O 1.238 0.489 0 O-C-N 120.341 -1.474 . . . . 4.9500000000000002 108.963 154.105 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 36.2 tptt 44.39 31.59 0.61 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.341 1.856 . . . . 8.6099999999999994 113.566 -179.483 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . 0.405 ' CD2' ' HE3' ' A' ' 92' ' ' LYS . 16.0 m-85 75.87 6.66 3.8 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.101 2.16 . . . . 8.8699999999999992 114.453 171.085 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 11.6 t -143.7 -41.95 0.28 Allowed 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 115.007 1.484 . . . . 6.9400000000000004 115.007 -177.246 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.09 -30.01 67.12 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.246 -0.909 . . . . 12.1 112.456 -173.738 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 9.0 t 42.22 69.77 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 127.377 2.271 . . . . 9.3100000000000005 112.788 -179.412 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 6.8 mmmm -61.18 -36.98 81.3 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.584 0.957 . . . . 12.24 113.584 -169.597 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -26.01 40.55 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.805 0.73 . . . . 11.17 111.688 179.539 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 32.6 mttp 70.58 63.95 0.19 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.202 1.801 . . . . 10.25 109.655 176.373 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 4.4 tt -72.99 66.49 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.173 1.389 . . . . 3.3300000000000001 110.12 179.52 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 10.5 m -61.79 160.63 11.55 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.188 -0.914 . . . . 3.1699999999999999 109.406 165.192 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -43.71 -31.83 0.88 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 115.461 1.652 . . . . 3.5899999999999999 115.461 177.103 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.7 m -55.07 -34.88 63.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.628 1.571 . . . . 2.7400000000000002 115.067 173.836 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.5 m -78.55 -41.54 31.8 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.726 1.148 . . . . 1.45 111.947 -179.936 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -57.74 -45.84 85.28 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 120.997 -1.064 . . . . 3.6499999999999999 112.401 -177.191 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -63.24 -27.84 69.63 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.929 1.085 . . . . 4.6900000000000004 113.929 177.675 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -87.19 -49.67 7.13 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 124.445 1.098 . . . . 3.3799999999999999 109.629 -177.681 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 14.4 tmm? -50.21 -37.65 36.38 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.741 2.017 . . . . 1.6299999999999999 113.127 171.63 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 17.5 mt -68.7 -0.6 5.48 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 116.799 2.148 . . . . 2.4399999999999999 116.799 174.037 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -114.94 11.2 16.5 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.087 1.143 . . . . 2.4100000000000001 114.087 161.221 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.44 -56.8 2.21 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.816 1.246 . . . . 2.8700000000000001 112.993 166.806 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -75.97 -27.21 57.42 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.009 -1.057 . . . . 2.6299999999999999 113.704 -173.014 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 2.2 mt -128.3 56.1 1.64 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 127.023 2.129 . . . . 3.02 107.929 -172.307 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -102.58 -15.76 16.29 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.481 1.512 . . . . 1.46 115.022 -166.398 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -94.96 -34.9 12.2 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 120.96 -1.087 . . . . 1.98 110.957 179.394 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 9.6 ptp -68.0 -3.06 8.85 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.533 0.938 . . . . 3.1299999999999999 113.533 166.129 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 28.5 tp -71.72 105.5 3.75 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.124 -0.985 . . . . 3.9300000000000002 111.049 -170.116 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 5.4 m -79.78 54.25 1.8 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.157 0.98 . . . . 5.0 111.323 169.556 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . 0.618 ' CG ' ' H ' ' B' ' 156' ' ' THR . 27.4 t70 53.23 -153.75 0.25 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 128.551 2.74 . . . . 4.7800000000000002 115.018 171.786 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 156' ' ' THR . . . . . 0.618 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 41.4 p -54.9 -36.36 65.09 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 128.671 2.789 . . . . 3.3999999999999999 112.176 175.61 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.8 -46.73 89.65 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 123.811 0.719 . . . . 1.96 111.604 175.75 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -72.26 -34.36 68.18 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.042 0.937 . . . . 3.9199999999999999 113.188 174.059 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -58.49 -35.02 71.57 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.252 -1.53 . . . . 7.1500000000000004 112.596 177.182 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -63.34 -25.65 68.4 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.23 1.567 . . . . 5.2999999999999998 115.23 171.5 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -76.37 -18.38 58.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.134 1.161 . . . . 1.76 114.134 170.787 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.33 -52.75 7.7 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.179 0.9 . . . . 1.98 110.708 163.043 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -68.39 -25.05 64.86 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.335 0.865 . . . . 2.0899999999999999 113.335 -174.091 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -57.87 -30.39 65.78 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.327 -1.483 . . . . 3.9199999999999999 112.615 168.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 15.9 mt -80.79 -29.87 36.03 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.314 0.646 . . . . 2.0899999999999999 112.104 -177.879 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 36.2 mm -61.13 -51.06 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.172 1.389 . . . . 2.27 111.049 174.77 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -66.01 -35.81 81.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.76 0.824 . . . . 2.7400000000000002 112.604 176.348 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -62.4 -35.91 80.67 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.81 0.844 . . . . 4.0 112.03 173.763 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.6 tp -86.71 -21.39 26.65 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.593 0.96 . . . . 4.1900000000000004 113.593 178.211 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -63.05 -23.65 67.55 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.894 0.877 . . . . 3.6699999999999999 112.376 173.458 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.13 -11.24 60.75 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.761 1.393 . . . . 3.0 114.761 169.623 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -125.46 -23.39 4.11 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.274 1.213 . . . . 3.2200000000000002 114.274 -172.417 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.26 158.16 43.5 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.433 -0.792 . . . . 4.5800000000000001 112.743 -160.229 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . 0.458 ' CG ' ' H ' ' B' ' 175' ' ' GLY . 12.8 p-10 -103.19 -118.13 0.2 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 127.392 2.277 . . . . 6.0199999999999996 111.737 -172.392 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . 0.458 ' H ' ' CG ' ' B' ' 174' ' ' ASP . . . -87.41 -4.88 80.03 Favored Glycine 0 CA--C 1.534 1.279 0 CA-C-O 118.265 -1.297 . . . . 4.9400000000000004 113.703 159.869 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.6 mmt-85 -83.17 164.82 19.95 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 119.783 1.791 . . . . 9.0500000000000007 112.282 162.62 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 1.6 pp -146.67 153.89 12.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 129.628 3.171 . . . . 4.6900000000000004 107.099 173.02 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 8.4 t -97.98 176.51 5.75 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.974 0.909 . . . . 2.1000000000000001 111.43 166.246 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -74.35 -52.29 12.63 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.428 0.899 . . . . 3.8500000000000001 113.428 -176.39 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -58.6 -29.28 66.33 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.453 1.901 . . . . 3.1699999999999999 111.548 -179.485 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -64.5 -55.93 17.42 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-O 118.027 -0.987 . . . . 4.0 110.811 175.345 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -50.24 -49.01 54.29 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.422 1.464 . . . . 3.8599999999999999 112.497 178.949 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -62.52 -40.66 97.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.926 0.49 . . . . 0.73999999999999999 111.708 179.958 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 97.9 m -64.09 -37.6 88.03 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.434 1.494 . . . . 2.9700000000000002 111.706 173.298 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.5 mt -60.13 -51.22 70.52 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.21 0.914 . . . . 2.0099999999999998 110.523 175.624 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 47.4 mm -46.3 -42.26 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-N 119.631 1.105 . . . . 1.8600000000000001 113.078 -177.589 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.14 -31.65 79.65 Favored Glycine 0 CA--C 1.533 1.212 0 CA-C-O 119.193 -0.781 . . . . 0.81999999999999995 113.467 178.732 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.38 -24.75 69.93 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-N 118.826 1.313 . . . . 0.68999999999999995 114.528 -177.011 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -87.8 -37.51 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 CA-C-N 118.682 1.241 . . . . 2.6099999999999999 111.471 169.03 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 22.8 m -80.81 -40.0 25.7 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.482 1.113 . . . . 3.3100000000000001 112.612 -169.325 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -45.08 -48.18 9.92 Favored Glycine 0 CA--C 1.538 1.526 0 CA-C-O 117.416 -1.769 . . . . 2.1099999999999999 116.249 -172.926 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.52 -32.88 7.4 Favored 'Trans proline' 0 C--N 1.353 0.809 0 CA-C-N 121.05 2.425 . . . . 1.1100000000000001 113.05 -179.738 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 41.2 pt -85.14 -20.44 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 113.218 0.822 . . . . 2.4100000000000001 113.218 179.979 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -51.89 -45.78 64.29 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 127.399 2.28 . . . . 1.6499999999999999 111.967 -178.033 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -55.27 -49.18 72.73 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.11 0.564 . . . . 4.7000000000000002 111.222 175.399 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.09 -35.49 61.78 Favored 'General case' 0 C--O 1.222 -0.373 0 O-C-N 121.228 -0.92 . . . . 3.21 111.675 -175.469 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 27.2 mt -48.75 -62.43 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.82 1.248 . . . . 2.6699999999999999 110.421 166.457 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -60.25 -45.04 94.63 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.931 -0.481 . . . . 1.98 111.041 -176.242 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.383 3.1 pt-20 -78.39 -8.06 58.04 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.406 0.521 . . . . 2.7799999999999998 112.406 -174.401 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.88 -27.8 44.04 Favored 'General case' 0 C--N 1.346 0.452 0 C-N-CA 126.551 1.941 . . . . 2.3300000000000001 115.324 162.905 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -74.19 5.52 4.36 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 121.055 1.752 . . . . 2.4300000000000002 111.159 172.57 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -127.94 -67.85 0.8 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.435 2.294 . . . . 2.8799999999999999 110.144 -176.991 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 56.2 12.01 0.89 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 129.806 3.242 . . . . 5.1699999999999999 115.803 167.441 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 72.1 m -155.95 33.12 0.35 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.566 1.146 . . . . 6.4800000000000004 111.838 -176.377 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 33.3 t -104.89 8.15 34.58 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.926 -1.109 . . . . 8.7899999999999991 112.96 169.108 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 34.8 m . . . . . 0 C--O 1.248 0.976 0 C-N-CA 127.685 2.394 . . . . 9.9000000000000004 108.963 -179.843 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 112.246 0.462 . . . . 10.67 112.246 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -88.09 -120.69 0.05 OUTLIER 'General case' 0 CA--C 1.559 1.327 0 O-C-N 124.896 1.373 . . . . 7.2599999999999998 109.137 140.968 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 94.5 m -95.75 33.19 1.7 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.481 2.313 . . . . 5.2599999999999998 114.23 -167.233 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -57.74 130.36 46.09 Favored 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 126.163 1.785 . . . . 3.54 113.45 -161.86 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.4 p -70.81 159.37 34.7 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 125.275 1.43 . . . . 2.3799999999999999 111.928 -174.692 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -61.76 -39.5 91.82 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 120.469 1.486 . . . . 2.3700000000000001 112.904 -178.425 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.19 -47.25 81.73 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.671 0.748 . . . . 1.8 110.469 175.082 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.66 -52.4 31.6 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.835 0.854 . . . . 2.8999999999999999 111.726 -177.044 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -56.73 -32.09 65.19 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 119.842 -1.786 . . . . 6.0700000000000003 113.765 169.731 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.63 -39.88 91.96 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 120.745 -1.222 . . . . 1.54 111.634 172.693 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 95.4 t -59.0 -33.67 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-N 119.401 1.001 . . . . 1.77 111.074 166.063 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.7 mt -58.54 -59.08 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 CA-C-N 120.469 1.486 . . . . 2.0299999999999998 111.558 164.139 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 23.1 t -55.02 -38.6 46.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.149 1.38 . . . . 1.8400000000000001 112.926 -176.945 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -65.7 -27.61 68.46 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.465 -1.397 . . . . 1.96 112.563 174.36 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.0 t -94.87 -19.72 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.137 1.375 . . . . 2.2000000000000002 111.343 -179.552 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -59.8 -54.24 48.52 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 120.342 1.428 . . . . 4.0099999999999998 110.083 153.573 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.8 t30 -54.18 -34.29 60.15 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 118.921 0.782 . . . . 2.3599999999999999 112.948 -178.344 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -80.32 -48.51 12.88 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.243 0.831 . . . . 3.6200000000000001 113.243 174.144 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -73.5 -22.29 60.18 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 114.23 1.196 . . . . 4.0700000000000003 114.23 -173.039 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.3 ptmt -48.86 -34.98 13.64 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 120.872 1.669 . . . . 3.6000000000000001 113.064 176.134 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -74.4 -40.27 62.14 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 114.03 1.122 . . . . 3.8100000000000001 114.03 178.529 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.6 m -79.98 -16.4 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 118.921 0.782 . . . . 4.0700000000000003 112.244 177.025 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.3 m 68.69 -59.61 0.46 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 128.973 2.909 . . . . 5.5999999999999996 111.995 -173.211 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 tmtm? -178.73 -38.78 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 127.486 2.314 . . . . 6.7800000000000002 112.149 -169.136 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -118.01 -23.95 7.24 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.911 1.819 . . . . 7.9000000000000004 115.911 -171.516 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.8 m -67.0 -37.73 84.73 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.109 1.322 . . . . 7.4800000000000004 113.438 -170.435 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 90.2 mt 48.45 -79.97 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 129.216 3.006 . . . . 7.6299999999999999 113.778 172.608 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -140.5 -19.6 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 126.775 2.03 . . . . 4.5899999999999999 113.359 175.706 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -57.05 -33.82 67.63 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.9 -1.125 . . . . 9.4800000000000004 112.896 166.456 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -132.26 68.7 1.49 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 122.605 1.193 . . . . 7.75 111.594 166.739 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.16 159.94 32.03 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 126.516 1.926 . . . . 7.0499999999999998 113.849 176.067 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.7 pt -71.71 -173.21 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 127.16 2.184 . . . . 3.0699999999999998 115.123 -174.722 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 97.6 p -101.02 140.75 34.89 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 120.692 -1.255 . . . . 3.9199999999999999 108.375 152.879 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -71.44 -18.95 62.29 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.19 -0.944 . . . . 3.8799999999999999 112.582 -171.846 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.9 m -48.43 -30.34 4.97 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.264 1.026 . . . . 2.73 113.621 159.323 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 t -65.28 -35.16 80.17 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 117.477 -1.249 . . . . 2.6000000000000001 111.761 176.443 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -59.3 -48.89 79.94 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 120.929 1.695 . . . . 3.0299999999999998 111.844 174.881 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.0 ptt85 -62.97 -29.74 71.04 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.346 0.976 . . . . 5.6200000000000001 111.463 176.606 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -83.96 -39.84 19.25 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 114.008 1.114 . . . . 3.1099999999999999 114.008 -175.874 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.7 tmm? -51.67 -47.8 63.68 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 126.331 1.853 . . . . 2.1600000000000001 110.67 162.379 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -55.47 -50.82 68.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.487 0.585 . . . . 2.2200000000000002 112.393 169.227 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -79.14 -9.17 59.48 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 115.758 1.762 . . . . 3.0299999999999998 115.758 -175.786 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -98.16 -51.68 3.93 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.256 1.423 . . . . 2.1299999999999999 114.078 167.724 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -89.67 -43.21 10.89 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.093 0.957 . . . . 2.8999999999999999 111.966 -168.9 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.58 38.55 2.13 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.049 1.34 . . . . 2.96 110.742 -168.526 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -96.55 -17.78 20.24 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 116.085 1.883 . . . . 2.3599999999999999 116.085 -149.257 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 -92.17 -38.9 11.87 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.446 1.498 . . . . 2.4300000000000002 113.142 -162.939 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 68.4 mtm -77.0 -18.9 57.89 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.021 -1.049 . . . . 4.0 113.367 170.479 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.1 tt -56.52 -31.24 63.93 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.128 0.971 . . . . 5.7999999999999998 112.68 -155.401 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.1 m 83.5 109.66 0.06 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.349 2.26 . . . . 5.2999999999999998 111.494 169.477 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.478 ' CG ' ' H ' ' A' ' 53' ' ' THR . 9.2 t70 66.42 -163.14 0.24 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.904 1.682 . . . . 4.4400000000000004 113.669 168.169 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.478 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 24.4 m -87.14 -31.56 20.34 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.274 1.429 . . . . 3.3100000000000001 109.913 157.03 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.2 -42.21 72.22 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.793 1.187 . . . . 2.2000000000000002 114.154 -174.773 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -76.38 -20.62 56.98 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.902 1.351 . . . . 4.7300000000000004 112.955 177.983 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.6 mtt85 -69.72 -37.92 76.72 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.0 -1.688 . . . . 8.3200000000000003 112.43 164.279 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 mmmt -59.07 -40.35 84.94 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.417 1.008 . . . . 5.0700000000000003 111.373 170.411 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.448 ' HA ' ' HE3' ' A' ' 61' ' ' LYS . . . -59.14 -40.44 85.48 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 117.833 -1.08 . . . . 2.6400000000000001 113.739 173.143 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.04 -46.88 84.64 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.663 1.185 . . . . 1.8999999999999999 112.368 167.32 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -62.79 -34.06 76.49 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.036 0.934 . . . . 2.4300000000000002 112.891 -175.681 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.448 ' HE3' ' HA ' ' A' ' 58' ' ' ALA . 8.0 mtmp? -47.69 -44.0 27.1 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 122.979 1.371 . . . . 3.96 113.102 169.488 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.1 mt -69.36 -43.05 74.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 113.615 -1.629 . . . . 2.1000000000000001 110.491 -174.708 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.1 mm -53.8 -54.57 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.669 1.588 . . . . 2.0099999999999998 110.56 178.806 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -64.13 -37.75 88.58 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 123.699 0.799 . . . . 3.7599999999999998 112.377 -178.001 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -44.34 82.46 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 121.512 0.672 . . . . 4.8499999999999996 112.232 168.355 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.21 -34.06 68.08 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.012 0.925 . . . . 3.6499999999999999 110.922 -174.429 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -77.78 -30.92 51.64 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.829 1.048 . . . . 3.5699999999999998 113.829 171.26 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.27 -31.63 58.38 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.852 1.056 . . . . 3.8100000000000001 113.852 176.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.51 57.94 1.19 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.484 1.113 . . . . 4.5599999999999996 113.084 -173.49 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.77 5.05 0.06 Allowed 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 116.594 2.072 . . . . 5.1900000000000004 116.594 167.301 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 72' ' ' GLY . 17.0 t70 59.65 -150.36 0.43 Allowed 'General case' 0 CA--C 1.557 1.216 0 CA-C-N 120.004 1.274 . . . . 4.0 110.102 -175.959 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.407 ' H ' ' CG ' ' A' ' 71' ' ' ASP . . . -93.91 11.63 70.6 Favored Glycine 0 CA--C 1.533 1.183 0 O-C-N 119.962 -1.711 . . . . 2.8199999999999998 112.603 158.231 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.2 mmt-85 -80.28 70.71 6.98 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.524 1.662 . . . . 5.6100000000000003 111.452 -176.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.8 mt -63.33 139.47 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 124.766 1.226 . . . . 3.2000000000000002 109.814 174.614 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.5 m -117.23 158.74 23.79 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.321 1.048 . . . . 2.5099999999999998 109.817 168.351 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -46.23 -47.73 17.91 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 123.151 1.453 . . . . 3.0699999999999998 112.247 172.689 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.21 -16.99 63.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 129.4 3.08 . . . . 3.1499999999999999 112.74 -175.303 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -58.47 -59.27 5.63 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.466 1.106 . . . . 4.2800000000000002 110.812 175.335 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -55.33 -47.67 75.32 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.567 -0.708 . . . . 2.9399999999999999 111.152 -178.473 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -62.56 -47.01 85.72 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.485 0.55 . . . . 0.58999999999999997 112.485 -178.365 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.3 t -69.78 -39.61 76.55 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.503 0.721 . . . . 2.6400000000000001 111.758 -179.538 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 44.2 mt -58.1 -46.13 86.05 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 118.001 -0.999 . . . . 1.8400000000000001 111.85 175.442 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 20.9 mm -50.56 -37.26 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 CA-C-N 119.549 1.068 . . . . 2.1299999999999999 112.775 -178.007 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.01 -20.07 47.74 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 119.686 1.13 . . . . 0.95999999999999996 114.189 176.258 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.99 0.78 82.12 Favored Glycine 0 CA--C 1.532 1.124 0 O-C-N 120.743 -1.445 . . . . 0.96999999999999997 114.48 175.32 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -134.72 -45.44 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 126.193 1.797 . . . . 2.3399999999999999 110.668 174.752 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 95.5 m -76.18 71.3 2.9 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.677 1.991 . . . . 2.0 107.131 163.024 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -149.77 -77.98 0.02 OUTLIER Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.212 1.387 . . . . 1.0600000000000001 111.077 -179.711 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -62.23 -34.14 79.21 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 123.227 2.618 . . . . 1.46 113.617 -176.634 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -82.95 0.06 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 114.549 1.314 . . . . 2.4700000000000002 114.549 179.839 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -35.88 -61.06 0.5 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.329 2.651 . . . . 3.2400000000000002 115.756 -176.158 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.51 -40.33 65.33 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.024 -1.047 . . . . 5.2599999999999998 111.719 176.296 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.3 tt -66.73 -42.29 86.52 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.432 0.693 . . . . 2.98 109.898 -176.704 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.7 mt -51.29 -54.5 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.0 0.92 . . . . 3.7599999999999998 110.2 169.788 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -41.08 96.21 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.614 -0.679 . . . . 2.9900000000000002 112.733 -179.606 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -93.63 0.66 56.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.951 0.901 . . . . 3.4199999999999999 112.666 -169.051 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -29.82 70.3 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 125.821 1.649 . . . . 5.7199999999999998 112.501 163.856 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.09 8.09 2.3 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.415 1.086 . . . . 3.8399999999999999 111.957 171.529 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.58 -61.16 1.55 Allowed 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.947 1.299 . . . . 4.21 109.644 174.754 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.57 11.36 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 131.417 3.887 . . . . 8.1600000000000001 116.873 170.886 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.9 t -163.76 25.61 0.08 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.417 1.487 . . . . 6.0199999999999996 110.687 -167.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.6 t -113.97 18.14 17.44 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.469 1.108 . . . . 7.5 113.673 -177.271 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.253 1.258 1 C-N-CA 132.316 4.246 . . . . 10.01 108.426 -177.494 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 45.3 m . . . . . 0 N--CA 1.471 0.575 0 N-CA-C 108.759 -0.83 . . . . 8.1699999999999999 108.759 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -64.26 -119.91 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 108.226 -1.027 . . . . 6.8799999999999999 108.226 133.105 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 34.7 t -94.64 -99.37 0.15 Allowed 'General case' 0 CA--C 1.543 0.697 0 O-C-N 120.794 -1.191 . . . . 4.5999999999999996 111.241 165.831 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 63.47 97.97 0.04 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 127.604 2.362 . . . . 3.52 110.28 -155.524 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 20.8 p -71.11 163.38 27.72 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.468 1.507 . . . . 2.2200000000000002 111.458 -173.892 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.51 -34.73 78.95 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 117.875 -1.059 . . . . 2.98 112.621 178.857 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.09 -50.2 64.89 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.971 1.26 . . . . 2.0099999999999998 109.119 172.621 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -67.51 -54.02 23.63 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.158 0.799 . . . . 2.54 113.158 -176.194 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -57.42 -30.55 65.07 Favored 'General case' 0 C--O 1.225 -0.187 0 O-C-N 120.759 -1.213 . . . . 5.2999999999999998 113.215 172.313 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.36 -43.09 78.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 118.211 -0.899 . . . . 1.6200000000000001 112.326 169.134 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 77.2 t -54.95 -36.12 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 120.353 1.433 . . . . 1.8899999999999999 110.452 167.267 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . 0.265 34.7 mt -60.9 -60.27 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 117.085 -1.436 . . . . 2.1200000000000001 112.129 166.972 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 21.9 t -51.74 -38.56 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 121.124 1.784 . . . . 1.6799999999999999 112.576 -179.685 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 9.8 mp -63.62 -36.74 84.8 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.096 -1.002 . . . . 1.97 111.895 173.424 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 72.3 t -90.22 -29.55 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 117.4 -1.286 . . . . 2.2000000000000002 112.456 -177.708 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -53.01 -50.44 64.21 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 121.359 1.89 . . . . 3.29 108.724 157.684 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 26.9 t30 -65.22 -25.16 67.57 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.837 1.051 . . . . 2.1600000000000001 113.837 -173.447 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -77.48 -50.13 13.29 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 120.963 -1.086 . . . . 3.8300000000000001 112.242 165.369 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -64.87 -27.13 68.66 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 117.134 -1.413 . . . . 4.0899999999999999 113.788 -170.148 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 2.6 ptmt -52.63 -32.83 43.8 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 121.841 2.11 . . . . 2.6699999999999999 112.911 174.792 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -73.32 -23.87 60.31 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.43 1.27 . . . . 3.5299999999999998 114.43 179.252 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 31.3 m -100.7 -14.94 7.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 CA-C-N 119.067 0.849 . . . . 3.7000000000000002 112.99 170.46 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 6.6 m 68.84 -53.36 0.57 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 129.759 3.224 . . . . 5.4699999999999998 112.846 -172.883 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 1.7 mmtm 163.39 -33.1 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 129.056 2.943 . . . . 6.8200000000000003 111.959 -160.526 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -130.78 -21.0 2.79 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.719 1.748 . . . . 8.0199999999999996 115.719 -167.914 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 15.6 m -70.39 -44.17 68.55 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 120.882 -1.136 . . . . 7.4699999999999998 111.672 -176.78 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 92.8 mt 57.9 -68.86 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 129.698 3.199 . . . . 7.6699999999999999 114.378 167.301 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -160.9 -23.82 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 128.43 2.692 . . . . 4.5899999999999999 111.231 179.142 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 133' ' ' LYS . . . . . 0.432 ' HE2' ' O ' ' B' ' 133' ' ' LYS . 0.0 OUTLIER -54.44 -26.57 31.66 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.23 -0.919 . . . . 9.5299999999999994 113.016 161.974 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -138.66 80.82 1.81 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.753 1.263 . . . . 7.5199999999999996 111.687 156.059 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.65 152.23 44.68 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 127.25 2.22 . . . . 7.2199999999999998 113.085 169.081 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 34.8 pt -76.19 -155.42 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 125.878 1.671 . . . . 3.8900000000000001 113.731 179.791 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 90.3 p -108.4 142.57 38.57 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 119.446 -2.034 . . . . 3.48 107.74 153.212 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . 0.4 ' CD ' ' HB3' ' B' ' 169' ' ' LEU . 20.8 mttp -67.53 -21.96 65.45 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.054 -1.029 . . . . 3.9399999999999999 110.99 179.895 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 2.9 m -50.2 -23.07 1.99 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.324 1.602 . . . . 2.8599999999999999 115.324 162.1 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 21.7 t -70.35 -34.58 72.81 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 120.309 -1.495 . . . . 2.2799999999999998 112.761 169.92 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -64.52 -44.52 90.62 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 118.299 -0.858 . . . . 3.4300000000000002 112.334 178.805 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 16.4 ptt85 -57.88 -34.04 69.35 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.681 1.128 . . . . 5.2199999999999998 110.821 172.014 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -86.75 -38.55 16.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 113.977 1.103 . . . . 2.9900000000000002 113.977 -169.144 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.6 tmm? -62.31 -37.58 86.1 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.856 -0.528 . . . . 2.0099999999999998 110.941 165.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 12.6 mt -64.81 -41.67 95.6 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 120.658 -1.276 . . . . 2.27 113.844 169.778 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 146' ' ' GLN . . . . . 0.447 ' HB2' ' HE ' ' B' ' 159' ' ' ARG . 14.3 pt20 -73.71 -19.91 60.68 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 114.05 1.13 . . . . 3.1800000000000002 114.05 -175.665 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -91.29 -68.54 0.79 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.826 2.05 . . . . 2.4500000000000002 113.005 168.954 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -65.96 -27.22 68.0 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.655 1.57 . . . . 3.6400000000000001 113.792 -167.233 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.25 6.1 42.79 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.245 1.018 . . . . 3.3399999999999999 112.87 -179.817 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -52.09 -36.68 51.57 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.773 1.768 . . . . 2.4700000000000002 115.773 -160.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -67.25 -53.02 33.83 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.11 0.868 . . . . 2.3999999999999999 112.699 -168.318 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 38.0 mtm -73.2 -23.81 60.45 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.414 1.264 . . . . 4.1100000000000003 114.414 173.565 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 8.8 tt -50.76 -38.09 45.92 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-O 118.141 -0.933 . . . . 5.6500000000000004 112.823 -160.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 50.2 m 81.58 102.81 0.06 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.235 1.814 . . . . 5.3300000000000001 112.28 172.237 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . 0.521 ' CG ' ' H ' ' B' ' 156' ' ' THR . 14.1 t70 69.8 -173.43 0.18 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.541 1.536 . . . . 4.6200000000000001 114.5 165.32 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 156' ' ' THR . . . . . 0.521 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 62.2 m -73.23 -38.61 65.97 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.939 1.696 . . . . 3.52 110.0 162.579 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.49 -45.71 89.12 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.407 1.003 . . . . 2.29 113.742 -172.692 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -72.66 -20.01 61.33 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 118.813 1.306 . . . . 4.6399999999999997 112.71 178.909 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 159' ' ' ARG . . . . . 0.447 ' HE ' ' HB2' ' B' ' 146' ' ' GLN . 38.7 mtt85 -70.4 -38.06 74.58 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 120.057 -1.652 . . . . 8.6199999999999992 112.83 167.652 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -61.97 -37.64 85.56 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.174 -0.954 . . . . 5.2000000000000002 111.26 169.596 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 161' ' ' ALA . . . . . 0.458 ' HA ' ' HE3' ' B' ' 164' ' ' LYS . . . -60.5 -38.49 84.48 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 117.668 -1.158 . . . . 2.4500000000000002 113.602 170.428 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -58.12 -48.05 81.41 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.454 1.025 . . . . 1.8400000000000001 111.84 168.6 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -61.67 -32.87 73.07 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.062 1.134 . . . . 2.2999999999999998 114.062 -177.681 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 164' ' ' LYS . . . . . 0.458 ' HE3' ' HA ' ' B' ' 161' ' ' ALA . 8.2 mtmp? -46.64 -44.63 18.57 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-O 123.131 1.443 . . . . 4.0800000000000001 113.206 171.777 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 5.6 mt -72.8 -39.7 66.47 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.199 -1.819 . . . . 1.76 111.274 -170.386 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 26.1 mm -53.66 -55.16 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 126.096 1.758 . . . . 2.1099999999999999 109.651 178.437 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -66.48 -38.4 87.22 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.254 1.022 . . . . 3.7599999999999998 112.832 -179.262 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -57.57 -15.05 6.23 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.625 1.17 . . . . 4.4699999999999998 113.939 169.19 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 169' ' ' LEU . . . . . 0.4 ' HB3' ' CD ' ' B' ' 138' ' ' LYS . 3.4 mm? -108.63 -38.93 5.53 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.686 1.194 . . . . 3.04 113.346 170.046 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -77.82 -25.57 48.92 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 119.443 -2.036 . . . . 3.9300000000000002 113.787 -177.674 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.32 -20.13 44.99 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.723 1.147 . . . . 4.5 113.782 176.09 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -159.82 20.79 0.17 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.083 1.512 . . . . 5.6100000000000003 115.083 -161.407 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.44 15.35 4.51 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 120.597 -1.314 . . . . 6.1699999999999999 113.915 171.922 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 14.3 t70 60.56 -155.05 0.36 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.701 1.6 . . . . 3.8999999999999999 110.649 177.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -94.09 15.95 62.03 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 120.278 -1.513 . . . . 2.8399999999999999 112.857 165.609 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 53.6 mmt-85 -78.02 51.41 0.97 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.099 1.45 . . . . 5.8200000000000003 112.39 -177.696 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 39.7 mt -58.04 127.71 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.212 1.005 . . . . 3.6800000000000002 110.316 -175.394 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.3 m -113.23 168.57 9.61 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.141 1.163 . . . . 3.3999999999999999 114.141 -173.21 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -63.38 -58.49 6.93 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.01 1.324 . . . . 3.1200000000000001 111.13 170.695 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -67.92 -22.45 65.06 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.246 2.219 . . . . 3.5299999999999998 111.482 -172.134 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -57.6 -58.72 7.09 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 125.56 1.544 . . . . 3.27 110.882 169.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -50.46 -50.44 52.35 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.971 -0.456 . . . . 3.6499999999999999 110.824 179.418 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.3 t-105 -62.82 -46.39 88.15 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.396 0.679 . . . . 0.63 112.762 -179.672 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.1 t -68.77 -33.89 74.64 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 118.638 0.654 . . . . 2.5099999999999998 111.387 -178.68 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 75.9 mt -61.69 -43.07 99.57 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 117.449 -1.262 . . . . 1.8799999999999999 112.143 172.065 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 46.8 mm -48.39 -43.19 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 CA-C-N 121.077 1.762 . . . . 1.8899999999999999 112.122 -179.253 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.89 -19.06 58.3 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.179 0.895 . . . . 0.66000000000000003 114.311 -179.981 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -76.78 -4.85 82.9 Favored Glycine 0 CA--C 1.534 1.241 0 O-C-N 120.776 -1.426 . . . . 0.93999999999999995 114.274 174.775 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -123.17 -45.28 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.851 1.66 . . . . 2.0699999999999998 110.188 170.686 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 92.6 m -74.64 71.91 1.93 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.983 1.713 . . . . 2.1200000000000001 107.739 165.574 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -144.43 -78.35 0.04 OUTLIER Glycine 0 CA--C 1.529 0.926 0 C-N-CA 125.535 1.54 . . . . 1.1100000000000001 111.14 178.668 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -63.77 -32.29 67.71 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.344 2.696 . . . . 1.1000000000000001 113.684 -176.894 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.4 pt -78.38 -3.13 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 114.306 1.224 . . . . 2.27 114.306 178.846 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -35.61 -64.83 0.27 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 127.704 2.402 . . . . 3.1299999999999999 115.516 -176.889 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -57.64 -33.41 68.25 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.616 -1.303 . . . . 6.0899999999999999 113.202 177.101 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 10.4 tt -70.15 -41.36 73.94 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 117.991 -1.004 . . . . 3.52 110.468 177.487 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 83.9 mt -52.58 -50.27 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 119.15 0.887 . . . . 3.5299999999999998 110.71 172.181 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -61.28 -47.1 87.55 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.964 0.906 . . . . 2.96 113.301 175.019 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -92.44 2.44 56.66 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 120.713 -1.242 . . . . 3.4900000000000002 113.257 -169.074 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -22.37 61.06 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.636 1.574 . . . . 5.1200000000000001 113.301 161.571 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -87.88 15.31 7.29 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 123.784 1.754 . . . . 3.2799999999999998 111.152 172.891 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -121.75 -67.99 0.93 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.04 1.336 . . . . 4.0499999999999998 109.062 168.118 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.52 13.34 0.2 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 129.243 3.017 . . . . 8.0299999999999994 116.873 165.012 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 45.9 t -170.92 24.01 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.088 1.755 . . . . 6.25 110.574 -166.336 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 31.1 t -108.19 7.94 27.71 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.882 1.273 . . . . 7.8700000000000001 112.857 -178.647 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 42.7 t . . . . . 0 C--O 1.256 1.41 1 C-N-CA 131.892 4.077 . . . . 10.0 108.624 -165.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.496 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 119.369 -0.348 . . . . 2.2599999999999998 110.489 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.17 150.27 4.66 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 118.914 0.779 . . . . 1.1000000000000001 111.165 -173.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -59.26 -48.59 81.06 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 118.914 0.779 . . . . 2.5800000000000001 110.301 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.67 -47.69 14.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.594 1.558 . . . . 1.04 110.941 172.718 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -74.26 -50.59 18.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 118.005 -0.997 . . . . 2.79 113.235 -173.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 mtmm -50.4 -37.89 39.96 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 120.931 1.696 . . . . 6.0199999999999996 113.48 164.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.866 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.39 -44.95 85.89 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.206 -1.378 . . . . 0.56000000000000005 111.928 175.284 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.483 ' O ' HG23 ' A' ' 16' ' ' VAL . 69.1 t -60.14 -36.14 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 CA-C-N 121.339 1.882 . . . . 0.63 110.59 172.115 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 52.6 mt -58.49 -51.99 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 O-C-N 121.179 -0.95 . . . . 0.82999999999999996 111.766 167.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.2 t -61.97 -39.58 84.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.486 1.515 . . . . 0.59999999999999998 112.019 -177.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.3 mp -63.59 -43.12 97.87 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.798 0.839 . . . . 1.01 111.187 172.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 12' ' ' VAL . 89.0 t -62.34 -41.94 93.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 118.126 -0.94 . . . . 0.68999999999999995 109.864 177.124 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -65.88 -41.68 91.28 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.111 1.323 . . . . 4.4900000000000002 114.111 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -16.52 20.28 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 120.336 -1.478 . . . . 3.5800000000000001 113.48 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -98.8 -61.59 1.35 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.767 1.627 . . . . 1.8999999999999999 113.189 166.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -60.46 -24.4 65.21 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.462 1.483 . . . . 1.8500000000000001 114.365 -171.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -46.32 -26.63 0.85 Allowed 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.094 1.316 . . . . 2.6600000000000001 113.815 167.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -91.18 7.12 42.24 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.808 2.043 . . . . 2.3700000000000001 115.99 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 N--CA 1.477 0.908 0 CA-C-N 119.711 1.141 . . . . 2.3700000000000001 109.587 170.065 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 22.9 pt . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 121.812 0.815 . . . . 2.96 111.441 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.6 t -78.74 134.7 37.04 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.571 -0.9 . . . . 2.75 108.571 159.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -55.25 -25.11 31.45 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.154 -0.966 . . . . 2.3799999999999999 112.346 172.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.6 m -61.97 -12.98 21.17 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.013 1.486 . . . . 2.9199999999999999 115.013 169.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.6 m -82.96 -23.95 33.2 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.59 1.541 . . . . 1.6899999999999999 114.273 168.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -52.76 -53.96 40.63 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.298 1.863 . . . . 2.1299999999999999 111.9 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 27.0 ptt180 -61.66 -17.17 54.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.767 2.027 . . . . 2.6299999999999999 114.874 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -101.64 -52.42 3.22 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 126.969 2.108 . . . . 3.1800000000000002 109.179 -175.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 17.1 tmm? -53.75 -36.4 62.28 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.174 1.39 . . . . 1.8899999999999999 112.535 170.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 mt -54.12 -30.06 47.36 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.027 1.331 . . . . 1.02 113.983 169.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.79 -3.69 58.05 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.416 1.007 . . . . 3.0899999999999999 112.869 176.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -56.5 2.19 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.691 1.596 . . . . 1.6000000000000001 112.346 170.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -90.46 -14.8 32.08 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.215 1.191 . . . . 3.0899999999999999 114.215 -167.234 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 mt -123.22 45.27 2.46 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.008 2.123 . . . . 1.6100000000000001 109.852 174.331 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -78.8 -21.01 48.4 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 115.343 1.608 . . . . 1.4199999999999999 115.343 -170.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.506 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 59.9 m-70 -83.43 -22.54 32.63 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 121.211 1.823 . . . . 1.6599999999999999 114.364 -168.081 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 73.6 mtm -91.6 -12.92 32.93 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.88 1.672 . . . . 1.8999999999999999 113.028 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.2 tp -99.06 117.87 34.54 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.768 1.227 . . . . 3.2999999999999998 111.016 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.7 m -159.19 -47.21 0.06 Allowed 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.569 -1.332 . . . . 5.3700000000000001 110.337 171.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -37.72 -26.78 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.631 2.772 . . . . 5.9400000000000004 115.471 160.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.7 m 71.79 -25.01 0.18 Allowed 'General case' 0 C--N 1.342 0.257 0 C-N-CA 128.758 2.823 . . . . 2.6299999999999999 112.73 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.26 -44.16 75.24 Favored Glycine 0 N--CA 1.473 1.103 0 C-N-CA 127.043 2.259 . . . . 1.8899999999999999 113.604 172.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -55.03 -42.74 73.0 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.498 1.119 . . . . 3.4199999999999999 111.774 171.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.7 ttt-85 -68.29 -40.07 81.91 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.534 -1.354 . . . . 5.2199999999999998 113.249 170.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.1 mtmt -55.32 -29.94 59.26 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 122.16 2.255 . . . . 4.8099999999999996 112.58 173.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.42 -10.22 59.26 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.984 1.476 . . . . 1.3899999999999999 114.984 173.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -82.43 -52.89 6.45 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.796 1.238 . . . . 0.89000000000000001 111.233 162.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.89 -33.47 74.27 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.316 0.647 . . . . 2.2400000000000002 112.655 -173.271 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -54.66 -32.0 58.5 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.719 1.007 . . . . 3.0600000000000001 113.719 169.048 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.0 mt -81.16 -40.19 24.34 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.618 1.167 . . . . 1.0800000000000001 110.735 -177.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.1 mm -48.7 -55.42 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.644 1.177 . . . . 1.3600000000000001 110.66 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -66.01 -38.81 89.38 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.417 1.087 . . . . 1.8700000000000001 113.174 -177.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -32.82 70.61 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.873 1.269 . . . . 3.1899999999999999 112.699 170.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.77 -41.57 14.0 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.142 0.977 . . . . 2.5299999999999998 110.593 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -47.95 -48.4 32.14 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.263 1.425 . . . . 2.73 112.111 172.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -53.51 -22.19 7.69 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.873 1.434 . . . . 2.0600000000000001 114.873 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.1 m-80 -113.81 5.62 16.39 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.066 1.346 . . . . 2.6800000000000002 113.539 -175.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 38.2 t-80 -149.16 101.68 3.17 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 117.216 2.302 . . . . 3.6899999999999999 117.216 -153.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -20.75 3.24 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 128.239 2.616 . . . . 4.6200000000000001 115.341 170.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 95.87 22.9 19.39 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 118.84 -0.978 . . . . 2.8599999999999999 113.015 -166.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 58.9 mmt-85 -75.45 88.18 2.63 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.608 1.704 . . . . 4.4500000000000002 106.61 153.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.94 143.41 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 108.875 -0.787 . . . . 2.75 108.875 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.87 149.2 39.04 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.526 1.131 . . . . 1.8300000000000001 108.538 174.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.36 -38.18 88.56 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 120.1 1.318 . . . . 2.0 110.896 176.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.31 -22.83 63.64 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.924 2.09 . . . . 2.9399999999999999 113.905 175.553 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.96 -61.2 2.75 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.795 1.238 . . . . 3.6099999999999999 110.969 -178.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -56.0 -44.87 79.04 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.392 -0.818 . . . . 2.3799999999999999 112.789 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -61.72 -44.39 97.0 Favored 'General case' 0 C--O 1.239 0.552 0 O-C-N 121.844 -0.535 . . . . 0.59999999999999998 111.247 -178.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.59 -21.35 59.53 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 117.421 -1.276 . . . . 1.6100000000000001 112.804 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.8 mt -70.59 -44.22 67.78 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 120.176 1.353 . . . . 0.90000000000000002 112.662 165.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.8 mm -56.21 -37.3 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 CA-C-N 120.869 1.668 . . . . 0.69999999999999996 112.452 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.28 -14.33 63.93 Favored Glycine 0 CA--C 1.533 1.208 0 CA-C-O 118.935 -0.925 . . . . 0.83999999999999997 114.502 178.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.02 -19.7 58.83 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-N 119.085 1.442 . . . . 0.81000000000000005 113.901 175.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.4 mp -90.76 -44.97 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 118.524 1.162 . . . . 1.1100000000000001 109.509 167.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.2 m -76.4 85.78 3.15 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 107.595 -1.261 . . . . 1.25 107.595 -178.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -167.79 -75.82 0.04 OUTLIER Glycine 0 CA--C 1.532 1.098 0 CA-C-O 117.918 -1.49 . . . . 0.89000000000000001 113.993 -170.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -59.91 -44.48 30.05 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 123.134 2.556 . . . . 1.0 111.496 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.8 pt -76.27 -12.73 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 114.487 1.292 . . . . 1.51 114.487 169.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.84 -49.09 77.86 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.788 1.631 . . . . 1.1299999999999999 112.599 -175.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -50.49 68.95 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.078 0.854 . . . . 3.4100000000000001 112.051 170.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.9 tt -53.75 -39.05 65.02 Favored 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 125.273 1.429 . . . . 1.45 112.399 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 80.4 mt -55.82 -63.22 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 119.623 1.101 . . . . 1.03 111.068 171.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -53.49 -30.48 41.34 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 118.596 0.635 . . . . 1.8 112.63 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -83.8 -21.03 32.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.45 1.1 . . . . 3.2400000000000002 112.54 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 -73.03 -38.15 66.63 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 120.938 -1.101 . . . . 2.29 112.13 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -69.34 0.85 4.44 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.303 1.441 . . . . 2.4500000000000002 112.798 175.028 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 . . . . . 0 N--CA 1.465 0.292 0 C-N-CA 126.229 1.811 . . . . 2.2599999999999998 111.32 179.02 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.506 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.642 0 CA-C-O 119.465 -0.302 . . . . 2.3599999999999999 110.522 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.53 150.18 7.13 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-N 118.958 0.799 . . . . 1.0800000000000001 111.371 -173.222 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -58.56 -49.21 78.27 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.458 1.026 . . . . 2.7599999999999998 110.238 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.38 -47.23 13.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.383 1.473 . . . . 1.02 111.129 172.367 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -74.71 -50.83 16.07 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 117.928 -1.034 . . . . 2.7000000000000002 113.071 -172.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -50.11 -37.0 31.91 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 120.965 1.712 . . . . 5.54 113.245 164.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.866 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.91 -41.63 82.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 117.438 -1.268 . . . . 0.57999999999999996 112.777 176.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 115' ' ' VAL . . . . . 0.477 ' O ' HG23 ' B' ' 119' ' ' VAL . 75.2 t -62.36 -37.63 79.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-N 121.122 1.783 . . . . 0.64000000000000001 110.396 170.005 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 55.8 mt -56.29 -53.42 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 119.398 0.999 . . . . 0.79000000000000004 111.197 167.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 7.5 t -61.19 -39.66 83.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 125.206 1.402 . . . . 0.54000000000000004 112.1 -176.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.5 mp -63.32 -44.49 94.81 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.128 0.876 . . . . 0.98999999999999999 111.431 172.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 119' ' ' VAL . . . . . 0.477 HG23 ' O ' ' B' ' 115' ' ' VAL . 91.0 t -62.85 -40.54 89.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 118.056 -0.974 . . . . 0.67000000000000004 109.852 178.461 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -67.52 -42.95 81.93 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.676 1.125 . . . . 4.0999999999999996 113.286 172.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.61 -18.99 23.02 Favored 'General case' 0 CA--C 1.552 1.027 0 O-C-N 120.447 -1.408 . . . . 3.6099999999999999 113.561 176.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -95.17 -63.75 1.13 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.629 1.172 . . . . 2.0 113.083 166.048 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -59.06 -23.82 62.35 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.656 1.571 . . . . 1.8300000000000001 114.833 -170.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -46.89 -25.04 0.69 Allowed 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 120.259 1.391 . . . . 2.46 113.884 167.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -93.23 8.78 38.85 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.298 2.239 . . . . 2.29 116.153 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.1 m . . . . . 0 N--CA 1.477 0.899 0 CA-C-N 120.141 1.337 . . . . 2.4300000000000002 110.146 168.447 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 9.0 pt . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 121.816 0.817 . . . . 2.98 111.475 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 32.5 t -84.99 138.35 32.52 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.7 -0.852 . . . . 2.54 108.7 163.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -58.78 -20.01 45.88 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 120.56 -1.337 . . . . 2.21 112.522 172.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 50.8 m -66.01 -16.76 64.18 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.237 1.415 . . . . 2.5800000000000001 114.586 167.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 61.6 m -80.41 -29.97 37.7 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.887 1.221 . . . . 1.2 113.098 176.256 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.411 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 70.1 t80 -50.91 -57.37 8.68 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.651 1.114 . . . . 1.8999999999999999 112.146 176.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -61.86 -17.79 57.74 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.57 1.948 . . . . 2.8599999999999999 114.606 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -97.52 -54.76 3.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.962 2.105 . . . . 3.3300000000000001 109.07 -177.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -53.31 -35.67 60.4 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.803 1.641 . . . . 1.8100000000000001 112.701 172.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.0 mt -54.31 -30.0 49.56 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.004 1.322 . . . . 1.0600000000000001 113.898 169.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.84 -3.43 56.78 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.611 1.096 . . . . 3.29 112.891 176.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.64 -57.27 2.05 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.874 1.67 . . . . 1.47 112.341 171.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -89.67 -15.78 31.89 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.682 0.993 . . . . 3.0600000000000001 113.682 -167.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.3 mt -121.97 44.98 2.44 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.334 1.854 . . . . 1.6200000000000001 110.088 174.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -79.04 -23.67 44.13 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.344 1.609 . . . . 1.3799999999999999 115.344 -169.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 151' ' ' HIS . . . . . 0.496 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 64.6 m-70 -81.3 -22.36 38.63 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 121.115 1.78 . . . . 1.6299999999999999 114.343 -167.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 73.2 mtm -91.19 -11.44 38.32 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.677 1.591 . . . . 1.97 113.102 171.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 40.0 tp -100.74 120.15 39.66 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.15 1.38 . . . . 3.2400000000000002 111.091 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 23.0 m -160.94 -47.29 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 O-C-N 120.524 -1.36 . . . . 5.1399999999999997 110.019 170.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -37.72 -27.69 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 128.995 2.918 . . . . 5.9100000000000001 115.527 161.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 100.0 m 71.71 -22.17 0.2 Allowed 'General case' 0 C--N 1.342 0.245 0 C-N-CA 128.471 2.708 . . . . 2.7999999999999998 112.969 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.84 -44.89 92.01 Favored Glycine 0 N--CA 1.471 1.008 0 C-N-CA 126.181 1.848 . . . . 1.9299999999999999 113.038 171.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -54.97 -41.34 71.05 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.823 1.249 . . . . 3.4300000000000002 111.731 172.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.6 ttt-85 -68.9 -41.36 78.36 Favored 'General case' 0 C--N 1.345 0.374 0 O-C-N 120.482 -1.387 . . . . 4.8700000000000001 113.121 170.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 19.5 mtmt -57.37 -26.49 61.1 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 121.65 2.023 . . . . 3.9900000000000002 112.885 173.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -74.54 -11.0 60.09 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.853 1.427 . . . . 1.4099999999999999 114.853 172.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.13 -56.89 3.52 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.307 1.443 . . . . 0.89000000000000001 111.145 163.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -34.18 69.0 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 113.255 0.835 . . . . 2.23 113.255 -176.565 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -55.14 -32.2 61.91 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 121.047 -1.033 . . . . 3.1200000000000001 113.765 170.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 165' ' ' LEU . . . . . 0.45 HD11 ' HA3' ' B' ' 188' ' ' GLY . 17.3 mt -79.97 -40.09 28.73 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.254 1.022 . . . . 1.0700000000000001 110.416 -176.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 39.6 mm -49.74 -54.42 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.101 1.36 . . . . 1.3100000000000001 110.733 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -65.4 -37.85 88.2 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.517 1.127 . . . . 1.8899999999999999 113.369 -178.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -34.18 74.36 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.1 1.36 . . . . 3.1400000000000001 112.988 170.101 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.81 -41.0 18.01 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.738 1.215 . . . . 2.6499999999999999 110.282 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -51.39 -46.61 62.88 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.676 1.59 . . . . 2.6499999999999999 112.817 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -55.22 -20.71 11.53 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.72 1.378 . . . . 2.1400000000000001 114.72 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -112.64 4.57 17.29 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.021 1.328 . . . . 2.71 113.459 -176.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -151.51 100.71 2.74 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 117.52 2.415 . . . . 3.48 117.52 -153.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -19.08 4.1 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.49 2.716 . . . . 4.6399999999999997 115.793 171.335 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 96.15 26.46 11.25 Favored Glycine 0 CA--C 1.53 0.987 0 CA-C-O 118.915 -0.936 . . . . 2.9500000000000002 113.087 -167.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 54.3 mmt-85 -78.63 84.16 4.76 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.35 1.575 . . . . 4.5 107.154 154.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 11.3 mt -62.05 132.59 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 CA-C-N 118.795 0.725 . . . . 2.8599999999999999 109.324 -173.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 21.2 m -94.39 158.45 15.56 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 122.012 -0.43 . . . . 1.5600000000000001 110.33 166.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -63.63 -37.86 88.95 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 119.521 -0.872 . . . . 2.0 111.474 166.592 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -21.63 65.53 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.652 1.581 . . . . 2.9399999999999999 114.266 177.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -62.43 -59.21 5.3 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.94 0.896 . . . . 3.4900000000000002 110.933 -177.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -54.51 -46.81 73.57 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.437 -0.789 . . . . 2.5 112.856 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 40.7 t-105 -61.96 -45.72 92.43 Favored 'General case' 0 C--O 1.239 0.542 0 O-C-N 121.998 -0.439 . . . . 0.62 111.078 -176.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -72.27 -23.19 61.16 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-O 117.317 -1.325 . . . . 1.6100000000000001 112.436 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.411 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 30.9 mt -69.91 -42.61 73.14 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 120.081 1.31 . . . . 0.84999999999999998 112.844 167.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 32.2 mm -56.81 -36.08 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 CA-C-N 120.928 1.694 . . . . 0.66000000000000003 112.497 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.21 -19.16 67.99 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.043 -0.865 . . . . 0.69999999999999996 114.077 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 188' ' ' GLY . . . . . 0.45 ' HA3' HD11 ' B' ' 165' ' ' LEU . . . -80.84 -20.55 65.35 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-N 119.356 1.578 . . . . 0.84999999999999998 113.751 176.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.2 mp -90.86 -43.21 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 CA-C-N 118.497 1.149 . . . . 1.1100000000000001 110.25 168.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 4.1 m -78.13 83.89 4.38 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 107.86 -1.163 . . . . 1.3100000000000001 107.86 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -165.31 -74.55 0.03 OUTLIER Glycine 0 CA--C 1.533 1.16 0 CA-C-O 118.128 -1.373 . . . . 0.88 114.109 -172.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.68 -42.55 38.34 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.158 2.572 . . . . 1.02 111.617 176.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.9 pt -77.11 -12.4 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 114.93 1.456 . . . . 1.5700000000000001 114.93 169.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.45 -52.17 66.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.75 1.614 . . . . 1.0900000000000001 112.605 -175.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.66 -48.8 69.09 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.523 -0.736 . . . . 3.5099999999999998 112.284 170.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 10.2 tt -56.52 -37.64 70.73 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 125.318 1.447 . . . . 1.7 111.979 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 75.4 mt -56.56 -61.94 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 119.648 1.113 . . . . 1.0 111.069 169.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -55.71 -28.42 55.6 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.726 -0.609 . . . . 1.8799999999999999 112.585 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -83.66 -23.76 31.63 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.33 1.052 . . . . 3.1200000000000001 112.35 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -76.55 -42.31 43.45 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.961 1.305 . . . . 2.25 112.838 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.58 3.01 6.79 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 122.659 1.219 . . . . 2.5699999999999998 112.548 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -120.23 -57.8 1.91 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 126.959 2.103 . . . . 2.6800000000000002 110.572 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.28 6.5 pt20 . . . . . 0 N--CA 1.476 0.85 0 C-N-CA 130.678 3.591 . . . . 5.1900000000000004 115.506 171.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.1 m-30 . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 111.809 0.3 . . . . 2.2999999999999998 111.809 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.2 t -76.26 134.83 39.69 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 108.184 -1.043 . . . . 2.0800000000000001 108.184 153.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -61.7 -28.66 69.57 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 122.683 0.393 . . . . 2.9300000000000002 110.638 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.03 -40.82 67.41 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.541 -0.725 . . . . 1.01 110.991 175.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -67.16 -61.3 1.99 Allowed 'General case' 0 C--N 1.337 0.058 0 O-C-N 121.909 -0.494 . . . . 2.5299999999999998 109.971 176.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.4 tptt -54.56 -26.94 35.33 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.416 1.265 . . . . 5.71 114.416 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.794 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -73.7 -44.5 56.36 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.258 1.423 . . . . 0.71999999999999997 112.254 170.372 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 77.6 t -59.46 -39.53 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 120.547 1.521 . . . . 0.84999999999999998 110.025 168.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.5 mt -55.57 -50.42 66.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-O 117.689 -1.148 . . . . 0.80000000000000004 110.516 170.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.7 t -58.43 -40.68 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-N 120.42 1.464 . . . . 0.55000000000000004 111.685 178.174 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.23 -51.53 65.86 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.071 0.85 . . . . 0.93999999999999995 111.914 173.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.1 t -60.63 -46.8 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.5 1.52 . . . . 0.82999999999999996 112.883 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -66.6 -44.34 82.41 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 3.3300000000000001 110.111 -176.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.5 t30 -65.59 -34.66 78.76 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.085 0.772 . . . . 3.0 113.085 177.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -63.63 -50.65 68.51 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 120.556 -1.34 . . . . 2.2599999999999998 112.459 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -63.34 -42.91 98.98 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 117.491 -1.242 . . . . 2.4399999999999999 113.037 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.8 ptmt -63.0 -29.58 70.94 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.251 1.841 . . . . 4.7000000000000002 112.932 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -74.5 -49.23 22.96 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.043 -1.036 . . . . 2.6299999999999999 112.719 172.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.4 t . . . . . 0 N--CA 1.48 1.054 0 CA-C-N 119.371 0.987 . . . . 3.6600000000000001 112.903 -179.401 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.4 tt . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 108.236 -1.024 . . . . 2.52 108.236 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.4 m -118.05 156.3 28.84 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.402 -0.811 . . . . 2.5499999999999998 110.825 164.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -64.96 -19.27 65.88 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.237 -1.539 . . . . 2.0099999999999998 113.145 -177.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.1 p -65.34 -28.96 69.66 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.112 1.365 . . . . 1.8899999999999999 114.079 164.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.9 m -68.3 -30.78 69.86 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.383 -1.448 . . . . 1.1599999999999999 112.815 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.443 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 14.4 t80 -59.24 -57.86 11.16 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 120.579 1.536 . . . . 2.1600000000000001 111.819 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -55.27 -25.06 31.51 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.589 1.155 . . . . 2.2999999999999998 112.152 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.405 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 26.2 mt-10 -90.34 -50.13 6.14 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 125.774 1.629 . . . . 3.79 112.662 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 59.7 ttp -45.37 -45.57 12.64 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 124.12 0.968 . . . . 2.4100000000000001 110.243 162.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.1 mt -58.16 -50.49 73.33 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 125.264 1.426 . . . . 1.21 112.732 171.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -20.86 59.78 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 120.427 1.467 . . . . 3.0 113.972 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 1.4 mppt? -87.41 -48.55 7.87 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.778 1.231 . . . . 2.8500000000000001 110.237 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -74.64 -74.35 0.2 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.267 1.027 . . . . 3.8199999999999998 111.615 171.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.0 mt -74.77 32.68 0.09 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.69 1.596 . . . . 2.48 113.422 -173.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -59.25 -22.79 61.66 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.675 1.59 . . . . 1.6299999999999999 113.47 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -77.5 -62.55 1.62 Allowed 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.181 0.901 . . . . 1.6699999999999999 110.279 -178.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 6.8 ptp -62.23 -29.87 70.7 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.583 1.083 . . . . 3.2000000000000002 113.362 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.83 -61.62 1.79 Allowed 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.88 -0.785 . . . . 3.2200000000000002 108.88 170.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.9 m 54.86 -82.52 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.09 1.756 . . . . 4.7400000000000002 111.45 -169.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.2 161.12 24.13 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.7 2.0 . . . . 3.7999999999999998 113.97 -174.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.5 m -69.61 -23.81 63.57 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.864 1.666 . . . . 2.6099999999999999 112.377 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.86 -52.17 54.56 Favored Glycine 0 N--CA 1.471 1.018 0 C-N-CA 126.188 1.851 . . . . 1.53 112.784 173.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -61.5 -27.0 68.28 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.052 0.541 . . . . 3.48 112.15 172.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 94.0 mtm-85 -80.74 -17.06 52.23 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 114.055 1.132 . . . . 6.1200000000000001 114.055 170.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt -66.45 -36.05 81.82 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 119.055 -2.278 . . . . 3.6800000000000002 110.918 169.068 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.8 -18.74 34.84 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 114.859 1.429 . . . . 1.03 114.859 163.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -80.72 -53.26 6.67 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 119.913 1.233 . . . . 0.85999999999999999 110.896 166.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -57.44 -40.55 78.69 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.889 1.275 . . . . 2.7999999999999998 113.873 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.0 ptmt -53.3 -30.96 41.62 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.905 0.882 . . . . 3.1600000000000001 112.542 178.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 30.1 mt -80.21 -44.69 19.31 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 118.503 -0.761 . . . . 0.73999999999999999 111.067 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 6.2 mm -54.47 -48.14 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-O 118.624 -0.703 . . . . 0.79000000000000004 109.783 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -67.36 -28.76 68.22 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 114.162 1.171 . . . . 1.76 114.162 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -73.89 -35.52 64.7 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.307 0.643 . . . . 3.6299999999999999 112.244 171.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -72.43 -29.08 63.38 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.607 1.163 . . . . 2.3599999999999999 111.515 172.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -62.52 -21.6 65.66 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.83 1.652 . . . . 3.4199999999999999 113.355 175.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.15 -10.91 59.78 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.748 1.388 . . . . 1.9299999999999999 114.748 169.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -135.99 -34.28 0.81 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 116.206 1.928 . . . . 2.3500000000000001 116.206 -166.356 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.6 m170 -115.64 115.89 27.16 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.421 -1.425 . . . . 4.0199999999999996 112.105 -170.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -140.95 152.88 45.33 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.187 1.395 . . . . 5.8200000000000003 110.342 162.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.32 -41.6 0.78 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 127.309 2.385 . . . . 2.9100000000000001 114.353 -177.228 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.3 mmt85 -98.41 139.92 33.44 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 127.949 2.5 . . . . 5.3799999999999999 111.414 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 45.3 mm -101.41 145.67 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 N-CA-C 107.803 -1.184 . . . . 2.1000000000000001 107.803 148.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 t -101.62 152.93 20.22 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.518 -0.739 . . . . 1.5 111.759 169.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -58.23 -51.66 68.84 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.021 0.828 . . . . 2.4300000000000002 110.96 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -61.06 -15.14 29.16 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.119 1.368 . . . . 3.21 112.565 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -64.51 -57.85 8.03 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.468 1.107 . . . . 3.0499999999999998 111.963 -174.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.56 -42.32 78.39 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.012 -1.68 . . . . 2.02 111.768 176.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 30.0 t-105 -63.96 -48.54 76.06 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 119.247 -0.406 . . . . 0.68999999999999995 111.907 -177.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 36.5 p -62.59 -44.71 95.62 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.777 1.231 . . . . 2.7200000000000002 111.064 175.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.443 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 93.3 mt -62.28 -38.69 90.31 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 118.389 -0.815 . . . . 0.80000000000000004 112.852 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 23.3 mm -55.22 -46.67 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 CA-C-N 120.397 1.453 . . . . 0.93000000000000005 111.585 175.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.55 -29.23 72.93 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 119.458 -0.634 . . . . 0.82999999999999996 113.186 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.42 -22.82 77.79 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-O 118.676 -1.069 . . . . 0.58999999999999997 114.163 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.7 mp -88.24 -47.62 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 118.959 1.38 . . . . 0.90000000000000002 110.323 162.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.6 m -75.97 31.89 0.12 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 127.017 2.127 . . . . 1.77 112.355 -169.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.61 -85.39 1.16 Allowed Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.3 0.952 . . . . 0.98999999999999999 111.095 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -64.23 -36.16 47.93 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.743 2.295 . . . . 1.51 111.974 -176.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.62 -17.63 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 113.579 0.955 . . . . 1.1799999999999999 113.579 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.54 -44.31 94.55 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 120.037 1.289 . . . . 1.0700000000000001 112.846 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.25 -36.83 84.96 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 120.753 -1.217 . . . . 3.3199999999999998 110.643 176.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.32 -46.87 88.38 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.579 1.152 . . . . 1.1299999999999999 111.355 173.434 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 83.4 mt -50.69 -58.87 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.732 0.813 . . . . 1.1499999999999999 110.636 172.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -63.92 -37.13 86.29 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.859 -0.526 . . . . 1.9099999999999999 112.251 -176.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.291 3.9 pt-20 -76.83 -13.99 59.95 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.041 -1.037 . . . . 3.0499999999999998 112.239 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.61 -29.18 30.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.44 1.896 . . . . 2.46 114.643 167.435 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -76.23 3.94 9.74 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 123.104 1.43 . . . . 2.4399999999999999 111.995 173.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 . . . . . 0 C--N 1.327 -0.413 0 C-N-CA 126.119 1.768 . . . . 2.6000000000000001 111.06 -175.906 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 111.783 0.29 . . . . 2.27 111.783 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 7.2 t -75.4 137.64 41.17 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.093 -1.077 . . . . 2.0600000000000001 108.093 153.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -60.77 -28.67 68.9 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 122.568 0.347 . . . . 2.8599999999999999 110.573 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -39.25 69.42 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.131 -0.981 . . . . 1.1399999999999999 111.006 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -68.43 -60.67 2.27 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-O 119.319 -0.372 . . . . 2.5499999999999998 110.359 176.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -55.87 -27.24 50.83 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.341 1.237 . . . . 6.5099999999999998 114.341 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.794 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -72.14 -45.61 59.84 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.193 1.397 . . . . 0.81000000000000005 111.821 169.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 63.2 t -59.63 -39.62 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-N 120.892 1.678 . . . . 0.85999999999999999 110.442 170.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 10.6 mt -53.9 -50.21 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-O 117.605 -1.188 . . . . 0.79000000000000004 110.962 169.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 3.7 t -59.07 -43.23 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.072 1.306 . . . . 0.55000000000000004 111.671 178.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.3 mp -61.25 -45.76 93.2 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.06 0.845 . . . . 1.03 111.615 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 38.6 t -66.89 -44.38 88.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.262 1.425 . . . . 0.71999999999999997 113.141 178.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -66.43 -42.17 88.12 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.346 1.058 . . . . 3.1299999999999999 110.359 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -62.76 -31.02 71.89 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.625 0.972 . . . . 2.6299999999999999 113.625 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -71.32 -55.32 8.26 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.478 -1.389 . . . . 2.3599999999999999 111.949 176.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -61.13 -39.6 90.63 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.86 -1.15 . . . . 2.4100000000000001 113.191 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.65 -32.43 72.59 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.179 1.354 . . . . 4.5899999999999999 112.798 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -76.32 -43.62 40.41 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.76 -1.213 . . . . 2.52 112.128 172.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 54.0 t . . . . . 0 N--CA 1.481 1.089 0 C-N-CA 124.462 1.105 . . . . 3.5800000000000001 113.173 -177.452 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.5 tt . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 107.476 -1.305 . . . . 2.5899999999999999 107.476 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 66.8 m -142.96 161.36 38.32 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 119.769 -1.832 . . . . 2.5899999999999999 110.198 173.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -68.4 -20.7 64.69 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 120.907 -1.12 . . . . 2.0800000000000001 112.806 -175.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 7.8 p -66.77 -31.25 71.77 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.262 1.425 . . . . 1.95 113.371 164.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 6.1 m -67.51 -35.56 79.34 Favored 'General case' 0 C--O 1.225 -0.229 0 O-C-N 120.574 -1.329 . . . . 1.29 112.344 -177.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.455 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 12.9 t80 -57.72 -58.8 6.74 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 119.606 1.094 . . . . 1.95 111.434 -177.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -54.81 -26.07 32.44 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.618 1.167 . . . . 2.1600000000000001 112.373 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 143' ' ' GLU . . . . . 0.405 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 24.6 mt-10 -90.38 -50.88 5.71 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 125.739 1.616 . . . . 3.54 112.703 -174.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 63.5 ttp -45.53 -45.14 13.19 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 124.247 1.019 . . . . 2.6200000000000001 110.176 162.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 5.3 mt -57.85 -50.48 73.16 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 125.281 1.432 . . . . 1.27 112.759 170.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -75.12 -21.96 58.51 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.411 1.46 . . . . 3.1299999999999999 114.139 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 147' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 1.5 mppt? -85.02 -49.43 8.3 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.895 1.278 . . . . 2.6000000000000001 110.068 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -74.27 -74.23 0.2 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.092 0.957 . . . . 3.8500000000000001 111.442 172.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 10.7 mt -75.11 33.61 0.1 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.946 1.699 . . . . 2.5600000000000001 113.214 -173.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -59.01 -23.03 61.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.641 1.576 . . . . 1.51 113.286 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -79.34 -61.42 2.01 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.226 0.921 . . . . 1.6299999999999999 110.687 -177.503 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 ptp -63.14 -26.73 68.95 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.564 1.075 . . . . 3.2200000000000002 113.848 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.08 -62.25 1.46 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.433 0.561 . . . . 3.2400000000000002 109.696 167.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 32.3 m 56.75 -82.13 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.894 1.678 . . . . 4.6399999999999997 111.995 -169.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -85.22 161.65 19.5 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.368 1.867 . . . . 3.8999999999999999 113.779 -170.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 44.0 m -70.8 -25.58 62.93 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 125.684 1.594 . . . . 2.9199999999999999 112.164 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -59.01 -52.62 52.31 Favored Glycine 0 N--CA 1.469 0.889 0 C-N-CA 126.204 1.859 . . . . 1.71 112.345 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -60.34 -30.75 69.73 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.208 -0.584 . . . . 3.6299999999999999 112.101 172.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -77.61 -15.85 58.96 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 120.915 -1.116 . . . . 6.1399999999999997 113.878 171.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -65.54 -35.55 81.19 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 119.165 -2.209 . . . . 3.8999999999999999 111.192 169.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.61 -19.23 36.87 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 114.901 1.445 . . . . 1.01 114.901 164.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.69 -54.0 6.28 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.632 1.106 . . . . 0.90000000000000002 111.151 166.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -57.57 -40.41 78.91 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.487 1.115 . . . . 2.71 113.468 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -52.9 -32.71 46.68 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.897 0.879 . . . . 3.2200000000000002 112.456 178.184 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 39.7 mt -77.98 -45.14 24.65 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 118.708 -0.663 . . . . 0.73999999999999999 110.543 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.81 -47.83 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.36 -0.829 . . . . 0.80000000000000004 109.575 -177.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -66.84 -32.38 73.62 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.961 1.097 . . . . 1.76 113.961 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -69.22 -35.71 76.47 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.555 -0.716 . . . . 3.75 112.003 171.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -74.28 -28.54 61.24 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.829 1.252 . . . . 2.6499999999999999 111.943 173.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -63.73 -21.48 66.42 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.095 1.758 . . . . 3.48 113.266 175.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.57 -9.42 59.78 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.701 1.371 . . . . 1.95 114.701 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -136.34 -35.02 0.76 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.104 1.89 . . . . 2.3700000000000001 116.104 -166.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -109.54 108.1 18.44 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.47 -1.394 . . . . 3.9100000000000001 111.469 -174.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -121.04 156.32 32.45 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.32 1.448 . . . . 5.1399999999999997 110.309 161.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 64.91 -5.13 1.33 Allowed Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.647 1.594 . . . . 3.1600000000000001 116.615 169.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 21.8 mmt85 -144.88 152.73 40.69 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 126.902 2.081 . . . . 5.1100000000000003 111.214 -165.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 32.7 mm -122.01 150.18 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.528 1.531 . . . . 2.3199999999999998 107.44 156.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.3 t -108.03 157.97 17.79 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.632 0.773 . . . . 1.5800000000000001 112.226 169.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -60.01 -50.86 72.06 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 121.109 -0.995 . . . . 2.3100000000000001 111.353 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -61.7 -16.24 47.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.796 1.238 . . . . 3.3900000000000001 112.637 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -64.2 -55.25 22.98 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.115 0.966 . . . . 2.9700000000000002 112.188 -175.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -57.22 -44.17 83.48 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.185 -1.572 . . . . 2.0600000000000001 111.848 175.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -64.01 -48.04 77.92 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 119.258 -0.401 . . . . 0.69999999999999996 112.031 -177.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 40.3 p -62.42 -44.52 96.22 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.659 1.184 . . . . 2.6800000000000002 111.286 175.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.455 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 93.8 mt -62.91 -38.8 92.42 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 118.164 -0.922 . . . . 0.69999999999999996 112.599 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 23.2 mm -54.36 -46.18 69.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 CA-C-N 120.514 1.506 . . . . 0.89000000000000001 111.389 174.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.46 -29.1 72.4 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 118.569 0.622 . . . . 0.77000000000000002 113.035 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.69 -22.49 78.68 Favored Glycine 0 CA--C 1.535 1.304 0 CA-C-O 118.651 -1.083 . . . . 0.59999999999999998 114.264 178.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.6 mp -87.29 -48.67 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 CA-C-N 119.132 1.466 . . . . 0.93999999999999995 109.879 162.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 2.6 m -75.38 33.62 0.11 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 127.209 2.204 . . . . 1.6799999999999999 111.913 -169.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -88.95 -87.17 1.24 Allowed Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.54 1.067 . . . . 0.97999999999999998 110.758 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.78 -34.29 62.08 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.799 2.333 . . . . 1.45 111.954 -175.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.29 -20.98 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 118.703 -0.665 . . . . 1.1699999999999999 112.764 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.01 87.71 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 120.159 1.345 . . . . 1.0 112.911 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.37 -36.83 83.5 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 120.825 -1.172 . . . . 3.3199999999999998 110.231 177.118 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -46.68 88.54 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.751 1.221 . . . . 1.49 111.886 173.693 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 77.8 mt -50.61 -59.35 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.9 0.88 . . . . 1.1799999999999999 110.515 171.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -65.02 -35.95 82.83 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.935 -0.478 . . . . 1.8500000000000001 112.269 -175.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.264 4.3 pt-20 -77.08 -15.89 59.41 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 117.951 -1.024 . . . . 3.2799999999999998 112.139 177.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -81.12 -32.04 33.98 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.944 1.697 . . . . 2.3999999999999999 114.392 168.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -73.47 5.04 4.07 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 123.212 1.482 . . . . 2.3100000000000001 112.177 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -134.29 -61.46 0.78 Allowed 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 126.644 1.977 . . . . 2.6000000000000001 111.24 -174.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.919 0 C-N-CA 129.202 3.001 . . . . 4.3200000000000003 115.729 163.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 120.989 0.423 . . . . 2.5699999999999998 112.029 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 47.3 p -81.23 155.41 26.13 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 121.323 -0.861 . . . . 1.3 109.792 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -61.21 -35.44 77.2 Favored 'General case' 0 C--O 1.223 -0.307 0 O-C-N 120.556 -1.34 . . . . 2.1299999999999999 111.641 -177.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -49.56 76.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.507 1.523 . . . . 0.91000000000000003 110.9 174.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -69.0 -53.06 22.55 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.217 1.807 . . . . 2.7400000000000002 111.27 -177.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.07 -34.82 45.42 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.256 1.022 . . . . 5.4800000000000004 110.356 169.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.832 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -77.04 -39.28 50.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 117.343 -1.313 . . . . 0.46000000000000002 112.992 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.7 t -52.72 -45.28 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 121.111 1.778 . . . . 0.60999999999999999 110.719 164.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.06 -50.55 77.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.124 0.874 . . . . 0.79000000000000004 111.148 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.9 t -60.07 -34.95 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.63 1.172 . . . . 0.53000000000000003 112.702 176.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 mp -72.09 -43.03 65.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.8 1.182 . . . . 0.93999999999999995 110.967 174.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.3 t -58.6 -45.7 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 125.456 1.503 . . . . 0.56999999999999995 110.99 173.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.3 tm-20 -67.01 -45.76 76.57 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.867 1.267 . . . . 2.8999999999999999 111.12 174.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.429 ' HA ' ' HD2' ' A' ' 21' ' ' LYS 0.285 1.5 t30 -71.1 -7.32 45.69 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 115.143 1.534 . . . . 2.8300000000000001 115.143 179.244 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -82.82 -66.79 0.85 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.547 0.739 . . . . 2.2400000000000002 111.892 153.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -59.73 -32.8 70.88 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.266 1.21 . . . . 2.1099999999999999 114.266 -167.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.429 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 10.0 ptmt -54.76 -25.88 30.68 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 119.723 -1.861 . . . . 2.5 113.756 175.379 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -82.66 -1.36 50.88 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.719 1.377 . . . . 2.79 114.719 178.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.476 0.836 0 CA-C-N 119.84 1.2 . . . . 3.8500000000000001 109.808 170.016 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.4 tt . . . . . 0 CA--C 1.548 0.878 0 N-CA-C 109.374 -0.602 . . . . 2.7999999999999998 109.374 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.1 t -102.43 141.98 34.37 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.916 -1.115 . . . . 3.2400000000000002 109.526 164.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 73.4 mttt -61.24 -17.8 55.18 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.054 -1.654 . . . . 2.2200000000000002 113.026 174.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.3 t -61.4 -33.2 73.28 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.466 -0.771 . . . . 3.8599999999999999 112.578 166.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -65.02 -37.5 87.83 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 120.878 -1.138 . . . . 1.6399999999999999 113.185 -173.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.497 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 67.8 t80 -62.15 -54.75 36.61 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.887 1.221 . . . . 2.04 111.899 176.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 24.7 ptt180 -65.64 -5.91 9.71 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.203 1.001 . . . . 2.2200000000000002 113.187 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.414 ' HB3' ' HE2' ' A' ' 44' ' ' LYS . 6.5 mt-10 -102.27 -43.1 5.8 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 126.657 1.983 . . . . 2.8199999999999998 111.851 176.462 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 4.9 ttm -52.65 -43.29 65.4 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.766 1.27 . . . . 1.8899999999999999 109.968 168.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.497 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 72.1 mt -74.72 11.92 0.94 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 127.889 2.476 . . . . 2.2200000000000002 115.402 169.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -125.74 -11.38 6.67 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 125.7 1.6 . . . . 2.9500000000000002 113.023 166.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.414 ' HE2' ' HB3' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -109.0 -76.48 0.61 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.278 1.431 . . . . 1.8200000000000001 110.983 176.51 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.47 -19.67 66.03 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 120.624 1.557 . . . . 3.1000000000000001 115.026 -175.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.34 7.02 22.82 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.427 1.269 . . . . 1.8200000000000001 114.427 177.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -50.32 -33.9 21.82 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 117.615 2.45 . . . . 2.0699999999999998 117.615 -165.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -68.47 -25.12 64.82 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 121.102 1.773 . . . . 3.3799999999999999 112.214 -177.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.2 tpp -73.12 -7.44 51.37 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.673 1.989 . . . . 1.75 113.144 175.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.28 21.98 4.81 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.91 1.684 . . . . 3.6899999999999999 114.317 -162.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.5 t -35.31 -63.45 0.34 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 126.132 1.773 . . . . 4.4699999999999998 112.426 164.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -81.53 95.97 7.29 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 124.335 1.054 . . . . 6.1399999999999997 108.167 -177.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.2 p -51.42 -18.12 0.95 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.563 1.945 . . . . 3.4399999999999999 115.831 -168.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -58.02 -35.07 74.71 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.39 0.995 . . . . 1.72 112.63 171.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 74.1 m-80 -59.22 -38.41 79.87 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 117.83 0.815 . . . . 3.8500000000000001 111.535 172.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.94 -27.15 49.27 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 114.498 1.296 . . . . 4.9000000000000004 114.498 172.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -59.56 -37.01 77.32 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 119.546 -1.971 . . . . 3.1800000000000002 110.971 167.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.3 -11.5 42.33 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.952 1.464 . . . . 1.1200000000000001 114.952 169.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.69 -52.03 6.38 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 120.502 1.501 . . . . 0.66000000000000003 112.173 164.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.94 -35.32 76.42 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 118.951 0.796 . . . . 2.3100000000000001 112.268 -176.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -24.67 67.73 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.892 1.071 . . . . 4.6100000000000003 113.892 177.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.6 mt -73.98 -34.66 64.3 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 122.662 0.385 . . . . 0.77000000000000002 111.067 176.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 37.8 mm -58.27 -50.36 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.064 0.946 . . . . 1.01 110.982 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.36 -38.18 89.29 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.016 0.926 . . . . 2.2200000000000002 112.645 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.38 -41.51 76.34 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.845 0.858 . . . . 3.02 112.12 166.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -73.16 -40.97 64.41 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 123.437 0.695 . . . . 3.1000000000000001 111.449 -178.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -49.57 -41.99 43.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.893 1.277 . . . . 2.5600000000000001 112.723 175.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.82 -16.93 62.5 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.322 1.601 . . . . 2.1600000000000001 115.322 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -133.68 16.04 3.97 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.505 1.298 . . . . 3.7999999999999998 114.505 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -119.48 107.05 12.84 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.897 1.279 . . . . 5.0700000000000003 110.97 -174.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -73.63 0.23 13.38 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.467 1.907 . . . . 5.54 114.223 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.59 -2.43 57.31 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 117.785 -1.564 . . . . 2.8199999999999998 113.54 -167.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.532 HH11 ' HG2' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -70.89 77.03 0.64 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.134 1.967 . . . . 5.25 109.804 164.306 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -55.46 125.79 11.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 107.763 -1.199 . . . . 3.1699999999999999 107.763 164.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 36.9 t -137.31 146.19 44.34 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 124.792 1.237 . . . . 1.8200000000000001 111.594 -170.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -53.09 -41.6 65.09 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.95 1.093 . . . . 2.1800000000000002 113.95 -171.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -76.62 -14.46 59.98 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.837 0.681 . . . . 4.29 112.837 -174.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -64.84 -49.31 71.1 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.146 -0.971 . . . . 2.98 109.453 172.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -53.68 -48.18 69.73 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.261 -1.524 . . . . 2.0499999999999998 111.929 171.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 30.5 t-105 -68.97 -46.15 68.85 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.843 0.683 . . . . 0.56000000000000005 112.843 -171.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 57.5 p -59.73 -45.91 90.73 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.994 0.918 . . . . 2.5 111.027 171.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 91.6 mt -62.19 -38.46 89.21 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 117.31 -1.329 . . . . 0.59999999999999998 112.323 -179.084 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.4 mm -50.61 -44.02 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 121.294 1.861 . . . . 0.66000000000000003 111.261 174.224 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.11 -22.25 72.37 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 125.194 1.378 . . . . 0.56999999999999995 114.308 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.14 -20.0 70.66 Favored Glycine 0 CA--C 1.532 1.123 0 CA-C-N 118.362 1.081 . . . . 0.59999999999999998 113.193 173.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.5 mp -102.84 -45.49 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.768 1.227 . . . . 1.05 110.947 163.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.0 m -80.88 72.45 7.88 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 127.108 2.163 . . . . 1.48 108.635 -176.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -158.92 -71.23 0.02 OUTLIER Glycine 0 CA--C 1.525 0.664 0 C-N-CA 127.467 2.461 . . . . 0.90000000000000002 109.052 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -55.77 -55.63 2.84 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.187 2.591 . . . . 1.1100000000000001 111.64 170.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.8 pt -74.27 -17.33 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 N-CA-C 114.361 1.245 . . . . 1.01 114.361 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.74 -48.06 82.43 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.91 0.777 . . . . 1.0800000000000001 112.435 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.69 -47.65 76.43 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.217 -0.927 . . . . 2.9500000000000002 111.804 169.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.4 tt -57.01 -45.35 83.13 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-O 117.722 -1.132 . . . . 1.6899999999999999 111.403 -178.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.9 mt -46.32 -55.28 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 120.009 1.277 . . . . 0.88 111.005 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -61.73 -49.98 74.25 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.296 0.638 . . . . 1.8100000000000001 111.305 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -61.9 -36.58 81.73 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.891 0.876 . . . . 3.6800000000000002 111.434 -178.105 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -68.13 -44.6 75.73 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 127.896 2.478 . . . . 2.1899999999999999 111.314 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -68.2 -21.86 64.84 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.31 1.414 . . . . 3.3300000000000001 111.714 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.604 0 C-N-CA 123.535 0.734 . . . . 2.2400000000000002 111.191 172.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 . . . . . 0 N--CA 1.483 1.213 0 N-CA-C 114.039 1.126 . . . . 2.3500000000000001 114.039 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.1 p -81.83 155.23 25.49 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.866 -1.146 . . . . 1.3400000000000001 109.754 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -61.05 -36.51 79.79 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 120.728 1.604 . . . . 2.3599999999999999 111.752 -178.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -47.86 84.43 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.615 1.166 . . . . 0.91000000000000003 110.34 176.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -68.15 -54.1 20.41 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.314 1.446 . . . . 2.98 111.645 -177.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -33.91 66.6 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.517 1.127 . . . . 4.54 109.96 172.323 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.832 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.96 -45.33 67.63 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 117.199 -1.381 . . . . 0.54000000000000004 112.201 173.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 22.5 t -53.78 -41.27 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-N 121.154 1.797 . . . . 0.68000000000000005 110.625 170.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 70.3 mt -58.48 -54.47 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.405 -0.807 . . . . 0.97999999999999998 112.172 169.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.4 t -58.34 -42.88 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 119.405 1.002 . . . . 0.68999999999999995 112.103 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.5 mp -64.87 -47.1 79.1 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.796 1.238 . . . . 1.2 111.469 176.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.9 t -57.65 -48.22 83.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 123.292 0.637 . . . . 0.69999999999999996 110.514 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -62.89 -34.18 76.86 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.532 1.133 . . . . 2.8700000000000001 111.738 175.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.0 -25.24 64.41 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.596 1.544 . . . . 2.6499999999999999 113.465 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -72.63 -52.86 13.62 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.566 -0.708 . . . . 2.0 111.0 165.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -65.9 -43.59 87.74 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.545 -0.722 . . . . 2.1400000000000001 112.923 -173.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 7.9 ptmt -58.01 -16.58 13.08 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 120.274 -1.516 . . . . 3.4300000000000002 114.941 177.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -89.61 -4.25 57.9 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.737 1.384 . . . . 3.25 114.737 173.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.482 1.167 0 CA-C-N 120.593 1.542 . . . . 3.8999999999999999 111.188 173.099 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 16.6 tt . . . . . 0 CA--C 1.545 0.776 0 N-CA-C 106.991 -1.485 . . . . 2.9500000000000002 106.991 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 29.6 t -100.18 144.56 29.06 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 120.735 -1.228 . . . . 3.0600000000000001 109.559 161.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -58.16 -21.64 47.91 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.572 -1.33 . . . . 2.0899999999999999 112.766 171.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 5.1 t -63.43 -34.46 77.8 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.756 0.65 . . . . 3.6800000000000002 112.756 170.308 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 14.7 m -63.17 -42.66 99.44 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 120.942 -1.099 . . . . 1.78 112.05 -175.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.463 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 65.4 t80 -51.33 -60.28 3.3 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.174 0.99 . . . . 2.0899999999999999 112.061 171.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.1 ptt180 -65.18 -14.7 61.24 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.604 0.964 . . . . 2.2999999999999998 113.604 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 143' ' ' GLU . . . . . 0.445 ' HB3' ' HE2' ' B' ' 147' ' ' LYS . 7.6 mt-10 -94.21 -40.91 9.76 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 126.467 1.907 . . . . 2.8399999999999999 113.398 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.3 tmm? -59.77 -39.44 84.86 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.342 -0.614 . . . . 2.3100000000000001 109.342 167.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 145' ' ' LEU . . . . . 0.436 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 94.5 mt -66.76 9.15 0.2 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.275 2.23 . . . . 2.8300000000000001 115.352 164.249 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -128.6 -21.84 3.39 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.465 1.283 . . . . 3.0800000000000001 114.465 168.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 147' ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' B' ' 143' ' ' GLU . 0.0 OUTLIER -108.19 -42.44 4.63 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.758 1.223 . . . . 1.8100000000000001 113.56 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -106.77 -26.07 11.45 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.723 2.009 . . . . 2.77 112.67 -163.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.93 18.8 20.84 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.881 1.672 . . . . 1.8500000000000001 111.996 167.038 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -59.5 -35.46 74.18 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 116.04 1.867 . . . . 2.3599999999999999 116.04 -159.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -60.95 -45.48 94.55 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 120.002 1.273 . . . . 3.2000000000000002 111.159 -178.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 tpp -59.8 -17.03 32.6 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.042 1.737 . . . . 1.79 113.174 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.07 26.25 9.78 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.836 2.055 . . . . 3.98 112.686 -174.413 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 43.4 t -64.85 -16.69 63.48 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.161 1.541 . . . . 4.6500000000000004 115.161 177.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -100.98 125.41 47.58 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 120.019 1.281 . . . . 5.0899999999999999 108.354 161.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 58.0 p -64.43 -21.51 66.67 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.802 1.038 . . . . 3.2799999999999998 113.802 -173.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -61.64 -37.1 93.66 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-N 119.646 1.112 . . . . 1.9099999999999999 111.89 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -62.66 -38.71 91.41 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 119.01 -0.519 . . . . 4.0300000000000002 111.688 174.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -77.19 -27.45 53.6 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 119.739 1.154 . . . . 4.6900000000000004 114.018 173.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -57.68 -40.29 79.07 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 119.601 -1.937 . . . . 3.3700000000000001 111.473 166.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.06 -12.9 43.06 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.31 1.596 . . . . 1.3100000000000001 115.31 170.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.53 -50.04 8.65 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 120.368 1.44 . . . . 0.81000000000000005 112.337 165.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.55 -35.1 76.81 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.617 0.644 . . . . 2.1600000000000001 112.173 -177.72 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.8 -23.11 67.08 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 114.13 1.159 . . . . 4.6399999999999997 114.13 176.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 22.1 mt -74.13 -33.85 63.69 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 122.579 0.352 . . . . 0.81000000000000005 111.46 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 29.1 mm -59.71 -50.08 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 124.349 1.06 . . . . 0.90000000000000002 110.527 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -65.52 -36.04 82.65 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.471 0.653 . . . . 2.1000000000000001 112.671 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -57.14 -43.46 82.47 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.672 0.789 . . . . 3.1499999999999999 112.232 165.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 4.9 tp -69.79 -42.23 74.02 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 118.485 0.584 . . . . 3.1600000000000001 111.287 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -51.5 -40.83 60.33 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.196 1.398 . . . . 2.6699999999999999 112.173 174.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.46 -15.25 62.44 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.914 1.82 . . . . 2.1000000000000001 115.914 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -135.08 14.71 3.55 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 115.199 1.555 . . . . 3.8100000000000001 115.199 -175.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -122.68 110.0 14.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.934 1.294 . . . . 5.0700000000000003 110.908 -171.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -73.47 -27.04 61.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.876 2.07 . . . . 5.46 113.634 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 125.36 -8.33 7.91 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-O 117.953 -1.471 . . . . 2.8799999999999999 113.728 -169.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -68.51 76.7 0.28 Allowed 'General case' 0 C--N 1.346 0.421 0 CA-C-N 120.411 2.106 . . . . 7.5300000000000002 109.522 157.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.73 137.4 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 107.922 -1.14 . . . . 3.48 107.922 164.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 16.9 t -142.24 147.25 36.18 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.623 0.601 . . . . 1.9199999999999999 112.623 -173.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -48.9 -48.53 42.38 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.793 1.237 . . . . 2.1200000000000001 113.751 -172.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -74.36 -12.71 60.6 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 113.636 0.976 . . . . 4.3899999999999997 113.636 -174.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -60.96 -51.45 69.21 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.135 -0.978 . . . . 3.0600000000000001 109.399 171.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -52.29 -49.13 64.75 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.746 -1.221 . . . . 1.98 112.494 172.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 26.7 t-105 -69.1 -45.13 71.02 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 118.576 -0.726 . . . . 0.66000000000000003 112.457 -172.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 46.3 p -59.34 -45.36 91.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.458 1.103 . . . . 2.5600000000000001 110.808 170.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.463 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 58.7 mt -59.06 -40.91 86.61 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 117.36 -1.305 . . . . 0.53000000000000003 112.584 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 22.5 mm -53.69 -40.8 44.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 121.382 1.901 . . . . 0.60999999999999999 112.074 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -65.18 -25.84 71.25 Favored Glycine 0 N--CA 1.473 1.107 0 C-N-CA 124.407 1.004 . . . . 0.56000000000000005 113.545 177.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -62.25 -19.68 59.86 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 118.391 1.095 . . . . 0.71999999999999997 113.986 173.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.2 mp -110.27 -36.78 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 CA-C-N 118.449 1.125 . . . . 1.1799999999999999 111.733 166.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 22.7 m -82.32 73.79 9.33 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 125.948 1.699 . . . . 1.52 108.04 -178.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -161.85 -67.78 0.02 OUTLIER Glycine 0 CA--C 1.529 0.947 0 C-N-CA 127.283 2.373 . . . . 0.79000000000000004 110.026 -175.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -58.27 -61.28 0.28 Allowed 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.307 2.671 . . . . 0.95999999999999996 111.178 168.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.9 pt -66.48 -28.09 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 CA-C-N 119.242 0.928 . . . . 1.1799999999999999 112.975 177.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 194' ' ' ALA . . . . . 0.445 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -56.57 -46.01 80.98 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.889 0.768 . . . . 1.05 112.826 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -65.98 -30.17 70.69 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.171 -0.955 . . . . 4.7699999999999996 113.488 172.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 35.4 mt -68.14 -41.02 82.26 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.589 1.086 . . . . 4.8600000000000003 111.943 176.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 197' ' ' ILE . . . . . 0.445 HD12 ' HA ' ' B' ' 194' ' ' ALA . 70.5 mt -53.53 -42.88 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 119.278 0.944 . . . . 1.1200000000000001 110.805 171.174 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -61.98 -47.77 83.33 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 117.835 -1.078 . . . . 2.1099999999999999 111.93 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -52.57 -49.32 65.2 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.368 1.067 . . . . 3.4700000000000002 110.666 171.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -46.52 66.55 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.036 1.334 . . . . 4.5199999999999996 112.761 -177.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -77.8 -4.7 47.78 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.614 0.643 . . . . 2.7000000000000002 112.527 -177.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -98.82 -49.04 4.7 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.061 0.945 . . . . 3.3199999999999998 111.261 170.396 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 CA--C 1.535 0.377 0 C-N-CA 128.019 2.527 . . . . 5.6399999999999997 112.967 179.913 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.408 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 5.3 m-30 . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 118.652 -0.69 . . . . 2.4399999999999999 111.916 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.9 p -61.84 156.58 20.27 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 118.967 0.803 . . . . 1.1499999999999999 110.403 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -63.19 -27.78 69.6 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.047 0.758 . . . . 2.1600000000000001 113.047 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt -69.36 -47.87 63.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.728 1.211 . . . . 1.3200000000000001 109.984 172.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -49.74 62.8 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 122.837 0.455 . . . . 2.5499999999999998 111.367 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.94 -36.49 17.48 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.729 1.612 . . . . 5.5300000000000002 111.124 172.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.19 -21.33 56.6 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.184 -1.572 . . . . 0.68000000000000005 113.716 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.1 t -60.89 -38.03 78.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 CA-C-N 121.143 1.792 . . . . 1.22 110.066 169.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.5 mt -56.7 -56.95 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-O 118.825 -0.607 . . . . 1.1200000000000001 109.967 168.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 99.5 t -54.34 -40.28 47.66 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 124.642 1.177 . . . . 0.71999999999999997 112.933 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -72.62 -39.02 67.6 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.268 -0.895 . . . . 1.0900000000000001 112.432 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.1 t -64.55 -40.41 88.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.067 0.947 . . . . 0.81000000000000005 111.53 172.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -55.15 -54.21 46.16 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.38 1.072 . . . . 2.6899999999999999 110.094 174.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -56.48 -30.16 62.6 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 115.479 1.659 . . . . 3.25 115.479 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -73.59 -57.85 3.71 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.532 0.606 . . . . 2.3500000000000001 112.171 173.032 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -68.38 -17.33 64.21 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.311 1.226 . . . . 1.8200000000000001 114.311 -171.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -44.27 -32.64 1.34 Allowed 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 120.546 1.521 . . . . 2.9199999999999999 113.215 171.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -93.4 8.02 42.17 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.07 1.748 . . . . 2.3399999999999999 114.033 -174.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.476 0.863 0 C-N-CA 125.398 1.479 . . . . 2.2999999999999998 110.27 172.363 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 12.0 pt . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 120.269 0.08 . . . . 2.9399999999999999 111.085 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.4 t -76.41 138.63 40.5 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 120.504 -1.372 . . . . 3.4399999999999999 111.954 177.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.9 mtpt -72.51 -6.74 45.96 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.098 -0.955 . . . . 3.2799999999999998 113.309 169.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.1 p -80.3 -48.31 13.2 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.294 0.952 . . . . 3.0899999999999999 111.056 156.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.6 m -59.06 -35.6 73.61 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 117.234 -1.365 . . . . 1.28 113.751 -167.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -60.16 -60.38 3.91 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 121.058 1.754 . . . . 2.3799999999999999 112.07 172.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -63.78 -23.87 67.54 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.872 0.693 . . . . 2.79 112.872 -178.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -71.45 -49.0 45.77 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.121 1.368 . . . . 3.23 112.774 169.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 8.4 tmm? -59.37 -35.88 74.73 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 126.125 1.77 . . . . 1.3700000000000001 111.804 -174.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.2 mt -59.07 -20.24 51.58 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.679 1.592 . . . . 1.24 114.695 168.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -1.15 18.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.789 1.177 . . . . 2.79 113.228 175.509 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.62 -37.14 7.23 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.144 1.378 . . . . 1.8600000000000001 112.839 172.469 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -96.79 -72.2 0.65 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.93 1.692 . . . . 4.5 109.637 169.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.95 20.7 0.06 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 125.944 1.698 . . . . 1.5 114.769 -171.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -66.63 -23.01 66.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 128.964 2.906 . . . . 1.45 116.2 -164.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.494 ' H ' ' CD2' ' A' ' 48' ' ' HIS . 0.3 OUTLIER -76.42 -54.84 6.16 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.417 1.008 . . . . 1.49 109.608 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.4 tpp -47.7 -42.91 26.07 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.485 2.314 . . . . 1.79 113.797 162.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -109.22 34.72 3.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.729 1.212 . . . . 4.0199999999999996 113.076 -175.262 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.4 p -62.88 -39.49 94.63 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 114.942 -1.026 . . . . 5.6399999999999997 110.942 167.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -68.98 137.43 53.72 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.286 1.434 . . . . 4.6799999999999997 112.991 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.8 m -69.35 -32.79 72.08 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.954 1.701 . . . . 2.3300000000000001 112.327 175.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.85 -50.53 57.82 Favored Glycine 0 N--CA 1.47 0.922 0 CA-C-N 119.568 1.076 . . . . 1.5600000000000001 111.963 178.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -59.4 -29.29 67.63 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.971 -0.723 . . . . 3.3599999999999999 112.35 172.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -80.02 -31.85 39.59 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.679 0.992 . . . . 5.8499999999999996 113.679 174.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 mmmt -60.67 -35.88 77.34 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 119.249 -2.157 . . . . 3.7000000000000002 111.872 169.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.88 -29.89 56.73 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 117.25 -1.357 . . . . 1.04 114.076 167.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.65 -41.32 79.53 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 120.514 1.506 . . . . 0.79000000000000004 113.157 167.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -63.38 -35.31 79.99 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 125.845 1.658 . . . . 3.46 112.606 -177.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -47.82 -43.04 27.64 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.628 1.171 . . . . 3.27 112.835 168.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.487 ' HB3' HD22 ' A' ' 82' ' ' LEU . 16.4 mt -70.12 -38.48 75.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.601 -1.182 . . . . 1.01 110.35 -174.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.3 mm -63.89 -42.12 94.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 122.988 0.515 . . . . 0.87 111.518 -176.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -72.13 -37.4 69.46 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 123.319 0.648 . . . . 1.97 111.583 176.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -67.16 -30.68 70.72 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.183 -0.948 . . . . 3.6000000000000001 112.383 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.444 HD22 HD11 ' A' ' 82' ' ' LEU . 28.2 tp -69.14 -24.3 64.07 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 120.895 -1.128 . . . . 3.5 112.394 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.51 -25.96 28.7 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.143 1.777 . . . . 4.8899999999999997 113.731 171.228 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -85.47 -4.43 59.16 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.817 1.414 . . . . 3.77 114.817 174.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -127.59 -30.22 2.58 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 114.372 1.249 . . . . 3.9399999999999999 114.372 -171.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -90.97 57.97 3.65 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.943 1.297 . . . . 5.7199999999999998 112.528 -163.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -87.47 84.23 7.18 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.361 1.065 . . . . 5.6799999999999997 111.543 177.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 74.0 -28.6 0.95 Allowed Glycine 0 N--CA 1.476 1.309 0 C-N-CA 125.831 1.681 . . . . 4.1399999999999997 115.863 167.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 -89.14 152.15 21.79 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 126.229 1.812 . . . . 7.4500000000000002 110.329 169.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.4 mp -127.39 138.48 54.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 106.0 -1.852 . . . . 4.2699999999999996 106.0 170.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.0 152.28 20.38 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.579 0.228 . . . . 2.25 111.219 173.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -61.62 -48.67 79.84 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 123.408 1.575 . . . . 2.1299999999999999 109.558 167.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.2 -16.5 64.34 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.95 2.9 . . . . 2.8999999999999999 114.308 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.2 tt0 -59.85 -55.04 39.07 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.444 1.498 . . . . 2.9199999999999999 110.256 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -59.49 -38.3 80.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.367 -0.833 . . . . 2.4500000000000002 111.813 177.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 22.2 t-105 -61.96 -49.98 73.94 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 118.818 -0.611 . . . . 0.56999999999999995 111.084 177.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.3 t -71.63 -15.6 62.25 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 113.924 1.083 . . . . 1.8700000000000001 113.924 176.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.487 HD22 ' HB3' ' A' ' 62' ' ' LEU . 89.3 mt -74.34 -47.53 33.81 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 120.009 1.277 . . . . 0.76000000000000001 111.861 164.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.8 mm -51.31 -40.66 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-N 120.895 1.679 . . . . 0.78000000000000003 113.77 -174.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.11 -22.62 60.81 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 118.767 0.712 . . . . 0.71999999999999997 113.641 177.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.41 -16.76 80.43 Favored Glycine 0 CA--C 1.534 1.234 0 O-C-N 121.181 -1.187 . . . . 0.58999999999999997 113.882 175.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.8 mp -95.62 -46.36 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 CA-C-N 118.382 1.091 . . . . 0.79000000000000004 110.871 161.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 28.8 m -84.78 83.55 8.0 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 126.128 1.771 . . . . 1.27 108.54 -171.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -167.45 -64.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.961 0 C-N-CA 125.428 1.49 . . . . 1.1699999999999999 111.932 -171.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -58.19 -53.17 4.5 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.2 2.6 . . . . 1.47 111.293 165.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.9 pt -61.22 -24.61 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 113.115 0.783 . . . . 1.8500000000000001 113.115 174.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.39 -53.42 52.64 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.412 1.006 . . . . 1.0 112.389 -175.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -61.08 -34.17 74.51 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.621 -1.299 . . . . 2.9900000000000002 112.662 175.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.6 tt -66.24 -44.47 83.67 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.211 1.004 . . . . 1.29 111.23 -178.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 56.0 mt -49.32 -59.91 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.63 0.772 . . . . 1.0600000000000001 109.734 166.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -61.95 -28.52 69.6 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.014 -1.054 . . . . 1.9399999999999999 113.409 -173.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.348 3.2 pt-20 -87.21 -11.43 49.84 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 121.277 -0.89 . . . . 3.1400000000000001 113.095 175.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.448 ' C ' ' H ' ' A' ' 99' ' ' GLN . 0.6 OUTLIER -81.86 -40.73 22.02 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.433 1.893 . . . . 2.1899999999999999 113.935 169.553 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -66.43 7.66 0.31 Allowed 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 123.501 1.62 . . . . 2.4500000000000002 112.889 174.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLN . . . . . 0.448 ' H ' ' C ' ' A' ' 97' ' ' GLN . 16.0 mm-40 . . . . . 0 C--N 1.326 -0.426 0 C-N-CA 126.891 2.076 . . . . 1.8899999999999999 109.704 -175.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 5.9 m-30 . . . . . 0 N--CA 1.479 0.992 0 N-CA-C 112.237 0.458 . . . . 2.4500000000000002 112.237 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 5.4 p -65.52 166.78 9.85 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 118.436 0.562 . . . . 1.1599999999999999 111.878 -176.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -62.19 -37.9 87.07 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.379 -0.826 . . . . 2.9300000000000002 111.957 173.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.38 -51.49 65.66 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.278 0.631 . . . . 1.0600000000000001 109.724 173.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.79 -54.8 10.29 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.26 -0.274 . . . . 2.4700000000000002 110.26 -169.343 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . 0.257 0.7 OUTLIER -60.49 -23.41 64.48 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 122.057 -0.402 . . . . 4.6200000000000001 111.621 177.06 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.24 -25.03 61.47 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 119.34 -2.1 . . . . 1.05 114.324 169.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 34.3 t -61.58 -35.38 66.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 121.297 1.862 . . . . 1.05 110.879 170.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 71.2 mt -54.52 -55.8 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 121.383 -0.823 . . . . 1.0800000000000001 110.713 165.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 78.9 t -56.26 -41.45 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.951 1.3 . . . . 0.83999999999999997 112.474 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.71 -38.77 87.41 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.369 0.668 . . . . 1.1899999999999999 112.287 176.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 71.7 t -71.39 -39.32 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.709 0.804 . . . . 0.91000000000000003 111.494 177.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -51.04 -55.89 15.24 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.726 1.21 . . . . 2.71 109.605 171.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -50.52 -40.77 52.43 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.9 1.444 . . . . 3.3500000000000001 114.9 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -66.44 -57.53 7.18 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.705 0.684 . . . . 2.3900000000000001 111.79 178.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -66.05 -20.52 66.2 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.617 0.969 . . . . 1.8400000000000001 113.617 -171.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -45.88 -32.68 2.77 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 120.216 1.371 . . . . 3.0800000000000001 113.526 170.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -93.89 8.37 41.51 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.242 1.417 . . . . 2.1400000000000001 113.916 -174.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.0 m . . . . . 0 N--CA 1.479 1.02 0 C-N-CA 125.742 1.617 . . . . 2.29 110.033 169.797 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 22.0 pt . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 108.441 -0.948 . . . . 2.7599999999999998 108.441 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 30.3 t -73.18 138.14 45.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 117.637 -1.625 . . . . 2.9100000000000001 111.209 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mtpt -63.94 -13.93 49.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.641 0.776 . . . . 3.3300000000000001 112.934 167.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 97.2 p -77.38 -27.73 52.6 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.02 -1.05 . . . . 2.46 113.233 163.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.3 m -78.55 -39.56 37.44 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.937 1.244 . . . . 1.1699999999999999 113.118 -173.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.444 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 64.5 t80 -55.51 -55.9 26.47 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 120.366 1.439 . . . . 2.2599999999999998 111.727 -177.461 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -55.49 -19.45 9.71 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.402 1.481 . . . . 2.5099999999999998 113.805 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 143' ' ' GLU . . . . . 0.404 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 23.4 mt-10 -100.36 -46.23 5.32 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 125.332 1.453 . . . . 3.25 112.496 -174.307 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -51.15 -41.95 60.47 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.944 1.297 . . . . 1.1899999999999999 110.646 165.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.8 mt -59.82 -17.25 34.62 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 116.098 1.888 . . . . 1.0800000000000001 116.098 168.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -114.77 -5.0 12.65 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 120.679 1.581 . . . . 2.6699999999999999 113.955 174.007 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 147' ' ' LYS . . . . . 0.404 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 1.3 mppt? -107.18 -36.02 6.67 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.605 1.562 . . . . 3.02 113.23 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -87.92 -72.65 0.52 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.307 1.443 . . . . 4.3499999999999996 108.617 163.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.58 22.65 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.794 2.038 . . . . 1.5700000000000001 114.918 -171.257 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -66.11 -25.67 67.1 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.376 2.67 . . . . 1.54 116.622 -166.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 151' ' ' HIS . . . . . 0.549 ' H ' ' CD2' ' B' ' 151' ' ' HIS . 0.6 OUTLIER -73.17 -55.87 5.87 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.936 1.244 . . . . 1.51 109.805 -177.639 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 27.2 tpp -47.77 -49.79 27.5 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.704 2.002 . . . . 1.99 112.891 163.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 1.4 mt -99.7 35.37 2.02 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.667 1.187 . . . . 4.0199999999999996 113.147 -174.18 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 13.5 p -65.51 -36.77 84.82 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.785 -1.098 . . . . 5.3600000000000003 111.183 167.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -71.89 135.7 46.64 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.102 1.361 . . . . 4.96 113.062 174.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 96.9 m -67.07 -33.15 74.88 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.877 1.671 . . . . 2.4900000000000002 112.533 174.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -64.29 -52.56 42.84 Favored Glycine 0 N--CA 1.471 0.992 0 CA-C-N 119.98 1.264 . . . . 1.6599999999999999 112.152 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -58.4 -29.87 66.39 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.013 0.925 . . . . 3.54 112.446 173.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 57.7 mtm-85 -78.64 -31.52 46.9 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.779 1.4 . . . . 6.0599999999999996 114.779 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -60.93 -37.09 81.11 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 119.879 -1.763 . . . . 3.8500000000000001 111.68 168.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -53.22 -32.14 46.75 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-O 117.581 -1.2 . . . . 1.0600000000000001 113.795 168.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.6 -44.42 74.36 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.869 1.268 . . . . 0.97999999999999998 113.152 169.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -62.96 -36.32 83.08 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.754 2.022 . . . . 3.5899999999999999 112.842 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -52.53 -36.21 55.05 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.916 -1.115 . . . . 2.96 112.336 171.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 9.8 mt -73.36 -36.14 66.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.949 -0.569 . . . . 1.04 111.247 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.0 mm -58.86 -44.8 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 123.797 0.839 . . . . 0.92000000000000004 111.54 177.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -76.04 -33.11 59.62 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 123.168 0.587 . . . . 1.74 112.014 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -67.29 -32.4 73.36 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.341 -0.85 . . . . 3.52 112.364 170.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 22.2 tp -67.73 -23.85 65.31 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.014 -1.054 . . . . 3.3799999999999999 112.123 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.2 -32.78 49.77 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.537 1.535 . . . . 5.0300000000000002 113.843 170.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.09 -7.4 58.86 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.645 1.35 . . . . 3.7599999999999998 114.645 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -127.31 -26.44 3.07 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 115.091 1.515 . . . . 3.7000000000000002 115.091 -168.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 32.7 t60 -100.21 66.75 1.33 Allowed 'General case' 0 CA--C 1.548 0.889 0 O-C-N 120.885 -1.135 . . . . 5.29 112.817 -163.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -81.41 69.58 8.08 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.847 1.308 . . . . 5.8499999999999996 111.898 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.96 -24.54 1.04 Allowed Glycine 0 CA--C 1.536 1.399 0 C-N-CA 125.858 1.694 . . . . 3.6899999999999999 115.694 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 16.9 mmt85 -79.97 142.71 34.8 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.752 1.221 . . . . 7.29 110.494 169.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 3.4 mp -111.27 145.53 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 N-CA-C 106.547 -1.649 . . . . 4.5700000000000003 106.547 165.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.79 150.74 25.28 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 122.907 0.483 . . . . 2.2200000000000002 109.816 168.517 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -59.61 -49.6 77.13 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 123.569 1.652 . . . . 2.1400000000000001 109.559 169.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.44 -16.91 26.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 129.821 3.248 . . . . 3.1600000000000001 114.687 176.368 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -59.36 -57.51 12.67 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.243 1.417 . . . . 3.0299999999999998 110.649 175.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -57.62 -40.2 78.61 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.444 -0.785 . . . . 2.3700000000000001 112.331 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.9 t-105 -60.85 -51.47 69.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.229 -0.891 . . . . 0.67000000000000004 111.351 174.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 7.1 t -69.43 -18.58 63.75 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.982 1.264 . . . . 1.6499999999999999 113.701 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.444 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 97.3 mt -68.87 -51.27 42.12 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 120.092 1.314 . . . . 0.78000000000000003 110.978 164.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 30.1 mm -52.0 -37.29 21.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 CA-C-N 121.035 1.743 . . . . 0.69999999999999996 114.336 -173.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.33 -22.07 65.02 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 119.309 0.959 . . . . 0.67000000000000004 114.238 175.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.79 -18.22 78.72 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 118.63 1.215 . . . . 0.69999999999999996 113.527 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.2 mp -101.48 -41.54 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 118.385 1.093 . . . . 0.82999999999999996 110.681 166.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 24.7 m -82.11 84.93 6.87 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.272 1.429 . . . . 1.3700000000000001 108.84 -177.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -171.88 -66.17 0.04 OUTLIER Glycine 0 CA--C 1.528 0.896 0 CA-C-O 118.258 -1.301 . . . . 1.0700000000000001 112.194 -170.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -58.36 -54.19 3.3 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.066 2.511 . . . . 1.3899999999999999 110.95 167.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 35.5 pt -64.95 -21.04 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 113.387 0.884 . . . . 1.8 113.387 175.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.01 -55.91 24.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.493 1.042 . . . . 0.97999999999999998 112.643 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -59.56 -34.21 72.4 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.518 -1.364 . . . . 3.1200000000000001 112.558 175.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.3 tt -66.14 -43.58 86.66 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 124.126 0.97 . . . . 1.45 110.725 -177.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 48.4 mt -51.69 -58.26 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.97 0.908 . . . . 1.23 109.631 167.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 80.7 t60 -70.79 -5.57 31.22 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 114.668 1.358 . . . . 1.8300000000000001 114.668 -173.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.339 3.5 pt-20 -104.01 -15.06 15.71 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.954 1.302 . . . . 3.0600000000000001 112.842 167.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 200' ' ' GLN . . . . . 0.462 ' C ' ' H ' ' B' ' 202' ' ' GLN . 11.2 mm-40 -80.08 -39.55 29.43 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 126.434 1.894 . . . . 2.1699999999999999 114.674 169.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.06 10.34 0.11 Allowed 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 121.411 1.914 . . . . 2.5099999999999998 112.977 171.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 202' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' B' ' 200' ' ' GLN . 2.3 mm-40 -126.29 -76.51 0.58 Allowed 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 127.241 2.216 . . . . 1.8899999999999999 109.149 -178.022 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.988 0 C-N-CA 130.333 3.453 . . . . 4.1699999999999999 116.72 169.178 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 113.94 1.089 . . . . 2.04 113.94 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 81.8 p -68.2 153.88 42.84 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.871 0.469 . . . . 1.03 110.661 -175.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.446 ' HG2' HG21 ' B' ' 117' ' ' VAL . 6.2 tp10 -52.58 -38.46 60.05 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.776 0.83 . . . . 2.5699999999999998 111.355 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -42.77 99.77 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.362 1.865 . . . . 0.82999999999999996 111.672 177.018 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -50.69 13.61 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 118.69 0.677 . . . . 2.7999999999999998 111.607 -177.547 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -49.68 -34.82 19.59 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.237 1.015 . . . . 6.0599999999999996 111.17 165.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.745 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.38 -40.63 77.31 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 116.821 -1.561 . . . . 0.57999999999999996 114.229 171.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.4 t -53.76 -47.32 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 CA-C-N 121.438 1.926 . . . . 0.98999999999999999 110.077 169.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.2 mt -52.46 -51.53 32.84 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 CA-C-N 118.556 0.617 . . . . 0.75 111.505 172.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 16.9 t -60.21 -47.67 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.421 1.088 . . . . 0.53000000000000003 112.195 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 mp -57.92 -45.85 85.9 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.417 1.087 . . . . 0.90000000000000002 111.022 175.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.9 t -59.22 -54.13 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 126.072 1.749 . . . . 0.69999999999999996 111.792 -178.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 tp10 -71.22 -32.95 69.43 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.11 1.323 . . . . 5.04 112.234 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -67.72 -17.64 64.63 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 120.214 1.37 . . . . 2.5899999999999999 113.432 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -80.26 -56.68 4.04 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.321 -0.862 . . . . 2.02 111.65 161.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.435 ' HB3' ' CE1' ' B' ' 198' ' ' HIS . 21.2 m-85 -59.67 -34.28 72.65 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.246 -0.883 . . . . 2.02 113.059 -169.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -47.6 -39.34 16.57 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.672 1.578 . . . . 2.8999999999999999 113.949 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.476 ' CE2' ' HG3' ' A' ' 41' ' ' MET . 90.9 m-85 -82.61 -19.69 37.86 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 120.747 -1.221 . . . . 2.3700000000000001 113.562 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 1.5 t . . . . . 0 CA--C 1.544 0.737 0 C-N-CA 126.283 1.833 . . . . 3.3999999999999999 110.97 168.559 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.0 tt . . . . . 0 N--CA 1.477 0.883 0 CA-C-O 121.615 0.722 . . . . 3.75 110.539 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.9 m -113.61 138.27 50.41 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.12 -1.437 . . . . 3.2799999999999998 107.12 168.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.503 ' HE2' ' OE2' ' A' ' 78' ' ' GLU . 15.2 mttp -76.64 -15.96 59.68 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.133 0.973 . . . . 3.3799999999999999 110.633 -154.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.3 p -41.49 -27.86 0.11 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.238 1.815 . . . . 2.1499999999999999 114.722 154.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.9 m -74.33 -44.27 53.14 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.19 0.996 . . . . 1.48 112.64 171.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -52.95 -50.47 63.97 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.152 1.381 . . . . 1.8200000000000001 112.104 -172.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -54.35 -31.53 54.76 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.878 1.271 . . . . 3.3100000000000001 113.397 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -95.56 -36.67 11.18 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 112.78 0.659 . . . . 4.1100000000000003 112.78 -174.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' MET . . . . . 0.476 ' HG3' ' CE2' ' A' ' 22' ' ' TYR . 11.8 tmm? -48.57 -47.77 39.36 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.487 0.715 . . . . 1.5600000000000001 110.179 159.004 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.1 mt -54.48 -51.49 64.89 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.523 0.729 . . . . 1.05 112.685 173.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.41 -6.49 59.39 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.535 1.68 . . . . 3.0 115.535 -174.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.93 -37.33 9.44 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.63 1.172 . . . . 2.1699999999999999 113.715 167.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -107.1 -21.85 12.84 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.006 1.322 . . . . 2.9300000000000002 114.537 -167.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 64.3 mt -111.01 44.49 1.28 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.846 1.258 . . . . 2.3799999999999999 109.843 162.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.6 p30 -66.76 -2.78 5.43 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 115.865 1.802 . . . . 1.53 115.865 -169.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.433 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -100.34 -48.77 4.47 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.648 1.979 . . . . 2.5099999999999998 111.977 178.678 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 45.4 tpp -72.17 33.03 0.06 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.801 2.04 . . . . 2.2999999999999998 112.816 175.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 tp -89.1 -36.05 15.95 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 127.014 2.126 . . . . 4.0300000000000002 113.129 -157.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.96 28.13 17.09 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.733 0.813 . . . . 4.9800000000000004 112.094 -175.041 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.5 t70 58.61 -77.53 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 129.043 2.937 . . . . 5.2300000000000004 112.617 -170.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 50.9 m -132.26 -17.28 2.68 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 126.827 2.051 . . . . 2.29 111.334 -173.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -69.84 -65.37 2.58 Favored Glycine 0 N--CA 1.473 1.129 0 CA-C-N 120.566 1.53 . . . . 1.5600000000000001 112.983 -170.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -59.7 -24.09 63.67 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.652 0.781 . . . . 3.7799999999999998 112.83 172.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -79.89 -46.04 17.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.675 1.19 . . . . 5.0199999999999996 113.736 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -58.28 -37.1 74.34 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.039 -1.663 . . . . 3.6000000000000001 111.26 167.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.26 -46.17 79.78 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 117.45 -1.262 . . . . 1.8100000000000001 112.0 168.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.34 -48.76 65.3 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.244 1.018 . . . . 0.79000000000000004 112.386 170.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.37 -28.53 69.76 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 124.458 1.103 . . . . 2.5899999999999999 113.319 -178.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -59.24 -38.22 79.47 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 120.446 -1.409 . . . . 3.54 112.196 173.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 mt -66.05 -35.35 80.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.308 -0.86 . . . . 0.88 110.953 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 20.0 mm -67.1 -50.11 66.94 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.253 0 C-N-CA 123.938 0.895 . . . . 1.02 110.973 -177.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -67.41 -24.91 65.71 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.234 1.014 . . . . 3.3700000000000001 112.363 -178.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -67.71 -49.61 61.8 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 124.328 1.051 . . . . 3.0600000000000001 113.795 164.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.408 HD12 ' HE2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -97.73 -34.0 11.08 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 120.461 -1.4 . . . . 2.5099999999999998 114.674 -163.792 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -65.39 -14.43 60.86 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 119.888 -1.758 . . . . 4.5800000000000001 112.861 169.001 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.25 -16.65 52.03 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.533 1.308 . . . . 3.6200000000000001 114.533 167.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -128.44 -4.04 5.44 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.726 1.75 . . . . 3.73 115.726 -167.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -137.54 118.94 14.72 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 120.376 -1.453 . . . . 4.1900000000000004 109.854 172.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -94.24 -108.03 0.13 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.485 1.514 . . . . 4.04 113.33 -163.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -89.03 15.44 57.98 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 128.09 2.757 . . . . 3.8599999999999999 113.342 176.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.4 mmt-85 -126.38 147.57 49.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.816 1.646 . . . . 4.9699999999999998 109.311 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.0 mm -142.8 141.35 27.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 125.337 1.455 . . . . 2.5299999999999998 108.453 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.4 t -94.4 156.38 16.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.393 0.542 . . . . 2.3399999999999999 112.059 169.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -58.98 -40.39 84.7 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.796 0.808 . . . . 1.9299999999999999 111.188 161.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -73.38 -16.6 61.34 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.385 1.074 . . . . 4.0899999999999999 112.686 -172.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.503 ' OE2' ' HE2' ' A' ' 35' ' ' LYS . 25.6 mt-10 -60.75 -52.44 65.08 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.893 0.77 . . . . 3.0899999999999999 111.374 175.059 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -54.13 -42.84 69.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 121.228 -0.92 . . . . 1.8500000000000001 111.092 174.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -65.33 -52.34 54.58 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 118.292 -0.861 . . . . 0.67000000000000004 112.475 -177.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.7 t -68.65 -26.82 65.52 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.572 1.078 . . . . 1.8400000000000001 112.742 177.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.0 mt -68.57 -38.71 80.93 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 119.986 1.266 . . . . 0.79000000000000004 111.357 173.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.4 mm -58.42 -38.88 72.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 120.469 1.486 . . . . 0.96999999999999997 112.718 -178.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.42 -24.64 52.85 Favored Glycine 0 CA--C 1.54 1.594 0 CA-C-N 119.288 0.949 . . . . 0.90000000000000002 113.405 174.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.68 -8.81 57.62 Favored Glycine 0 CA--C 1.534 1.266 0 O-C-N 121.131 -1.217 . . . . 0.78000000000000003 114.12 173.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.2 mp -124.44 -41.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.878 1.339 . . . . 1.04 112.154 172.125 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 79.5 m -81.74 94.05 6.93 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.052 1.741 . . . . 1.3500000000000001 108.361 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -177.37 -68.95 0.06 OUTLIER Glycine 0 CA--C 1.527 0.829 0 CA-C-O 118.606 -1.108 . . . . 1.0800000000000001 112.253 -172.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.76 -43.73 30.07 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.71 2.273 . . . . 1.1000000000000001 111.378 169.114 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 12.2 pt -75.64 -19.56 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 N-CA-C 113.569 0.952 . . . . 1.21 113.569 172.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.08 -54.67 43.2 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.717 1.144 . . . . 1.1799999999999999 111.973 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.49 -42.68 78.7 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 118.23 -0.89 . . . . 2.8199999999999998 112.673 169.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.9 tt -59.78 -42.15 92.69 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 118.891 0.769 . . . . 1.25 112.126 -176.125 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.2 mt -55.79 -56.9 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 124.109 0.964 . . . . 1.21 109.504 173.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.4 ' CE1' ' HB3' ' B' ' 123' ' ' TYR . 60.0 t60 -59.64 -36.29 76.08 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.82 1.248 . . . . 2.2400000000000002 112.789 -177.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -88.47 -9.19 53.32 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.07 0.948 . . . . 3.1499999999999999 113.282 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -87.9 -48.47 7.77 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 124.453 1.101 . . . . 2.9300000000000002 113.802 169.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -57.52 -37.59 73.27 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.128 0.966 . . . . 2.5299999999999998 111.99 -171.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 . . . . . 0 N--CA 1.469 0.511 0 C-N-CA 124.471 1.108 . . . . 2.3799999999999999 111.553 174.759 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 113.111 0.782 . . . . 2.1200000000000001 113.111 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 82.2 p -74.08 157.47 36.01 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 122.831 0.453 . . . . 1.1399999999999999 109.797 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -63.6 -23.34 67.34 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.656 -0.653 . . . . 2.6499999999999999 111.962 176.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.4 -41.11 98.41 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.369 0.668 . . . . 0.75 110.053 170.203 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.76 -51.02 12.16 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.759 0.651 . . . . 3.0299999999999998 112.759 -177.605 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -34.31 -50.26 0.41 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.774 1.23 . . . . 4.2400000000000002 111.899 159.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.745 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.04 -41.85 85.84 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 116.488 -1.72 . . . . 0.73999999999999999 113.959 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 15.6 t -53.83 -47.37 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-N 122.138 2.245 . . . . 1.01 110.788 168.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 16.6 mt -55.01 -49.19 73.62 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 119.454 1.025 . . . . 0.84999999999999998 111.224 173.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.446 HG21 ' HG2' ' A' ' 7' ' ' GLU . 23.2 t -65.62 -42.14 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.958 1.303 . . . . 0.57999999999999996 112.389 -176.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.6 mp -60.55 -42.44 96.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.615 1.166 . . . . 0.97999999999999998 111.153 172.06 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 18.0 t -65.06 -54.13 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.113 1.365 . . . . 0.68000000000000005 112.807 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 34.7 tp10 -69.69 -34.35 73.8 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 121.016 1.735 . . . . 4.75 111.874 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -68.73 -19.34 64.34 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.885 1.22 . . . . 2.5800000000000001 113.481 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -72.65 -65.97 0.72 Allowed 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.452 -0.78 . . . . 2.0499999999999998 110.985 158.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 123' ' ' TYR . . . . . 0.4 ' HB3' ' CE1' ' A' ' 95' ' ' HIS . 32.6 m-85 -56.35 -34.07 66.27 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 117.802 -1.094 . . . . 2.1000000000000001 113.777 -167.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 13.5 ptmt -46.78 -38.06 9.54 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 121.392 1.905 . . . . 2.7400000000000002 114.034 175.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 125' ' ' TYR . . . . . 0.535 ' CE2' ' HG3' ' B' ' 144' ' ' MET . 91.3 m-85 -82.89 -10.01 59.03 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 120.359 -1.463 . . . . 2.25 114.145 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 2.3 t . . . . . 0 CA--C 1.541 0.602 0 C-N-CA 127.057 2.143 . . . . 3.2799999999999998 111.459 179.848 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 8.2 tt . . . . . 0 N--CA 1.477 0.911 0 CA-C-O 121.169 0.509 . . . . 3.5699999999999998 109.952 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 58.6 m -117.84 144.31 45.51 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 121.011 -1.055 . . . . 3.2000000000000002 108.26 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 138' ' ' LYS . . . . . 0.453 ' HE2' ' OE1' ' B' ' 181' ' ' GLU . 17.2 mttp -73.1 -16.71 61.46 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.331 -0.856 . . . . 2.9399999999999999 112.183 -154.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.1 p -48.85 -29.5 4.71 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.652 1.981 . . . . 2.0 114.048 161.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 46.7 m -68.59 -46.9 68.11 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.745 1.157 . . . . 1.3100000000000001 112.577 171.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -55.93 -53.85 51.86 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 120.196 1.362 . . . . 1.9199999999999999 112.245 -170.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -50.17 -29.56 9.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.285 1.034 . . . . 3.2400000000000002 113.19 175.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -94.89 -36.2 11.72 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 114.505 1.298 . . . . 3.6000000000000001 114.505 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 144' ' ' MET . . . . . 0.535 ' HG3' ' CE2' ' B' ' 125' ' ' TYR . 4.6 tmm? -53.37 -44.77 68.84 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 118.942 -0.551 . . . . 1.2 110.43 163.06 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 43.1 mt -53.21 -49.11 67.44 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.92 0.782 . . . . 1.1799999999999999 112.155 170.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.0 -8.13 59.65 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.012 1.486 . . . . 2.6699999999999999 115.012 -172.291 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.37 -40.64 7.0 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.852 1.261 . . . . 1.8500000000000001 113.859 167.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -101.35 -28.74 12.43 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.382 1.473 . . . . 2.7599999999999998 113.209 -165.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 46.3 mt -108.41 40.5 1.76 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.323 1.449 . . . . 2.6400000000000001 111.022 166.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -62.0 -20.17 63.61 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.597 1.703 . . . . 1.3500000000000001 115.597 -169.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 151' ' ' HIS . . . . . 0.584 ' H ' ' CD2' ' B' ' 151' ' ' HIS . 0.0 OUTLIER -80.83 -59.94 2.49 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.165 1.386 . . . . 1.9199999999999999 111.916 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 42.7 tpp -58.64 -15.63 12.5 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 126.055 1.742 . . . . 2.0 115.524 173.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 50.9 tp -51.08 -29.87 14.3 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.634 2.774 . . . . 4.2400000000000002 115.779 -171.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 21.7 m 60.08 29.67 19.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.622 1.169 . . . . 4.6900000000000004 112.823 -174.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 12.0 t70 42.64 -97.53 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.352 1.861 . . . . 6.1799999999999997 111.71 -163.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 30.4 m -93.89 -25.3 17.37 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.106 1.362 . . . . 2.5600000000000001 112.164 -168.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -67.13 -68.44 1.66 Allowed Glycine 0 N--CA 1.477 1.383 0 CA-C-N 120.712 1.596 . . . . 1.5900000000000001 113.305 -167.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -60.53 -21.87 62.97 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.094 0.958 . . . . 3.5699999999999998 112.759 173.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 159' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' B' ' 162' ' ' ALA . 1.1 ttt-85 -82.41 -37.83 24.94 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.326 1.45 . . . . 4.9400000000000004 114.509 -178.156 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 18.2 mmmt -63.56 -37.54 87.71 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 119.981 -1.699 . . . . 4.6500000000000004 111.387 165.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -55.03 -43.54 73.81 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-O 117.192 -1.385 . . . . 1.8 111.646 168.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 162' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' B' ' 159' ' ' ARG . . . -52.53 -52.57 54.05 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.46 1.104 . . . . 0.94999999999999996 111.926 170.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -56.78 -37.18 70.74 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.865 1.266 . . . . 2.5800000000000001 113.212 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 34.7 mtmt -57.79 -38.36 75.37 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 121.167 -0.958 . . . . 3.5899999999999999 112.753 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 10.2 mt -66.27 -42.42 88.47 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.037 -0.983 . . . . 0.94999999999999996 110.619 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 17.3 mm -56.13 -56.09 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.464 1.106 . . . . 0.73999999999999999 109.925 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -68.01 -27.56 66.67 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.201 0.815 . . . . 2.5299999999999998 113.201 -175.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.08 -42.98 99.75 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.253 1.021 . . . . 2.73 113.472 167.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.46 -26.88 16.29 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.045 -1.034 . . . . 3.0099999999999998 112.605 -169.391 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.17 -12.26 54.8 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.137 -1.602 . . . . 3.48 113.714 172.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.08 -11.79 60.0 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.942 1.09 . . . . 2.1699999999999999 113.942 164.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -128.02 -15.55 4.76 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.502 1.667 . . . . 2.5899999999999999 115.502 -166.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -143.18 125.81 15.91 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 120.448 1.476 . . . . 4.1600000000000001 110.418 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 174' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' B' ' 175' ' ' GLY . 12.2 p-10 -114.6 -108.06 0.37 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 125.358 1.463 . . . . 3.77 112.835 -167.104 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 175' ' ' GLY . . . . . 0.423 ' H ' ' CG ' ' B' ' 174' ' ' ASP . . . -77.57 15.18 7.87 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 127.126 2.298 . . . . 3.5800000000000001 114.196 173.321 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -131.57 150.24 52.22 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.412 1.885 . . . . 4.9900000000000002 110.039 170.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 35.2 mm -143.8 139.61 25.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 126.802 2.041 . . . . 2.6200000000000001 107.622 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 25.2 t -92.33 151.4 20.31 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.133 0.424 . . . . 2.3100000000000001 110.447 167.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -50.14 -41.37 48.78 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.403 0.621 . . . . 1.9299999999999999 111.169 164.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -71.65 -12.89 61.56 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.5 0.926 . . . . 4.2199999999999998 113.5 -173.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 181' ' ' GLU . . . . . 0.453 ' OE1' ' HE2' ' B' ' 138' ' ' LYS . 14.6 mt-10 -60.13 -51.63 68.77 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.655 1.116 . . . . 2.79 111.385 177.126 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -56.64 -43.58 80.42 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.134 -0.979 . . . . 2.04 111.89 174.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 24.2 t-105 -62.87 -57.38 11.02 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 118.837 -0.602 . . . . 0.63 111.875 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.7 t -65.09 -28.71 69.64 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.923 -1.037 . . . . 1.6299999999999999 112.73 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 77.2 mt -71.54 -35.57 70.7 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.854 1.206 . . . . 0.77000000000000002 112.975 173.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 7.0 mm -54.98 -39.2 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 CA-C-N 121.242 1.837 . . . . 0.80000000000000004 112.292 177.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.07 -28.83 71.19 Favored Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.067 0.841 . . . . 0.72999999999999998 113.317 176.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -67.98 -14.23 65.42 Favored Glycine 0 CA--C 1.533 1.164 0 O-C-N 121.03 -1.277 . . . . 0.81999999999999995 113.461 175.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.7 mp -109.3 -32.52 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 118.465 1.133 . . . . 1.0700000000000001 112.313 166.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 18.6 m -91.88 97.24 10.85 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.379 1.871 . . . . 1.5 110.05 -175.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -177.06 -64.77 0.06 OUTLIER Glycine 0 CA--C 1.529 0.938 0 C-N-CA 124.868 1.223 . . . . 1.05 111.968 -172.46 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -62.33 -47.86 8.98 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.627 2.218 . . . . 1.1699999999999999 110.762 167.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 13.5 pt -67.93 -25.15 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 112.966 0.728 . . . . 1.3999999999999999 112.966 172.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.24 -58.95 6.18 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.836 1.198 . . . . 1.05 111.939 -178.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -38.99 74.21 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 118.378 -0.82 . . . . 2.9100000000000001 112.549 173.583 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.1 tt -61.89 -41.97 98.52 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 118.511 -0.757 . . . . 1.5 112.019 -177.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 32.8 mt -55.59 -56.17 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 119.478 1.035 . . . . 1.27 109.639 173.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 198' ' ' HIS . . . . . 0.435 ' CE1' ' HB3' ' A' ' 20' ' ' TYR . 62.1 t60 -59.46 -36.13 75.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.275 1.03 . . . . 2.3799999999999999 112.555 -176.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -90.51 -8.94 49.04 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.249 0.833 . . . . 3.3599999999999999 113.249 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -88.16 -49.02 7.28 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.434 1.094 . . . . 3.0 113.792 169.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -58.82 -33.85 70.85 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.05 0.929 . . . . 2.6600000000000001 112.144 -170.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -72.77 -52.82 13.48 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.675 1.19 . . . . 2.3900000000000001 111.388 175.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 . . . . . 0 CA--C 1.548 0.903 0 C-N-CA 127.212 2.205 . . . . 6.8300000000000001 113.837 177.299 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.418 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 3.6 m-30 . . . . . 0 CA--C 1.546 0.81 0 CA-C-O 119.099 -0.477 . . . . 2.3700000000000001 110.279 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.3 p -71.82 155.52 40.33 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 119.186 0.903 . . . . 1.21 110.703 -176.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -61.29 -24.33 66.33 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 114.276 1.213 . . . . 2.7599999999999998 114.276 -171.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -48.86 79.41 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 119.7 1.137 . . . . 1.03 110.643 170.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.24 -46.84 69.39 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.381 1.472 . . . . 2.8900000000000001 112.025 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.4 mmtt -52.17 -42.09 63.14 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.973 -1.08 . . . . 6.1799999999999997 111.495 169.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.42 -39.46 77.87 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.098 -1.43 . . . . 0.67000000000000004 112.064 177.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.2 t -54.6 -40.09 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 121.503 1.956 . . . . 1.1000000000000001 110.458 167.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.1 mt -59.67 -55.67 22.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 CA-C-N 120.07 1.304 . . . . 0.89000000000000001 111.809 170.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.9 t -58.11 -39.28 72.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 125.467 1.507 . . . . 0.60999999999999999 112.976 -177.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -70.48 -41.7 72.37 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.518 1.127 . . . . 0.94999999999999996 112.098 176.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 70.6 t -71.03 -35.88 61.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 123.826 0.85 . . . . 0.59999999999999998 111.396 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -62.32 -46.29 89.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.115 0.966 . . . . 2.7000000000000002 110.848 168.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -55.11 -31.78 61.5 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.827 1.418 . . . . 2.0800000000000001 114.827 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -78.24 -62.23 1.75 Allowed 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.645 -0.659 . . . . 2.1200000000000001 111.607 171.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -64.6 -26.57 68.46 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 118.288 -0.863 . . . . 1.9199999999999999 113.094 -169.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.0 -20.05 8.28 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 120.502 1.501 . . . . 2.5 114.146 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -90.41 0.22 57.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.142 1.377 . . . . 2.5299999999999998 114.584 176.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.482 1.15 0 C-N-CA 125.592 1.557 . . . . 2.3700000000000001 111.007 178.066 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.5 pt . . . . . 0 N--CA 1.474 0.768 0 N-CA-C 111.85 0.315 . . . . 2.8900000000000001 111.85 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.2 t -77.61 149.39 34.78 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.693 0.759 . . . . 3.0600000000000001 111.533 168.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -56.1 -23.0 31.38 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 120.607 -1.308 . . . . 2.2400000000000002 111.624 164.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.8 p -80.8 -9.42 59.81 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.009 -1.682 . . . . 1.6899999999999999 115.388 170.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.8 m -83.36 -33.98 25.71 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.042 1.292 . . . . 1.25 112.24 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.451 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 23.8 t80 -45.49 -60.25 2.27 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.865 1.266 . . . . 2.0499999999999998 110.934 176.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.7 ptt180 -58.1 -24.25 57.92 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.692 1.597 . . . . 2.3300000000000001 113.229 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -94.5 -40.39 9.91 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 126.154 1.782 . . . . 3.29 111.842 -172.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 5.7 tmm? -55.06 -40.44 70.32 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 120.298 -1.501 . . . . 1.24 111.811 163.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.428 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 81.8 mt -68.87 6.06 0.98 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.94 2.496 . . . . 1.73 114.972 169.569 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -115.58 -13.5 11.52 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.207 1.803 . . . . 2.6899999999999999 113.607 165.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.55 -37.57 9.11 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.847 1.425 . . . . 1.75 114.847 178.286 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -82.9 -56.29 3.91 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 118.591 0.632 . . . . 4.5800000000000001 109.77 164.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.95 75.06 4.49 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.482 -0.762 . . . . 2.1200000000000001 109.704 171.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -121.82 -2.92 9.23 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.216 1.807 . . . . 2.1899999999999999 113.965 -174.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -118.11 -28.01 5.96 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.114 -0.991 . . . . 1.78 112.027 176.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 36.9 tpp -65.49 -12.91 57.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.608 1.963 . . . . 1.9299999999999999 112.443 163.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.3 pp -151.5 175.39 12.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.555 1.542 . . . . 3.5899999999999999 112.841 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.0 m 156.06 -37.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 130.903 3.681 . . . . 7.46 107.922 -164.443 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -55.27 132.33 47.59 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.197 0.999 . . . . 4.25 110.505 156.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 50.3 m -80.73 -25.81 37.81 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.221 1.408 . . . . 2.4700000000000002 111.274 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.16 -48.12 87.49 Favored Glycine 0 N--CA 1.472 1.098 0 C-N-CA 124.738 1.161 . . . . 1.6699999999999999 111.82 177.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -46.52 -55.73 7.08 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.918 1.687 . . . . 3.3500000000000001 112.173 166.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -60.59 -29.08 68.98 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.536 -0.727 . . . . 6.8099999999999996 112.669 -177.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 mmmt -59.98 -37.73 80.47 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.613 -1.304 . . . . 4.3399999999999999 113.213 174.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.82 -19.48 62.6 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.4 1.259 . . . . 1.02 114.4 172.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.2 -43.25 19.56 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.669 1.122 . . . . 0.66000000000000003 111.42 164.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -60.96 -43.08 99.23 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 113.375 0.88 . . . . 2.23 113.375 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -56.4 -27.61 56.88 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.076 0.951 . . . . 2.6899999999999999 112.715 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 24.3 mt -77.01 -35.22 57.26 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 121.809 -0.557 . . . . 0.78000000000000003 111.763 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.6 mm -55.28 -40.81 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.244 1.018 . . . . 0.93999999999999995 110.89 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -73.42 -35.14 65.78 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.462 0.912 . . . . 2.98 113.462 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -60.78 -28.05 68.45 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.782 0.833 . . . . 3.2000000000000002 111.914 170.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.4 HD23 HD21 ' A' ' 82' ' ' LEU . 0.3 OUTLIER -85.74 -32.32 21.94 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.904 2.082 . . . . 2.0099999999999998 111.832 174.14 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -67.46 -22.24 65.5 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.114 1.366 . . . . 3.8100000000000001 113.972 172.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.4 -15.5 49.33 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.408 1.262 . . . . 2.48 114.408 169.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -151.37 -31.4 0.16 Allowed 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 118.048 2.61 . . . . 3.96 118.048 -170.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -90.37 100.95 13.69 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 121.427 1.921 . . . . 3.4399999999999999 111.385 -177.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -65.76 -5.23 8.14 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 116.635 2.087 . . . . 3.9300000000000002 116.635 -173.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.34 7.71 8.16 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.629 1.109 . . . . 2.5099999999999998 115.179 -169.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 41.4 mmt-85 -75.28 -179.89 4.73 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.714 1.757 . . . . 4.6299999999999999 109.71 149.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.5 mm -136.34 137.28 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 N-CA-C 106.672 -1.603 . . . . 2.0699999999999998 106.672 166.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.3 m -96.41 146.7 24.54 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.144 0.884 . . . . 2.1099999999999999 110.175 167.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -64.39 -51.34 63.71 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.729 0.641 . . . . 2.54 112.729 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -70.55 -20.67 62.78 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.702 1.201 . . . . 4.6799999999999997 112.953 -177.047 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -63.78 -35.86 82.0 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 121.34 -0.85 . . . . 5.2300000000000004 110.834 173.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -53.85 -52.13 61.39 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.213 -1.555 . . . . 1.72 110.749 170.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 -65.29 -45.82 82.88 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.865 0.866 . . . . 0.70999999999999996 111.465 -175.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 99.5 m -57.83 -46.25 85.01 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 127.102 2.161 . . . . 2.3999999999999999 111.287 177.062 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.451 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 85.1 mt -60.94 -26.52 67.56 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 118.196 -0.907 . . . . 0.75 113.06 174.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 35.9 mm -61.37 -32.69 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 CA-C-N 121.603 2.001 . . . . 0.98999999999999999 112.445 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.59 -28.07 67.16 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.572 1.082 . . . . 0.71999999999999997 112.939 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -72.79 -19.98 79.57 Favored Glycine 0 CA--C 1.533 1.192 0 O-C-N 121.373 -1.075 . . . . 0.62 114.301 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.9 mp -97.47 -35.25 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 CA-C-N 118.451 1.125 . . . . 0.78000000000000003 110.281 166.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.4 m -82.83 56.64 3.49 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.688 1.995 . . . . 1.3700000000000001 110.666 -175.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -131.98 -71.6 0.1 OUTLIER Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.341 1.924 . . . . 1.3300000000000001 111.497 175.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -63.94 -56.04 0.55 Allowed 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.302 2.668 . . . . 1.6200000000000001 111.872 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.3 pt -65.31 -27.16 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 112.966 0.728 . . . . 1.8 112.966 173.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.32 -35.81 78.35 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.429 1.013 . . . . 1.29 113.458 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.4 ptpt -69.25 -32.41 71.6 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.379 -1.451 . . . . 3.2200000000000002 113.478 166.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.96 -37.43 85.97 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 120.457 1.48 . . . . 1.49 112.031 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -47.04 -59.95 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-N 119.785 1.175 . . . . 1.1200000000000001 109.411 162.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -64.72 -19.05 65.55 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.692 1.367 . . . . 2.3100000000000001 114.692 -175.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -74.6 -47.36 32.82 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.307 -0.871 . . . . 3.1699999999999999 112.372 162.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -69.21 -40.01 78.27 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 117.424 -1.274 . . . . 2.3100000000000001 114.065 -172.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -60.37 -17.21 42.04 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 120.023 1.283 . . . . 2.7400000000000002 112.227 173.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.477 0.912 0 O-C-N 120.448 -1.407 . . . . 3.1099999999999999 110.919 172.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 . . . . . 0 CA--C 1.546 0.801 0 CA-C-O 118.592 -0.718 . . . . 2.8700000000000001 111.816 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.36 166.44 14.46 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 119.126 0.876 . . . . 1.0 111.124 -177.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.87 -24.04 66.67 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 118.977 0.808 . . . . 2.8999999999999999 113.155 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.37 -43.67 98.27 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.921 1.237 . . . . 0.85999999999999999 110.036 172.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -71.34 -43.83 66.26 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.742 0.817 . . . . 3.1899999999999999 112.004 175.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 44.7 mmtt -53.52 -42.27 67.22 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.798 1.181 . . . . 6.25 111.101 170.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.42 -45.41 69.25 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 124.331 1.052 . . . . 0.64000000000000001 111.977 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.33 -38.83 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 120.428 1.467 . . . . 0.79000000000000004 110.031 170.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 76.9 mt -59.29 -56.1 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-O 117.694 -1.146 . . . . 0.93000000000000005 111.378 168.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 t -58.21 -35.36 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 126.048 1.739 . . . . 0.69999999999999996 113.46 -177.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.42 -46.96 62.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.503 1.121 . . . . 0.96999999999999997 111.227 174.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 68.0 t -69.13 -34.68 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.976 0.91 . . . . 0.60999999999999999 111.316 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -67.98 -44.55 76.42 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.39 1.476 . . . . 2.6699999999999999 110.445 170.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -55.63 -34.12 64.62 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.977 1.717 . . . . 2.1000000000000001 113.952 175.129 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -73.31 -64.93 0.88 Allowed 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.885 -0.51 . . . . 1.99 111.405 170.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -64.93 -28.89 69.83 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.66 0.985 . . . . 1.8600000000000001 113.66 -169.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -19.97 16.56 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 120.856 1.662 . . . . 2.6499999999999999 113.834 177.24 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -89.94 -0.23 57.45 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.207 1.403 . . . . 2.1299999999999999 114.17 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 33.6 m . . . . . 0 N--CA 1.481 1.104 0 C-N-CA 125.295 1.438 . . . . 2.4100000000000001 110.763 177.244 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 23.9 pt . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 112.583 0.586 . . . . 2.9500000000000002 112.583 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 42.1 t -83.04 148.92 27.25 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.369 -0.832 . . . . 2.9100000000000001 111.233 171.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 18.0 ttpt -56.18 -20.3 17.31 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.734 -1.229 . . . . 2.4300000000000002 112.14 163.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 76.0 p -83.04 -8.32 59.56 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 115.674 1.731 . . . . 1.6699999999999999 115.674 169.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 67.4 m -76.71 -42.09 42.75 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.444 1.474 . . . . 1.1599999999999999 112.692 -176.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -50.86 -54.79 20.89 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.443 1.019 . . . . 1.9299999999999999 112.88 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -54.38 -26.26 29.21 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.292 1.037 . . . . 2.5800000000000001 113.517 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -95.75 -42.37 8.4 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.231 1.813 . . . . 3.1499999999999999 112.238 -174.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.9 tmm? -53.72 -40.06 65.78 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.852 -1.155 . . . . 1.1299999999999999 111.917 163.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.71 -21.36 54.72 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.688 1.366 . . . . 1.02 114.688 168.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -97.24 -5.37 37.0 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.418 1.487 . . . . 2.6099999999999999 112.386 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.85 -33.12 8.99 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.78 1.4 . . . . 1.55 114.78 168.034 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -89.09 -63.87 1.23 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.904 0.881 . . . . 4.0300000000000002 111.521 175.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.35 35.98 0.15 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.045 1.338 . . . . 1.98 112.514 174.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -80.26 3.75 19.88 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.655 2.382 . . . . 1.8999999999999999 114.43 -171.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 151' ' ' HIS . . . . . 0.418 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 17.3 m-70 -117.05 -26.12 6.95 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 118.826 0.739 . . . . 1.6599999999999999 111.611 173.515 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 42.5 tpp -68.43 -26.99 65.8 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.21 2.204 . . . . 2.1299999999999999 112.406 165.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 1.8 pp -123.98 167.25 14.4 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.849 1.66 . . . . 3.3399999999999999 111.131 167.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 21.8 m -167.8 -54.58 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.299 1.84 . . . . 6.4100000000000001 107.479 175.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -63.82 143.93 57.46 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.636 0.732 . . . . 4.2599999999999998 109.678 160.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 5.9 m -65.58 -23.72 66.91 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.602 1.161 . . . . 4.2000000000000002 111.08 172.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.36 -28.39 50.26 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.292 1.425 . . . . 2.3100000000000001 114.793 -178.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -71.25 -61.86 1.61 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 118.133 0.967 . . . . 3.0899999999999999 109.142 168.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.6 ttp-105 -48.56 -21.4 0.57 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.501 1.92 . . . . 4.6699999999999999 116.137 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -45.68 -38.35 6.73 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.635 1.107 . . . . 3.6299999999999999 113.224 164.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -70.94 -18.38 62.64 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 115.286 1.587 . . . . 1.04 115.286 174.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.46 -46.93 12.83 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 120.041 1.291 . . . . 0.73999999999999999 109.926 165.157 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -57.32 -41.96 80.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.544 1.538 . . . . 1.98 112.539 -177.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -58.43 -28.33 65.15 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.445 1.276 . . . . 2.8300000000000001 114.445 174.126 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 52.5 mt -76.98 -35.87 56.86 Favored 'General case' 0 C--O 1.222 -0.388 0 O-C-N 121.908 -0.495 . . . . 0.84999999999999998 110.773 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 14.7 mm -55.38 -40.36 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.607 0.763 . . . . 0.90000000000000002 110.64 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -71.35 -34.76 70.78 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.583 0.957 . . . . 3.1400000000000001 113.583 176.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -64.15 -31.18 72.28 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.973 0.909 . . . . 3.23 111.712 171.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.56 -36.28 57.72 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.123 2.169 . . . . 2.1000000000000001 111.56 172.174 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -70.3 -22.19 62.86 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.631 1.172 . . . . 3.8199999999999998 113.556 177.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -63.61 -13.36 41.41 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.573 1.323 . . . . 2.29 114.573 169.056 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -149.36 -34.07 0.19 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 118.169 2.655 . . . . 3.9199999999999999 118.169 -171.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -88.44 98.21 11.5 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 121.229 1.831 . . . . 3.3300000000000001 111.326 -175.353 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -64.83 -4.21 4.17 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 116.994 2.22 . . . . 3.8799999999999999 116.994 -172.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 120.41 5.67 10.18 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.679 -1.067 . . . . 2.4399999999999999 115.044 -167.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 37.7 mmt-85 -75.94 176.14 8.16 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.829 1.815 . . . . 4.6799999999999997 109.848 150.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 32.7 mm -135.3 136.63 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 106.832 -1.544 . . . . 2.2200000000000002 106.832 167.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 23.8 m -95.21 147.55 23.35 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.837 0.744 . . . . 2.1499999999999999 110.28 168.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -61.87 -51.63 67.41 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.513 0.673 . . . . 2.5 112.384 177.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -70.36 -16.02 62.93 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.562 1.545 . . . . 4.5700000000000003 112.777 -176.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -68.32 -38.02 81.16 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.085 -1.01 . . . . 4.8200000000000003 111.319 174.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -56.16 -45.43 79.68 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 119.963 -1.711 . . . . 1.8200000000000001 111.826 170.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.9 t-105 -68.09 -45.27 74.22 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.309 0.644 . . . . 0.71999999999999997 112.062 -177.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 87.2 m -58.25 -48.23 81.08 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.702 2.001 . . . . 2.2200000000000002 110.783 175.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 84.0 mt -61.25 -27.65 68.6 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.394 0.887 . . . . 0.56000000000000005 113.394 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 23.7 mm -62.12 -39.88 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 CA-C-N 120.851 1.659 . . . . 0.65000000000000002 111.604 176.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -59.34 -30.65 68.21 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.645 1.117 . . . . 0.58999999999999997 113.012 175.125 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -69.12 -20.09 74.54 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-O 118.836 -0.98 . . . . 0.57999999999999996 114.297 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.5 mp -98.27 -36.53 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 119.17 1.485 . . . . 0.79000000000000004 110.912 163.433 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 17.4 m -81.54 64.92 6.46 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.973 2.109 . . . . 1.3999999999999999 110.203 -173.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -137.66 -72.5 0.06 OUTLIER Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.403 1.478 . . . . 0.93000000000000005 111.649 178.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -65.43 -47.74 3.99 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.049 2.5 . . . . 1.1799999999999999 111.563 177.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 10.0 pt -66.99 -25.42 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 112.814 0.672 . . . . 1.23 112.814 174.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.76 -38.2 79.91 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.32 -0.863 . . . . 0.90000000000000002 112.692 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -65.78 -34.23 77.69 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 117.54 -1.219 . . . . 3.3900000000000001 112.922 165.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.2 tt -65.82 -39.43 90.84 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 121.206 1.821 . . . . 1.6100000000000001 111.872 177.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 96.3 mt -48.59 -59.28 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 CA-C-N 119.773 1.17 . . . . 1.0900000000000001 109.655 163.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 21.5 t60 -63.86 -22.37 66.89 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.661 1.356 . . . . 2.21 114.661 -175.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -71.06 -46.29 62.21 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.385 1.074 . . . . 3.1600000000000001 112.106 164.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 25.2 mm100 -68.6 -41.99 78.8 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 117.64 -1.171 . . . . 2.4700000000000002 113.731 -173.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.25 -18.73 28.69 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.616 1.098 . . . . 2.7000000000000002 112.553 174.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -91.38 -47.37 7.5 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.603 -1.31 . . . . 3.1000000000000001 111.064 173.566 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 . . . . . 0 CA--C 1.548 0.891 0 C-N-CA 126.429 1.891 . . . . 5.4400000000000004 113.355 -178.764 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 . . . . . 0 CA--C 1.543 0.701 0 N-CA-C 106.949 -1.5 . . . . 3.2400000000000002 106.949 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 p -57.5 169.02 0.7 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.027 1.731 . . . . 2.1299999999999999 113.799 -163.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.0 -8.94 53.23 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.743 -1.223 . . . . 3.6800000000000002 113.786 172.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.51 -39.94 10.14 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.458 1.026 . . . . 1.1899999999999999 110.641 167.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -77.51 -58.85 3.04 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 120.702 -1.249 . . . . 3.5699999999999998 110.784 -173.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.437 ' O ' HG23 ' A' ' 14' ' ' VAL . 11.9 tptp -56.67 -23.56 42.65 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.865 -0.522 . . . . 5.8600000000000003 111.624 171.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.801 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -66.04 -53.8 33.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.066 -1.021 . . . . 1.3700000000000001 112.785 168.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.03 -36.04 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 CA-C-N 119.865 1.211 . . . . 1.3200000000000001 110.727 174.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.4 mm -54.6 -50.93 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 119.463 1.029 . . . . 2.1000000000000001 110.645 167.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 10' ' ' LYS . 31.0 t -69.67 -29.49 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 124.759 1.224 . . . . 1.4099999999999999 112.188 -174.735 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.2 mp -70.59 -39.79 73.63 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.7 1.137 . . . . 1.54 111.571 170.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.8 t -63.48 -46.46 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.046 0.938 . . . . 1.3500000000000001 111.295 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -65.18 -45.72 83.73 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.362 0.983 . . . . 4.9500000000000002 111.244 172.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -57.85 -27.93 63.67 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 119.534 -1.979 . . . . 3.9199999999999999 113.815 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -74.63 -67.35 0.64 Allowed 'General case' 0 C--O 1.24 0.559 0 C-N-CA 123.266 0.626 . . . . 2.1600000000000001 111.709 165.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -61.11 -34.67 75.33 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 117.578 -1.201 . . . . 2.6200000000000001 112.334 -168.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.8 mtpt -43.54 -51.43 6.79 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 126.861 2.064 . . . . 2.27 113.044 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -81.6 -32.64 31.95 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.788 1.235 . . . . 2.6099999999999999 111.248 -176.284 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 CA--C 1.55 0.949 0 C-N-CA 128.217 2.607 . . . . 3.7799999999999998 110.115 177.628 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 36.3 pt . . . . . 0 N--CA 1.478 0.966 0 CA-C-O 120.68 0.276 . . . . 2.0899999999999999 111.337 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.5 m -78.19 135.98 37.72 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 121.196 -0.94 . . . . 2.4199999999999999 109.072 157.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.5 mttp -59.1 -27.91 66.02 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.069 -1.02 . . . . 2.0800000000000001 112.256 -178.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.2 p -57.37 -30.8 65.17 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.253 1.575 . . . . 1.6399999999999999 115.253 168.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.8 m -71.19 -39.07 72.04 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.641 1.11 . . . . 1.3 112.461 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -50.95 -53.91 28.83 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.038 0.935 . . . . 2.1000000000000001 111.611 176.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 23.7 ptt85 -69.61 -14.42 62.82 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.611 1.337 . . . . 2.9500000000000002 114.611 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -89.18 -46.02 9.12 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.193 0.997 . . . . 4.5199999999999996 111.009 175.01 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 3.3 tmm? -47.45 -47.25 27.1 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.518 1.127 . . . . 1.26 111.69 164.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.5 mt -60.12 -37.29 79.6 Favored 'General case' 0 C--O 1.212 -0.879 0 C-N-CA 123.49 0.716 . . . . 2.0600000000000001 111.655 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -69.96 -14.31 62.65 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 120.001 1.273 . . . . 3.0299999999999998 113.736 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.82 -46.48 3.48 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.391 1.476 . . . . 2.6499999999999999 114.108 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -87.28 -28.17 22.46 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 119.478 1.035 . . . . 3.5899999999999999 111.921 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.48 49.04 0.81 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.87 2.068 . . . . 1.71 110.766 162.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 42.1 p30 -69.05 -178.37 1.24 Allowed 'General case' 0 CA--C 1.548 0.904 0 O-C-N 120.561 -1.337 . . . . 4.6699999999999999 111.467 166.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 61.5 m170 80.29 -32.27 0.12 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 116.872 2.175 . . . . 2.7200000000000002 116.872 158.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.7 ptp -76.21 -19.66 58.18 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 113.383 0.883 . . . . 2.52 113.383 163.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.8 mp -69.28 107.87 3.44 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.505 0.722 . . . . 3.02 110.857 -177.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.5 m -76.58 -19.5 57.81 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.956 0.724 . . . . 4.04 112.956 167.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -162.67 160.61 25.83 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 127.73 2.412 . . . . 3.6899999999999999 107.902 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 p -51.28 -20.93 1.85 Allowed 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 126.455 1.902 . . . . 4.2300000000000004 114.004 164.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -48.88 -34.86 16.46 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-N 120.983 1.719 . . . . 2.1699999999999999 114.291 176.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 30.5 t30 -71.57 -38.71 70.91 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 118.158 0.979 . . . . 3.6099999999999999 112.304 175.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -63.73 -37.56 87.84 Favored 'General case' 0 C--N 1.346 0.446 0 O-C-N 121.003 -1.061 . . . . 4.7000000000000002 112.184 165.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -64.34 -27.48 69.05 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 119.643 -1.911 . . . . 3.23 113.327 174.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.56 -12.95 61.63 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.906 1.076 . . . . 1.0900000000000001 113.906 166.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.75 -46.47 14.2 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.162 0.892 . . . . 1.0900000000000001 111.608 160.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -51.86 -44.01 63.48 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.64 1.176 . . . . 1.8999999999999999 113.259 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -55.92 -28.45 56.88 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.715 1.005 . . . . 3.0899999999999999 113.715 175.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.7 mt -79.39 -41.43 27.76 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.346 1.059 . . . . 0.96999999999999997 111.238 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 mm -53.44 -54.22 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 124.407 1.083 . . . . 0.92000000000000004 110.175 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -58.1 -43.06 86.94 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.234 0.54 . . . . 1.8799999999999999 112.439 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -31.31 70.73 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.374 1.47 . . . . 2.8500000000000001 112.829 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.6 mt -95.05 -23.24 17.43 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 114.01 1.115 . . . . 2.8700000000000001 114.01 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -67.84 -14.67 63.15 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.506 1.503 . . . . 3.0 112.394 170.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.15 -18.73 48.95 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.064 1.505 . . . . 2.5600000000000001 115.064 163.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -130.53 -24.17 2.53 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 116.455 2.02 . . . . 3.2400000000000002 116.455 -166.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -121.88 138.94 54.2 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.288 -1.507 . . . . 4.4400000000000004 112.885 -171.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -96.37 -160.6 0.81 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 126.456 1.902 . . . . 4.5800000000000001 111.072 -175.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.84 -10.74 14.52 Favored Glycine 0 CA--C 1.527 0.793 0 O-C-N 120.011 -1.681 . . . . 2.79 113.843 152.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.7 mmt-85 -69.93 79.1 0.47 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.356 1.578 . . . . 4.8099999999999996 108.992 161.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.4 mt -83.32 135.54 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 N-CA-C 107.505 -1.294 . . . . 2.3599999999999999 107.505 172.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.7 t -104.17 166.45 10.39 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.551 0.691 . . . . 1.6599999999999999 111.79 172.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -78.11 -42.97 30.31 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.273 1.035 . . . . 2.6899999999999999 112.496 -178.164 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.5 p-10 -71.63 -24.1 61.81 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.588 1.955 . . . . 3.6499999999999999 112.644 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -52.86 -57.31 10.65 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.311 1.844 . . . . 2.8799999999999999 111.103 169.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -56.47 -46.73 80.26 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.223 -0.923 . . . . 2.27 111.814 177.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -59.76 -39.94 86.52 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.822 -0.549 . . . . 1.21 111.747 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 73.2 m -63.9 -42.02 97.55 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 126.243 1.817 . . . . 2.0299999999999998 110.769 175.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.01 -38.83 92.22 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 117.929 -1.034 . . . . 0.81999999999999995 113.289 174.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.1 mm -57.75 -34.4 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 120.716 1.598 . . . . 1.1299999999999999 110.947 173.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.02 -6.06 36.32 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.87 1.224 . . . . 1.4099999999999999 114.618 176.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -97.46 -19.85 24.18 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.034 1.417 . . . . 0.73999999999999999 114.599 171.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 5.1 mp -92.89 -35.96 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 118.776 1.288 . . . . 1.6399999999999999 110.451 170.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.8 m -74.42 145.7 43.49 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.575 -0.898 . . . . 2.2799999999999998 108.575 171.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.45 -60.15 0.49 Allowed Glycine 0 CA--C 1.535 1.292 0 CA-C-O 117.086 -1.952 . . . . 0.91000000000000003 115.428 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -65.55 -64.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.81 0 CA-C-N 121.356 2.578 . . . . 1.1599999999999999 111.095 -173.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.5 -7.98 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 112.897 0.703 . . . . 1.72 112.897 175.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.512 ' HA ' HD12 ' A' ' 94' ' ' ILE . . . -58.67 -34.04 70.8 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.846 1.203 . . . . 1.1699999999999999 113.225 -178.321 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -66.68 -27.59 67.78 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.335 -1.478 . . . . 3.7999999999999998 111.873 175.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.1 tt -80.21 -33.56 38.01 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.655 1.582 . . . . 1.47 111.564 174.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.512 HD12 ' HA ' ' A' ' 91' ' ' ALA . 98.0 mt -47.42 -52.49 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 CA-C-N 119.226 0.921 . . . . 0.92000000000000004 110.435 165.249 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -53.53 -42.06 67.02 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.157 1.169 . . . . 3.7000000000000002 114.157 177.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.56 -49.5 76.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.794 0.838 . . . . 6.5 110.731 173.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -60.56 -39.91 89.72 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 120.905 -1.122 . . . . 2.6600000000000001 113.35 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -66.94 -22.71 65.93 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 119.589 1.086 . . . . 3.4399999999999999 112.283 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.414 0 O-C-N 121.162 -0.961 . . . . 2.1099999999999999 112.017 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 106.426 -1.694 . . . . 3.2799999999999998 106.426 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 11.2 p -58.32 168.2 1.15 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 126.214 1.805 . . . . 2.1600000000000001 113.72 -162.143 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.51 -6.88 21.73 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.432 -1.417 . . . . 3.4399999999999999 113.742 171.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.61 -38.72 9.43 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.663 1.12 . . . . 1.0700000000000001 111.344 166.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.87 -58.39 3.29 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 120.537 -1.352 . . . . 3.5 110.407 -174.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 113' ' ' LYS . . . . . 0.461 ' O ' HG23 ' B' ' 117' ' ' VAL . 14.0 tptp -57.84 -26.06 61.51 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 122.087 -0.383 . . . . 6.7000000000000002 110.66 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.801 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -62.23 -55.97 23.25 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 121.477 -0.764 . . . . 1.27 112.887 169.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.25 -35.09 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-N 119.911 1.232 . . . . 1.3300000000000001 110.668 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 19.8 mt -57.68 -44.53 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 118.596 0.635 . . . . 1.3200000000000001 112.167 167.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.461 HG23 ' O ' ' B' ' 113' ' ' LYS . 39.8 t -72.73 -29.46 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 124.26 1.024 . . . . 1.45 111.558 -177.334 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.4 mp -69.68 -43.44 72.51 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.15 0.886 . . . . 1.6599999999999999 111.184 168.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 19.2 t -57.41 -46.76 85.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.566 1.146 . . . . 1.4199999999999999 111.728 171.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -62.31 -51.9 65.81 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.961 0.904 . . . . 4.6799999999999997 111.869 172.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -59.95 -25.59 65.32 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.489 -1.382 . . . . 3.9199999999999999 113.497 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -72.64 -69.54 0.4 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.688 0.795 . . . . 2.52 111.534 164.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -62.98 -32.15 73.42 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 118.328 -0.844 . . . . 2.4300000000000002 113.025 -167.485 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -43.86 -54.23 5.42 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.376 1.87 . . . . 2.2000000000000002 113.2 174.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 125' ' ' TYR . . . . . 0.458 ' CZ ' ' HG3' ' B' ' 144' ' ' MET . 43.1 m-85 -75.5 -30.2 59.78 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 123.531 0.732 . . . . 2.4300000000000002 110.783 -177.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 65.2 t . . . . . 0 CA--C 1.55 0.979 0 C-N-CA 127.683 2.393 . . . . 3.3500000000000001 110.702 178.551 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 35.9 pt . . . . . 0 N--CA 1.473 0.679 0 CA-C-O 121.708 0.766 . . . . 2.0800000000000001 112.403 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 5.5 m -99.07 127.2 44.97 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 121.825 -0.547 . . . . 2.3900000000000001 109.933 176.494 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 32.0 mttp -60.79 -28.63 68.9 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 120.836 -1.165 . . . . 2.0600000000000001 112.256 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 10.8 p -60.2 -33.69 72.58 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.75 1.62 . . . . 1.5900000000000001 113.801 168.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.2 m -79.95 -37.36 34.63 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 118.197 -0.906 . . . . 1.8100000000000001 111.792 174.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -49.05 -54.07 17.49 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.571 1.078 . . . . 2.02 111.878 173.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 14.0 ptt85 -66.08 -17.17 64.53 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 114.211 1.189 . . . . 3.0099999999999998 114.211 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -94.02 -48.12 6.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.205 1.402 . . . . 3.8599999999999999 110.086 -177.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 144' ' ' MET . . . . . 0.458 ' HG3' ' CZ ' ' B' ' 125' ' ' TYR . 5.6 tmm? -45.17 -45.73 11.69 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.118 2.167 . . . . 1.25 112.51 162.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 8.9 mt -54.35 -40.87 68.48 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 123.625 0.77 . . . . 2.2000000000000002 111.292 176.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -71.04 -13.66 62.06 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.634 -1.292 . . . . 2.9700000000000002 113.944 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.76 -53.78 3.31 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.902 1.281 . . . . 1.9299999999999999 113.086 175.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -86.98 -26.96 23.55 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.385 0.539 . . . . 3.6400000000000001 111.657 -174.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -107.61 46.83 0.92 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.921 2.089 . . . . 1.8 110.951 164.236 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 48.9 p30 -65.84 -178.38 0.57 Allowed 'General case' 0 CA--C 1.554 1.109 0 O-C-N 120.952 -1.093 . . . . 4.79 111.864 168.203 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 60.6 m170 79.17 -35.43 0.16 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 117.168 2.284 . . . . 2.6499999999999999 117.168 156.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 10.5 ptp -73.46 -19.37 60.96 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 118.716 0.689 . . . . 2.4199999999999999 112.77 162.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.33 99.83 0.58 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.935 0.894 . . . . 2.9500000000000002 111.04 -172.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 1.2 m -75.14 -14.7 60.58 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.259 1.024 . . . . 4.21 113.378 175.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -167.22 159.97 13.29 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 128.574 2.749 . . . . 3.8900000000000001 108.035 166.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 72.9 p -50.01 -24.19 2.47 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.035 1.734 . . . . 5.0099999999999998 113.5 165.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -51.71 -29.67 26.24 Favored Glycine 0 CA--C 1.529 0.967 0 CA-C-N 120.822 1.646 . . . . 2.3700000000000001 114.073 174.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -74.31 -36.16 63.71 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 118.3 1.05 . . . . 3.4700000000000002 112.377 174.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 17.4 ttt-85 -64.12 -39.56 94.3 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.994 0.815 . . . . 4.5999999999999996 111.884 162.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.6 mtmt -65.8 -20.95 66.44 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 119.893 -1.754 . . . . 3.54 113.652 174.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 161' ' ' ALA . . . . . 0.428 ' HA ' ' HG2' ' B' ' 164' ' ' LYS . . . -73.18 -10.39 59.72 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.239 -0.913 . . . . 1.28 113.447 168.367 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.02 -44.44 15.21 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 117.334 -1.317 . . . . 1.1100000000000001 111.471 158.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 163' ' ' ASP . . . . . 0.408 ' HA ' HG12 ' B' ' 166' ' ' ILE . 1.8 m-20 -48.52 -44.59 36.31 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 120.86 1.664 . . . . 1.9399999999999999 113.632 176.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 164' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' B' ' 161' ' ' ALA . 3.0 ptmm? -55.37 -30.29 60.06 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.105 1.15 . . . . 3.7400000000000002 114.105 174.006 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 39.5 mt -78.4 -38.25 42.04 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.481 -0.762 . . . . 1.1899999999999999 111.892 173.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 166' ' ' ILE . . . . . 0.408 HG12 ' HA ' ' B' ' 163' ' ' ASP . 9.5 mm -58.8 -53.39 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 124.004 0.815 . . . . 1.22 109.669 -174.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -60.61 -31.34 70.52 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.256 0.835 . . . . 2.1000000000000001 113.256 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -73.84 -39.9 63.69 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.927 1.691 . . . . 2.6099999999999999 112.738 176.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.02 -18.02 22.29 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 114.09 1.144 . . . . 3.0899999999999999 114.09 -173.419 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -58.88 -24.2 61.92 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.847 1.259 . . . . 3.0800000000000001 113.021 166.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.58 -24.75 45.35 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.065 1.135 . . . . 2.3399999999999999 114.065 169.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -109.34 -16.49 14.02 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.739 1.385 . . . . 2.5899999999999999 114.739 -170.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 5.7 t-80 -142.08 97.2 3.09 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 120.57 -1.331 . . . . 3.52 112.576 -163.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -65.49 167.52 8.68 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 108.857 -0.794 . . . . 4.7999999999999998 108.857 149.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -67.39 31.35 0.21 Allowed Glycine 0 CA--C 1.527 0.818 0 C-N-CA 126.113 1.816 . . . . 3.1099999999999999 116.799 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 30.8 mmt-85 -76.24 50.57 0.64 Allowed 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.476 1.638 . . . . 5.25 109.864 161.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.9 mt -62.29 136.71 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.023 1.329 . . . . 2.6499999999999999 111.144 -162.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 12.8 t -117.83 155.91 29.28 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.667 1.187 . . . . 2.5699999999999998 109.471 167.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -56.35 -34.78 66.94 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.488 1.115 . . . . 2.54 113.122 -173.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -68.52 -21.78 64.56 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.773 2.029 . . . . 3.9199999999999999 114.052 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -66.96 -58.63 4.59 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.008 1.277 . . . . 3.0899999999999999 110.944 178.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -50.03 -49.56 50.48 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.787 -0.571 . . . . 2.2599999999999998 111.706 172.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -61.17 -39.57 90.61 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.725 -0.609 . . . . 1.26 112.085 -176.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 27.5 m -64.85 -44.18 90.58 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.746 1.618 . . . . 2.0299999999999998 110.86 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 88.4 mt -64.83 -36.47 84.45 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 117.847 -1.073 . . . . 1.02 113.097 177.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 34.5 mm -56.21 -45.32 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 CA-C-N 120.898 1.681 . . . . 1.0600000000000001 111.344 172.073 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -64.82 -19.4 65.32 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 123.849 0.738 . . . . 1.1200000000000001 113.272 177.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.37 -20.82 65.94 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-O 118.257 -1.302 . . . . 1.03 113.915 173.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.3 mp -86.95 -43.09 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 CA-C-N 119.607 1.704 . . . . 1.1799999999999999 109.994 164.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 11.5 m -77.92 66.01 3.48 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.868 1.667 . . . . 1.53 111.375 -168.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -131.91 -75.39 0.12 Allowed Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.853 1.692 . . . . 1.3200000000000001 112.961 -174.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.52 -59.43 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.256 2.638 . . . . 1.47 112.753 -168.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.3 pp -69.08 -11.55 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 113.282 0.845 . . . . 1.6299999999999999 113.282 -173.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 194' ' ' ALA . . . . . 0.489 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -56.5 -35.9 68.53 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.624 1.102 . . . . 1.27 112.899 175.201 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -74.08 -10.24 59.43 Favored 'General case' 0 CA--C 1.55 0.979 0 O-C-N 120.287 -1.508 . . . . 4.2999999999999998 112.785 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.1 tt -93.88 -30.33 14.84 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.176 2.19 . . . . 1.8100000000000001 112.377 166.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 197' ' ' ILE . . . . . 0.489 HD12 ' HA ' ' B' ' 194' ' ' ALA . 91.6 mt -49.24 -48.14 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 120.661 -1.274 . . . . 1.0600000000000001 109.558 165.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -57.21 -30.31 64.46 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 115.458 1.651 . . . . 3.5699999999999998 115.458 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.67 -54.14 15.27 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.846 -0.427 . . . . 6.1799999999999997 109.846 168.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -58.8 -41.69 87.36 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.791 1.404 . . . . 2.7599999999999998 114.791 -172.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -69.66 -17.65 63.52 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 119.541 1.064 . . . . 3.25 112.471 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.8 -50.82 4.3 Favored 'General case' 0 CA--C 1.514 -0.409 0 O-C-N 121.232 -0.918 . . . . 1.98 111.735 177.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 CA--C 1.539 0.544 0 CA-C-N 114.954 -1.021 . . . . 4.2199999999999998 112.757 -179.081 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 111.942 0.349 . . . . 2.0699999999999998 111.942 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.9 t -64.69 151.9 43.8 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.48 0.712 . . . . 3.0099999999999998 110.329 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.425 ' HG2' HG21 ' B' ' 117' ' ' VAL . 4.5 tp10 -51.09 -38.95 54.82 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.484 1.114 . . . . 2.5299999999999998 112.033 -173.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.54 -49.16 73.39 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.281 1.432 . . . . 0.81999999999999995 111.611 178.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -72.95 -46.14 54.13 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.521 -0.737 . . . . 3.1699999999999999 111.341 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.85 -37.13 18.6 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.635 0.731 . . . . 6.0899999999999999 110.951 169.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.822 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -75.96 -47.35 25.43 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.301 1.44 . . . . 0.53000000000000003 112.326 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 74.3 t -54.66 -38.5 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 120.027 1.285 . . . . 0.62 110.398 171.285 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 85.5 mt -60.37 -55.01 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 118.403 -0.808 . . . . 0.93000000000000005 110.364 170.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.4 t -56.09 -40.98 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.537 1.062 . . . . 0.64000000000000001 112.569 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -64.35 -36.98 85.88 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.265 -0.897 . . . . 1.0700000000000001 111.566 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.5 t -80.84 -35.98 15.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 124.363 1.065 . . . . 0.73999999999999999 111.339 -178.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.457 ' CD ' ' HZ2' ' A' ' 21' ' ' LYS . 14.6 tm-20 -54.83 -49.96 69.78 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.032 0.933 . . . . 2.8799999999999999 109.98 164.541 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.535 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 6.3 t30 -66.14 -9.48 31.94 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.496 1.295 . . . . 2.6400000000000001 114.496 -170.258 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -112.46 -50.42 2.9 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.729 1.211 . . . . 2.5600000000000001 113.631 -178.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -59.68 -25.87 65.1 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.368 1.44 . . . . 2.02 112.912 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.535 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 7.3 ptmt -53.64 -20.45 5.29 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.623 -1.298 . . . . 2.1099999999999999 114.437 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -80.3 -2.86 47.05 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.43 1.27 . . . . 2.5800000000000001 114.43 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.475 0.821 0 C-N-CA 126.298 1.839 . . . . 2.7000000000000002 109.53 171.285 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.9 pt . . . . . 0 CA--C 1.537 0.465 0 N-CA-C 109.735 -0.468 . . . . 2.5 109.735 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.7 t -71.82 129.72 39.33 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 120.549 -1.344 . . . . 2.79 109.932 166.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.6 mttp -61.53 -20.52 63.34 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.023 -1.048 . . . . 2.2999999999999998 111.815 173.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.8 m -68.72 -28.41 66.8 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.357 -0.839 . . . . 2.3599999999999999 112.99 172.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.2 m -74.98 -21.42 59.16 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 120.029 1.286 . . . . 1.25 113.71 -173.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -63.15 -57.26 11.14 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.656 -1.278 . . . . 1.8600000000000001 112.021 165.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -60.65 -30.06 69.65 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.849 -0.532 . . . . 2.9199999999999999 112.227 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.98 -58.64 5.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.31 2.244 . . . . 3.5099999999999998 110.266 171.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -52.53 -37.66 58.05 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 127.798 2.439 . . . . 1.3999999999999999 113.868 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 58.9 mt -56.68 -16.17 5.83 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 115.088 1.514 . . . . 1.1899999999999999 115.088 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . 0.253 0.1 OUTLIER -110.87 11.42 22.36 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 115.058 1.503 . . . . 2.2000000000000002 115.058 171.786 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.94 -56.28 2.22 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.54 1.136 . . . . 1.76 111.532 164.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -81.28 -46.86 14.14 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.327 -0.858 . . . . 3.1200000000000001 112.344 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.43 15.4 3.06 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.385 -1.447 . . . . 2.0899999999999999 114.295 -172.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.15 29.69 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 130.582 3.553 . . . . 2.3300000000000001 118.226 -174.087 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.428 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 21.4 m-70 -126.89 -67.1 0.87 Allowed 'General case' 0 CA--C 1.545 0.786 0 O-C-N 120.07 -1.644 . . . . 1.75 111.705 -178.054 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.3 ptp -65.3 -11.83 45.61 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.301 1.41 . . . . 2.1499999999999999 114.181 167.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.4 tp -58.44 99.54 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.12 1.768 . . . . 2.3500000000000001 110.286 -176.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.19 61.39 6.8 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.412 1.085 . . . . 4.4500000000000002 110.143 -171.569 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.1 t70 48.1 -135.74 1.04 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 127.318 2.247 . . . . 5.0 112.904 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.4 p -76.61 -37.89 55.67 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 127.082 2.153 . . . . 2.75 111.18 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.82 -40.58 93.19 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 119.166 0.893 . . . . 1.6499999999999999 111.824 175.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -68.81 -56.91 6.51 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.326 1.051 . . . . 3.1400000000000001 111.259 172.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -56.4 -39.27 72.72 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 114.459 1.281 . . . . 4.8499999999999996 114.459 -176.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 48.6 mmtt -54.15 -38.19 65.24 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.67 1.577 . . . . 3.02 113.45 174.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.14 -30.02 61.54 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.869 -1.062 . . . . 1.0700000000000001 113.423 175.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.61 -47.96 65.33 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.173 0.897 . . . . 0.81000000000000005 111.206 171.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -63.46 -32.36 73.78 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.433 1.093 . . . . 2.04 112.825 -175.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -57.27 -32.24 66.41 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 119.287 0.949 . . . . 3.3399999999999999 113.35 173.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -75.58 -43.54 47.77 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.01 0.924 . . . . 0.93999999999999995 111.637 175.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 27.0 mm -59.88 -45.21 95.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 117.847 0.294 . . . . 1.05 110.671 -170.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -59.28 -40.4 85.98 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.837 0.827 . . . . 2.3700000000000001 113.094 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -65.2 -23.83 67.2 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.794 1.238 . . . . 2.9900000000000002 112.486 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -93.21 -33.68 13.89 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 125.827 1.651 . . . . 2.3700000000000001 113.171 174.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -58.71 -28.87 66.21 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.663 -1.273 . . . . 2.7200000000000002 112.961 163.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.34 -14.43 62.92 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.115 1.524 . . . . 1.9199999999999999 115.115 167.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -136.69 3.1 2.72 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.972 1.841 . . . . 2.5499999999999998 115.972 -165.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.414 ' CD2' ' HA ' ' A' ' 74' ' ' ILE . 0.2 OUTLIER -150.54 127.89 11.37 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 119.789 -1.819 . . . . 3.3799999999999999 112.231 -171.809 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -58.71 13.13 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 130.494 3.518 . . . . 4.7699999999999996 115.134 173.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.47 -18.96 4.12 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 118.537 -2.602 . . . . 3.2400000000000002 111.745 -162.279 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -44.19 135.83 4.22 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.181 1.49 . . . . 4.5 107.232 150.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.414 ' HA ' ' CD2' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -140.23 146.77 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.983 0.897 . . . . 3.3500000000000001 109.367 171.955 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 16.1 m -56.69 167.82 0.69 Allowed 'General case' 0 CA--C 1.552 1.057 0 CA-C-O 121.995 0.902 . . . . 1.8700000000000001 111.969 162.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -76.23 -33.16 59.21 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-O 124.258 1.98 . . . . 2.3100000000000001 109.874 160.221 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.31 -20.38 48.09 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 130.284 3.434 . . . . 3.6699999999999999 110.859 -162.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -68.11 -58.46 4.44 Favored 'General case' 0 C--O 1.22 -0.475 0 C-N-CA 127.242 2.217 . . . . 4.8499999999999996 111.859 176.118 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -48.32 -49.14 35.26 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 121.395 1.907 . . . . 1.75 111.937 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 14.7 t-105 -59.68 -47.71 84.56 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 118.802 -0.618 . . . . 1.0 110.84 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 94.6 m -58.59 -51.29 70.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.958 1.303 . . . . 2.5899999999999999 111.249 175.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.8 mt -58.6 -33.35 69.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.33 1.452 . . . . 1.1599999999999999 113.227 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 19.5 mm -50.6 -42.48 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 CA-C-N 120.441 1.473 . . . . 0.68999999999999995 111.047 173.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.94 -17.88 37.96 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.455 1.026 . . . . 0.70999999999999996 114.776 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.75 -24.21 60.69 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-N 118.472 1.136 . . . . 0.78000000000000003 113.741 174.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.6 mp -95.32 -44.32 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 119.398 1.599 . . . . 0.73999999999999999 109.704 169.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.8 m -74.29 54.07 0.54 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.167 2.187 . . . . 1.25 109.983 165.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -124.1 -77.79 0.35 Allowed Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.532 1.539 . . . . 0.81000000000000005 111.182 177.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.88 -46.84 0.68 Allowed 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 123.323 2.682 . . . . 0.93000000000000005 112.685 -174.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -76.11 -16.38 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 113.195 0.813 . . . . 1.28 113.195 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.89 -31.38 64.64 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.34 0.867 . . . . 1.22 113.34 -169.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -45.84 90.87 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.283 -0.886 . . . . 2.8599999999999999 111.777 168.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -57.81 -36.75 72.67 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 123.83 0.852 . . . . 1.6799999999999999 111.493 -173.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.1 mt -48.42 -59.7 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.72 1.208 . . . . 1.1299999999999999 110.699 171.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -64.39 -32.93 74.75 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.379 -0.825 . . . . 1.8200000000000001 112.978 -176.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.322 3.1 pt-20 -81.91 -22.66 36.68 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 112.989 0.737 . . . . 2.9100000000000001 112.989 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -68.15 -41.48 81.51 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 125.381 1.472 . . . . 3.0 113.761 167.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.08 -40.42 76.91 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.642 1.11 . . . . 2.6699999999999999 110.371 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 . . . . . 0 N--CA 1.476 0.855 0 C-N-CA 123.339 0.656 . . . . 3.1400000000000001 111.28 173.899 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.428 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 15.6 m-85 . . . . . 0 N--CA 1.472 0.642 0 N-CA-C 113.481 0.919 . . . . 2.3700000000000001 113.481 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.4 t -67.43 152.92 44.84 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.514 0.726 . . . . 3.27 111.73 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -64.86 -31.65 72.98 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 114.149 1.166 . . . . 2.5899999999999999 114.149 -159.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.77 -46.39 84.62 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.524 1.056 . . . . 0.87 110.184 177.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.25 -50.34 22.85 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.136 -0.935 . . . . 3.1099999999999999 110.913 -176.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -38.43 -50.17 1.5 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.479 1.036 . . . . 4.1600000000000001 113.239 164.065 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.822 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.19 -37.39 80.89 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 118.234 -0.889 . . . . 0.5 112.553 -177.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 70.4 t -61.43 -40.2 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.842 1.201 . . . . 0.62 110.477 169.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 48.0 mt -58.72 -51.12 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 119.452 1.024 . . . . 0.77000000000000002 109.894 170.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.425 HG21 ' HG2' ' A' ' 7' ' ' GLU . 19.7 t -61.95 -41.02 89.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.799 1.24 . . . . 0.56999999999999995 112.717 -176.044 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.7 mp -63.72 -43.39 96.68 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.287 -0.883 . . . . 0.96999999999999997 111.078 175.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 54.1 t -71.66 -36.16 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.861 0.865 . . . . 0.63 112.142 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 120' ' ' GLU . . . . . 0.431 ' CD ' ' HZ2' ' B' ' 124' ' ' LYS . 10.0 tm-20 -55.07 -51.06 67.55 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.496 1.118 . . . . 3.21 110.358 166.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 121' ' ' ASN . . . . . 0.54 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 5.5 t30 -64.32 -6.52 7.14 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.947 1.462 . . . . 2.4700000000000002 114.947 -174.377 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -110.24 -57.37 2.21 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.988 1.315 . . . . 2.25 112.856 -178.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -61.5 -20.86 63.67 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.426 1.012 . . . . 2.0899999999999999 113.45 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 124' ' ' LYS . . . . . 0.54 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 5.9 ptmt -53.86 -19.36 4.33 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 120.278 -1.513 . . . . 2.0 114.598 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -81.14 -1.66 45.35 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 114.406 1.261 . . . . 2.52 114.406 174.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 29.4 m . . . . . 0 N--CA 1.477 0.918 0 C-N-CA 125.503 1.521 . . . . 2.5899999999999999 110.778 172.569 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 29.7 pt . . . . . 0 N--CA 1.468 0.475 0 N-CA-C 108.72 -0.845 . . . . 2.54 108.72 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 41.7 t -61.21 122.2 14.47 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.918 -1.114 . . . . 2.6800000000000002 109.726 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 14.2 mttp -64.45 -17.35 63.74 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 120.961 -1.087 . . . . 2.6400000000000001 111.379 177.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 37.0 m -63.98 -29.54 70.69 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.331 -0.856 . . . . 2.2799999999999998 112.778 167.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 58.6 m -74.83 -20.89 59.57 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.967 1.258 . . . . 1.3 113.733 -174.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.18 -58.68 5.38 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.171 1.35 . . . . 1.97 110.744 167.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.6 ptt180 -60.49 -27.04 67.27 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.658 -0.651 . . . . 3.3799999999999999 112.475 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -66.82 -58.61 4.69 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.259 1.824 . . . . 3.6200000000000001 110.601 169.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.9 tmm? -50.98 -39.11 54.71 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 127.744 2.418 . . . . 1.25 113.514 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 75.2 mt -63.14 -0.03 0.69 Allowed 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 116.106 1.891 . . . . 1.5700000000000001 116.106 175.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . 0.263 0.1 OUTLIER -118.46 9.88 12.49 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.27 1.582 . . . . 2.1899999999999999 115.27 164.044 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.91 -64.36 1.19 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.29 1.436 . . . . 1.75 111.826 168.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -76.57 -30.2 56.95 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.778 0.717 . . . . 3.1299999999999999 111.511 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 mp -100.98 77.78 1.87 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.777 0.798 . . . . 1.8799999999999999 110.87 165.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -109.68 0.7 19.09 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.74 1.385 . . . . 2.0699999999999998 114.74 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -109.9 -39.83 4.95 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.9 1.227 . . . . 1.6299999999999999 113.671 -171.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 17.3 ptp -85.41 -15.78 41.94 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.766 -1.209 . . . . 2.3999999999999999 113.714 171.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.65 103.41 0.25 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 126.357 1.863 . . . . 2.3399999999999999 111.575 -166.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.406 ' H ' ' ND2' ' B' ' 158' ' ' ASN . 0.9 OUTLIER -85.14 59.1 5.42 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.076 0.951 . . . . 4.5300000000000002 110.841 -172.995 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 155' ' ' ASP . . . . . 0.417 ' CG ' ' H ' ' B' ' 156' ' ' THR . 35.3 t70 50.19 -139.7 0.86 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 127.042 2.137 . . . . 4.8099999999999996 112.395 -176.486 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 156' ' ' THR . . . . . 0.417 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 18.9 p -77.34 -35.58 54.58 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 126.669 1.988 . . . . 2.9900000000000002 111.485 -167.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.3 -41.65 95.11 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 119.773 1.17 . . . . 1.72 111.509 176.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 158' ' ' ASN . . . . . 0.406 ' ND2' ' H ' ' B' ' 154' ' ' SER . 35.0 t-20 -66.62 -55.82 13.53 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.955 1.302 . . . . 3.0099999999999998 111.346 173.361 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -53.36 -39.36 64.12 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.573 1.323 . . . . 5.0 114.573 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -60.34 -33.6 72.63 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.603 1.547 . . . . 3.0800000000000001 113.511 177.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -56.21 -28.16 57.31 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 118.148 -0.929 . . . . 1.05 113.095 175.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.73 -48.68 63.19 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 118.757 0.708 . . . . 0.92000000000000004 111.657 169.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -65.88 -30.87 71.54 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.174 0.99 . . . . 2.2200000000000002 113.174 -173.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 23.5 mtmt -58.16 -30.38 66.34 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.19 0.905 . . . . 3.4500000000000002 113.351 171.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 5.9 mt -80.77 -42.51 21.65 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.145 0.978 . . . . 1.02 111.742 174.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 16.1 mm -58.12 -44.73 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 CA-C-N 118.556 0.617 . . . . 1.0800000000000001 110.701 -173.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -56.49 -42.23 77.94 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.655 0.613 . . . . 2.5800000000000001 112.655 177.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -65.57 -25.8 67.58 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.504 1.121 . . . . 2.79 113.275 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.24 -37.47 9.66 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.888 1.275 . . . . 2.6499999999999999 113.131 -177.731 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -65.69 -22.45 66.63 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 120.904 -1.122 . . . . 3.2400000000000002 112.418 165.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.57 -23.54 62.62 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.729 1.381 . . . . 2.0099999999999998 114.729 164.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -118.31 -9.86 10.33 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.853 1.797 . . . . 2.5299999999999998 115.853 -169.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -140.83 129.44 22.76 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 120.887 1.676 . . . . 3.9900000000000002 112.721 -171.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -64.09 70.41 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 126.993 2.117 . . . . 4.6299999999999999 112.986 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 57.05 -1.75 0.11 Allowed Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.467 1.508 . . . . 3.96 114.209 -167.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 15.3 mmt85 -69.39 144.53 53.36 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 118.675 1.237 . . . . 4.7400000000000002 109.1 -172.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.7 mt -126.86 138.15 55.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 104.767 -2.309 . . . . 3.9300000000000002 104.767 156.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 39.3 m -74.98 -100.31 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.663 -0.648 . . . . 2.21 110.086 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -151.85 -66.72 0.17 Allowed 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.278 -1.513 . . . . 2.4199999999999999 109.339 166.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -22.2 -46.91 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 130.486 3.515 . . . . 3.2200000000000002 114.808 149.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -48.63 -61.65 1.92 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.583 1.953 . . . . 4.7999999999999998 115.291 169.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -54.85 -42.54 72.11 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 119.759 -1.838 . . . . 1.8300000000000001 111.56 -178.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 18.6 t-105 -62.09 -44.75 95.98 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.959 0.903 . . . . 0.94999999999999996 111.509 178.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 90.6 m -61.26 -44.93 96.44 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.956 1.702 . . . . 2.4500000000000002 111.302 174.085 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.7 mt -62.28 -32.67 73.42 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 117.32 -1.324 . . . . 1.0800000000000001 112.794 177.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 26.4 mm -52.94 -42.13 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 121.556 1.98 . . . . 0.65000000000000002 110.684 173.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.82 -9.86 35.55 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 125.153 1.358 . . . . 0.68000000000000005 115.115 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -83.67 -21.67 57.49 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-N 119.023 1.412 . . . . 0.85999999999999999 113.528 169.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.7 mp -100.12 -52.1 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 118.771 1.285 . . . . 0.80000000000000004 109.187 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 18.2 m -75.46 58.89 1.05 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.395 2.278 . . . . 1.4099999999999999 109.269 166.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -141.94 -70.54 0.03 OUTLIER Glycine 0 CA--C 1.526 0.725 0 C-N-CA 126.183 1.849 . . . . 0.93000000000000005 110.15 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.23 -51.67 3.35 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.959 2.439 . . . . 1.1299999999999999 112.051 175.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 1.8 pp -81.64 -13.74 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 113.038 0.755 . . . . 1.3100000000000001 113.038 -174.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.26 -31.64 72.12 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.221 0.822 . . . . 1.0700000000000001 113.221 -170.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.62 -46.82 77.33 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.538 -0.726 . . . . 2.9300000000000002 112.558 167.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.9 tt -60.17 -34.62 73.83 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.588 -0.72 . . . . 1.3999999999999999 111.379 -172.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 62.3 mt -51.46 -61.91 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.65 1.18 . . . . 1.0700000000000001 109.853 171.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -59.47 -36.15 75.45 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.835 0.68 . . . . 1.97 112.835 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.345 3.1 pt-20 -80.19 -22.29 42.06 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 112.746 0.647 . . . . 2.9900000000000002 112.746 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -70.61 -39.87 73.5 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 125.003 1.321 . . . . 2.8199999999999998 113.617 167.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -53.54 -40.81 65.81 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.918 1.235 . . . . 2.52 110.506 175.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -48.13 76.62 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.267 1.027 . . . . 3.2400000000000002 110.936 177.11 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 . . . . . 0 CA--C 1.541 0.622 0 N-CA-C 113.725 1.009 . . . . 5.7199999999999998 113.725 179.798 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 . . . . . 0 C--O 1.246 0.9 0 CA-C-O 119.748 -0.168 . . . . 2.1800000000000002 111.148 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.0 p -75.13 165.75 24.73 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.185 0.594 . . . . 1.05 111.962 -175.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -58.68 -44.98 90.39 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.445 0.698 . . . . 2.7000000000000002 110.643 173.085 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.87 -38.61 86.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.194 1.398 . . . . 0.93999999999999995 110.134 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -73.09 -53.79 10.16 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.085 -1.01 . . . . 2.9500000000000002 110.931 -177.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.0 mmtp -54.82 -33.32 61.45 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.777 -1.202 . . . . 4.8399999999999999 112.296 168.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.795 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.95 -45.09 83.03 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 117.955 -1.022 . . . . 0.75 112.425 169.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.6 t -58.53 -38.62 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-N 120.745 1.611 . . . . 0.89000000000000001 110.458 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.7 mt -56.34 -52.95 45.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 118.042 -0.98 . . . . 1.05 111.323 165.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -61.52 -33.93 59.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 120.759 1.618 . . . . 0.72999999999999998 114.094 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.19 -36.48 79.64 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 120.424 -1.422 . . . . 1.01 111.124 172.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 43.9 t -74.35 -34.94 38.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 123.707 0.803 . . . . 0.68000000000000005 110.855 178.172 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.55 -53.8 54.05 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.897 1.279 . . . . 3.4500000000000002 111.122 164.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.465 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 21.0 t-20 -52.93 -28.92 25.71 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.83 1.418 . . . . 3.5499999999999998 114.83 -178.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -81.33 -61.75 1.85 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.121 0.785 . . . . 2.2400000000000002 113.121 168.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -64.0 -29.12 70.3 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.736 0.643 . . . . 1.8100000000000001 112.736 -167.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.465 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 12.5 ptmt -51.36 -27.19 9.14 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.867 1.062 . . . . 2.3399999999999999 113.867 173.574 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -94.95 -8.97 35.44 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 115.362 1.616 . . . . 2.6800000000000002 115.362 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.7 m . . . . . 0 N--CA 1.484 1.257 0 CA-C-N 120.312 1.415 . . . . 2.5 109.606 167.609 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 15.4 tt . . . . . 0 N--CA 1.468 0.457 0 N-CA-C 109.115 -0.698 . . . . 3.1899999999999999 109.115 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.8 t -113.36 163.53 14.73 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.729 0.776 . . . . 2.2999999999999998 110.623 167.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -53.63 -27.66 28.44 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.385 1.074 . . . . 4.6200000000000001 113.696 168.315 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.9 p -72.36 -25.81 61.67 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.695 0.998 . . . . 2.3599999999999999 113.695 172.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 m -78.08 -49.1 14.59 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.805 0.842 . . . . 1.54 111.257 -175.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -48.07 -57.61 5.58 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.798 1.239 . . . . 2.2400000000000002 112.024 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 13.4 ptt85 -59.23 -15.53 15.82 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.011 1.115 . . . . 4.29 114.011 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -109.66 -26.05 10.09 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 114.513 1.301 . . . . 3.3300000000000001 114.513 -176.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 10.5 tmm? -53.06 -45.48 68.13 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 109.003 -0.74 . . . . 1.7 109.003 151.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.8 mt -64.1 -11.77 33.04 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.114 1.524 . . . . 1.25 115.114 172.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -101.23 -23.3 14.45 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.1 0.96 . . . . 2.3799999999999999 113.582 172.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -99.71 -41.28 7.36 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.257 1.206 . . . . 1.71 114.257 178.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -100.95 -20.45 15.43 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.89 1.276 . . . . 3.1099999999999999 114.356 -168.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.5 mt -118.48 41.4 2.98 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.534 1.534 . . . . 2.48 111.406 165.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -70.72 -15.94 62.74 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.648 1.351 . . . . 1.46 114.648 -172.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -94.59 -15.44 24.06 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.547 1.067 . . . . 1.8300000000000001 112.542 -170.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.2 mmm -80.64 14.62 2.02 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 126.153 1.781 . . . . 1.9299999999999999 114.703 174.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.3 mp -99.01 128.37 45.13 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.758 2.023 . . . . 3.0099999999999998 111.914 -176.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -109.49 -1.94 17.98 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.722 1.209 . . . . 4.5800000000000001 112.78 169.086 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -177.5 170.06 2.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 129.758 3.223 . . . . 4.3200000000000003 106.387 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -31.83 -39.08 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 125.329 1.452 . . . . 2.3700000000000001 112.573 147.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.13 -41.08 52.88 Favored Glycine 0 N--CA 1.473 1.16 0 C-N-CA 128.806 3.098 . . . . 1.6799999999999999 115.608 -171.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -59.22 -41.17 88.03 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 117.874 0.837 . . . . 3.4700000000000002 110.563 172.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 74.8 mtm-85 -73.5 -36.58 65.78 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 118.169 -0.919 . . . . 4.8499999999999996 112.79 172.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.3 mtmm -54.88 -28.94 54.11 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 121.485 1.948 . . . . 5.0599999999999996 112.516 171.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.12 -19.16 60.67 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 115.592 1.701 . . . . 1.23 115.592 170.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.87 -52.67 9.84 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.565 1.146 . . . . 0.81000000000000005 110.191 161.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -66.42 -31.33 72.02 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.984 0.914 . . . . 2.1600000000000001 112.493 -170.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.8 ptmm? -55.76 -25.0 38.63 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.302 1.223 . . . . 3.54 114.302 166.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 12.0 mt -84.92 -43.09 14.37 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.31 1.044 . . . . 0.78000000000000003 111.379 172.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.7 mm -51.83 -39.74 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.102 1.361 . . . . 0.80000000000000004 112.12 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -69.91 -30.13 67.47 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.348 1.459 . . . . 1.9099999999999999 113.899 177.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -85.66 -23.75 27.34 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.09 1.756 . . . . 3.3399999999999999 112.742 175.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.14 -26.09 68.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.868 1.267 . . . . 4.0099999999999998 112.456 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -67.11 -13.25 61.76 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.485 1.914 . . . . 2.7999999999999998 114.499 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -78.69 -6.11 54.89 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.192 0.812 . . . . 4.0599999999999996 113.192 166.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -132.07 -34.54 1.26 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.78 1.232 . . . . 3.9199999999999999 114.192 -169.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.8 m170 -110.28 67.78 0.65 Allowed 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.345 -1.472 . . . . 4.3700000000000001 114.764 -165.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -74.44 67.17 1.44 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.564 1.545 . . . . 4.3200000000000003 111.996 173.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.67 -40.0 0.94 Allowed Glycine 0 CA--C 1.532 1.147 0 C-N-CA 126.285 1.898 . . . . 2.52 113.502 -177.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -68.14 76.51 0.24 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 127.924 2.489 . . . . 8.4700000000000006 110.369 173.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.7 mm -65.58 139.01 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 O-C-N 121.425 -0.797 . . . . 2.73 109.814 171.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 t -91.92 167.27 12.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.414 1.086 . . . . 1.6599999999999999 112.864 176.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -72.72 -57.8 3.83 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.752 0.787 . . . . 2.0800000000000001 109.731 160.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.09 -35.81 62.5 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.933 2.093 . . . . 3.3700000000000001 112.946 -167.2 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -73.23 -22.89 60.33 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 113.722 1.008 . . . . 5.9400000000000004 113.722 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -57.01 -48.81 77.59 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 119.552 -1.968 . . . . 2.0800000000000001 110.51 166.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.7 t-105 -67.2 -41.99 84.91 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.691 -0.671 . . . . 0.84999999999999998 111.502 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.62 -41.66 92.45 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 119.342 0.973 . . . . 2.7400000000000002 112.049 171.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.66 -37.48 78.84 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.524 1.056 . . . . 0.88 112.525 176.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 40.0 mm -55.06 -42.82 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 CA-C-N 120.7 1.591 . . . . 0.84999999999999998 111.802 173.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.97 -27.63 73.62 Favored Glycine 0 CA--C 1.531 1.063 0 CA-C-N 118.54 0.609 . . . . 1.05 112.588 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.25 -20.38 71.22 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 118.164 0.982 . . . . 0.72999999999999998 113.983 177.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 mp -91.74 -50.07 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.512 1.125 . . . . 0.84999999999999998 110.107 162.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.8 m -81.96 46.36 1.0 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.441 2.297 . . . . 1.6799999999999999 112.097 -171.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.59 -70.97 0.57 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 126.084 1.802 . . . . 1.0800000000000001 110.514 175.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -61.61 -45.28 18.18 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.012 2.475 . . . . 1.0600000000000001 112.82 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.3 pt -73.12 -14.91 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 114.435 1.272 . . . . 1.0600000000000001 114.435 177.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.6 -40.57 83.61 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.094 0.861 . . . . 1.0700000000000001 113.198 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -40.17 91.3 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 117.741 -1.584 . . . . 2.7999999999999998 111.663 171.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -39.07 91.59 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 124.053 0.941 . . . . 1.47 111.353 -175.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -53.9 -58.52 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 123.982 0.913 . . . . 1.0800000000000001 110.893 166.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -63.44 -36.68 84.53 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.946 -1.096 . . . . 1.8500000000000001 113.08 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.279 2.6 pt-20 -81.29 -13.02 58.89 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.822 0.849 . . . . 3.0800000000000001 112.222 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.44 ' C ' ' H ' ' A' ' 99' ' ' GLN . 8.0 mm-40 -72.82 -35.17 67.24 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 125.082 1.353 . . . . 2.1200000000000001 113.232 165.094 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -71.54 16.62 0.1 Allowed 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 123.935 1.826 . . . . 3.5600000000000001 111.505 168.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLN . . . . . 0.44 ' H ' ' C ' ' A' ' 97' ' ' GLN . 4.2 mm-40 . . . . . 0 CA--C 1.534 0.356 0 C-N-CA 126.068 1.747 . . . . 2.5600000000000001 109.184 174.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 . . . . . 0 C--O 1.243 0.735 0 N-CA-C 109.923 -0.399 . . . . 2.2200000000000002 109.923 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.9 p -73.17 162.88 28.9 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.138 0.427 . . . . 0.88 110.994 -175.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -60.14 -43.93 95.32 Favored 'General case' 0 C--O 1.221 -0.431 0 O-C-N 121.359 -0.838 . . . . 2.1000000000000001 111.196 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.87 -41.75 71.2 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.48 1.512 . . . . 0.89000000000000001 110.694 175.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -72.91 -54.81 7.73 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.421 1.088 . . . . 3.04 112.249 -175.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -56.27 -26.9 53.44 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.89 1.276 . . . . 4.8700000000000001 112.239 168.027 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.795 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -76.73 -40.34 48.91 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 120.451 -1.406 . . . . 0.96999999999999997 112.608 169.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 37.3 t -58.81 -30.42 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 120.924 1.693 . . . . 0.91000000000000003 110.624 171.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 70.7 mt -58.22 -57.4 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 119.448 1.022 . . . . 1.1899999999999999 110.763 164.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 41.2 t -55.26 -38.56 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 125.656 1.582 . . . . 0.76000000000000001 114.617 177.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.7 mp -66.37 -33.96 76.88 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.408 -1.432 . . . . 1.1699999999999999 111.858 174.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 52.5 t -78.45 -33.59 17.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.157 0.583 . . . . 0.70999999999999996 110.768 -178.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -56.41 -51.58 67.85 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.797 0.839 . . . . 3.6000000000000001 111.563 164.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 121' ' ' ASN . . . . . 0.47 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 19.2 t-20 -52.65 -29.55 26.91 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.927 1.455 . . . . 3.6000000000000001 114.927 -177.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -82.37 -60.18 2.29 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.017 0.747 . . . . 2.0800000000000001 113.017 170.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -63.11 -29.3 70.69 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 119.01 -0.519 . . . . 1.8100000000000001 112.217 -166.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 124' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 10.7 ptmt -51.31 -25.44 5.88 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.931 1.292 . . . . 2.1400000000000001 114.137 172.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -98.24 -9.41 25.62 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 115.083 1.512 . . . . 2.7999999999999998 115.083 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.482 1.141 0 CA-C-N 119.818 1.19 . . . . 2.4500000000000002 109.158 166.71 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 19.9 tt . . . . . 0 N--CA 1.47 0.54 0 N-CA-C 109.754 -0.462 . . . . 3.27 109.754 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 30.2 t -94.04 149.15 21.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.6 0.714 . . . . 2.3999999999999999 110.677 166.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 57.9 pttt -52.43 -20.56 2.92 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.772 1.229 . . . . 4.3899999999999997 113.975 164.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 92.8 p -81.56 -21.31 38.55 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.354 1.242 . . . . 2.0699999999999998 114.354 169.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 14.0 m -78.06 -45.4 23.65 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.916 -1.115 . . . . 1.22 111.408 -175.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -47.07 -58.36 4.09 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.625 1.17 . . . . 2.3399999999999999 111.516 178.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 18.1 ptt85 -58.57 -14.98 9.44 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.438 1.495 . . . . 3.8300000000000001 113.652 -178.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -107.86 -31.01 8.19 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 114.706 1.373 . . . . 2.8399999999999999 114.706 -178.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 144' ' ' MET . . . . . 0.424 ' CG ' HD21 ' B' ' 121' ' ' ASN . 7.4 tmm? -52.52 -44.42 65.72 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.651 -0.499 . . . . 1.4299999999999999 109.651 156.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.5 mt -59.9 -22.34 62.25 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.931 1.692 . . . . 1.01 114.182 173.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -94.65 -15.2 24.18 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.411 1.084 . . . . 2.4199999999999999 112.979 177.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.17 -41.54 5.11 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.91 1.078 . . . . 1.6599999999999999 113.91 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -100.24 -15.99 17.89 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.369 1.468 . . . . 3.1099999999999999 113.899 -171.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 96.9 mt -125.38 38.33 4.2 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.296 1.839 . . . . 2.4399999999999999 111.966 166.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -69.57 -17.73 63.58 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.827 1.417 . . . . 1.3 114.827 -172.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -88.93 -0.79 57.7 Favored 'General case' 0 CA--C 1.555 1.153 0 O-C-N 120.565 -1.334 . . . . 1.6399999999999999 112.375 -171.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 4.5 mmm -101.71 12.97 36.23 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.273 2.229 . . . . 1.95 113.447 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 9.2 mp -96.71 128.64 43.85 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.734 2.014 . . . . 3.02 111.412 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 33.0 t -112.23 -1.75 15.1 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.117 1.367 . . . . 4.75 112.808 169.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -178.04 170.8 1.81 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 129.751 3.22 . . . . 4.5 106.917 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 m -33.24 -40.0 0.06 Allowed 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 125.133 1.373 . . . . 2.6800000000000002 111.915 148.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.09 -42.49 39.95 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 128.394 2.902 . . . . 1.73 115.389 -171.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -58.35 -43.56 88.38 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 117.642 0.721 . . . . 3.4500000000000002 110.78 172.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 83.2 mtm-85 -69.68 -39.52 76.92 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 118.244 -0.884 . . . . 4.9400000000000004 112.467 172.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 17.2 mtmm -54.16 -29.58 46.12 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 121.35 1.886 . . . . 4.9500000000000002 112.299 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -75.29 -19.37 59.72 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 115.282 1.586 . . . . 1.1799999999999999 115.282 171.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -76.37 -54.29 6.96 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.141 1.376 . . . . 0.76000000000000001 110.395 161.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -66.43 -31.82 72.8 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.87 0.868 . . . . 2.0099999999999998 112.394 -169.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 6.0 ptmm? -56.17 -25.56 47.22 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.774 1.028 . . . . 3.48 113.774 167.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.6 mt -84.54 -41.78 16.15 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.216 1.007 . . . . 0.75 111.391 174.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 20.3 mm -54.57 -43.1 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.385 1.074 . . . . 0.81000000000000005 111.233 -177.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -65.09 -27.87 69.06 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.861 1.264 . . . . 1.74 113.68 176.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -85.21 -24.22 27.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.956 1.303 . . . . 3.4100000000000001 112.782 174.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 14.2 tp -66.88 -23.85 66.05 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.596 1.158 . . . . 3.8300000000000001 112.355 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.46 -25.08 34.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.223 2.209 . . . . 3.1400000000000001 114.326 166.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.2 -9.08 59.04 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.601 0.963 . . . . 3.7400000000000002 113.601 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -130.61 -33.05 1.66 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.259 1.207 . . . . 3.46 114.259 -166.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 22.4 m170 -114.21 74.76 0.89 Allowed 'General case' 0 CA--C 1.548 0.88 0 O-C-N 120.463 -1.398 . . . . 4.1799999999999997 114.749 -168.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -82.67 76.76 9.51 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.002 0.921 . . . . 4.0599999999999996 110.824 166.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.61 -41.5 1.2 Allowed Glycine 0 N--CA 1.478 1.46 0 C-N-CA 126.518 2.009 . . . . 2.6699999999999999 114.598 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -68.52 82.83 0.27 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 128.064 2.546 . . . . 8.6400000000000006 109.967 171.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 26.6 mm -72.41 136.62 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 O-C-N 120.877 -1.14 . . . . 2.71 109.519 171.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 8.4 t -94.06 137.67 33.0 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.457 1.103 . . . . 1.79 111.275 170.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -50.14 -54.49 20.36 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.487 1.115 . . . . 2.2200000000000002 110.28 171.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.65 -30.67 65.59 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.813 2.045 . . . . 3.4900000000000002 112.278 -170.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -74.29 -22.93 59.06 Favored 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 113.049 0.759 . . . . 5.9100000000000001 113.049 -177.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -58.63 -47.32 84.8 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 119.503 -1.998 . . . . 2.1000000000000001 110.471 165.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 19.0 t-105 -68.59 -37.61 79.97 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.144 -0.931 . . . . 0.84999999999999998 111.724 -173.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 82.3 p -63.09 -47.09 84.35 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 119.649 1.113 . . . . 2.6000000000000001 110.689 171.244 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.29 -37.71 81.36 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.087 -0.959 . . . . 0.88 112.85 -178.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 39.6 mm -54.62 -41.89 57.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 CA-C-N 120.589 1.54 . . . . 0.82999999999999996 111.467 173.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.55 -26.31 73.69 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 123.684 0.659 . . . . 1.01 112.789 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -67.52 -19.99 71.38 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-N 118.097 0.949 . . . . 0.68999999999999995 113.326 177.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.8 mp -96.71 -46.47 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 CA-C-N 118.284 1.042 . . . . 0.84999999999999998 110.132 165.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 2.9 m -81.15 39.43 0.51 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.042 2.137 . . . . 1.7 112.351 -175.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -108.97 -70.62 0.68 Allowed Glycine 0 CA--C 1.529 0.96 0 C-N-CA 126.149 1.833 . . . . 0.98999999999999999 110.174 173.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -61.02 -43.39 30.36 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.057 2.505 . . . . 0.93999999999999995 113.029 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 11.1 pt -75.15 -17.56 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 114.454 1.279 . . . . 1.04 114.454 177.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -58.36 -42.51 87.12 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.548 1.067 . . . . 1.01 113.588 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.29 -41.62 89.41 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.979 1.263 . . . . 2.98 111.993 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -40.22 90.78 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 123.997 0.919 . . . . 1.72 111.714 -176.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 88.0 mt -52.85 -63.09 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.591 0.756 . . . . 1.02 110.041 168.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -59.09 -37.19 76.54 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.292 -0.88 . . . . 1.78 112.906 -175.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.295 2.5 pt-20 -78.02 -18.29 56.05 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 112.385 0.513 . . . . 3.21 112.385 178.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -75.99 -35.02 59.75 Favored 'General case' 0 C--N 1.344 0.334 0 C-N-CA 125.392 1.477 . . . . 2.1000000000000001 114.611 169.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -65.19 -1.13 2.03 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 122.801 1.286 . . . . 2.98 111.736 171.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -112.89 -70.16 0.82 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.001 1.721 . . . . 2.8300000000000001 109.597 177.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 . . . . . 0 N--CA 1.483 1.206 0 C-N-CA 131.695 3.998 . . . . 4.3300000000000001 116.413 177.15 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.481 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 50.8 m-85 . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 115.948 1.832 . . . . 2.0899999999999999 115.948 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.6 p -65.5 158.27 27.37 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.164 0.585 . . . . 0.97999999999999998 109.975 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -60.5 -31.05 70.12 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 117.885 -1.055 . . . . 3.73 110.908 172.159 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.22 -41.3 85.94 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.057 1.299 . . . . 0.82999999999999996 111.278 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -55.99 9.87 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.886 0.874 . . . . 2.9199999999999999 110.722 178.011 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -45.05 -43.82 9.68 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.762 1.625 . . . . 4.7000000000000002 113.593 166.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.875 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.08 -45.86 83.54 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.553 1.141 . . . . 0.51000000000000001 113.088 173.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.99 -41.06 87.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 120.248 1.385 . . . . 0.66000000000000003 110.608 173.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.6 mt -53.28 -49.7 51.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-N 119.187 0.903 . . . . 0.80000000000000004 111.331 166.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.4 t -65.6 -35.86 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 119.707 1.139 . . . . 0.54000000000000004 112.783 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp -65.45 -41.78 93.09 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.862 -1.149 . . . . 0.96999999999999997 111.338 172.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.0 t -67.4 -43.34 87.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 125.455 1.502 . . . . 0.58999999999999997 111.917 176.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -53.69 -51.96 61.58 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 119.119 0.872 . . . . 3.23 109.835 168.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.503 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 54.4 t30 -64.13 -23.11 67.2 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.035 1.124 . . . . 2.0699999999999998 114.035 -169.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -76.24 -61.1 2.06 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.7 0.8 . . . . 2.3300000000000001 112.335 168.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -67.49 -21.84 65.49 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.984 1.105 . . . . 1.79 113.984 -170.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.503 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 1.6 ptmt -53.69 -21.94 8.01 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.342 1.428 . . . . 2.1499999999999999 112.975 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -89.98 8.14 33.93 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.453 1.901 . . . . 2.48 115.023 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 125.136 1.374 . . . . 2.3999999999999999 110.885 173.036 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 16.3 pt . . . . . 0 CA--C 1.546 0.817 0 N-CA-C 113.87 1.063 . . . . 3.3999999999999999 113.87 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.2 m -125.72 156.82 38.77 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.711 2.004 . . . . 2.5699999999999998 109.523 171.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -58.07 -21.8 47.43 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 115.343 1.609 . . . . 2.02 115.343 -164.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.4 m -47.85 -42.25 26.05 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 121.269 -0.894 . . . . 2.04 113.304 165.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 m -74.36 -11.6 60.3 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.534 1.309 . . . . 1.8899999999999999 114.534 -172.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -69.82 -56.71 6.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 121.045 1.748 . . . . 2.1400000000000001 111.444 165.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -61.78 -26.04 67.84 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.466 0.543 . . . . 2.2999999999999998 112.466 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -71.52 -50.59 29.86 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.671 1.189 . . . . 3.8799999999999999 110.625 170.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -59.96 -43.04 95.3 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.886 1.674 . . . . 1.3300000000000001 112.733 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 31.8 mt -50.69 -36.86 38.06 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.907 1.283 . . . . 1.48 112.434 168.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -83.88 -20.21 33.47 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 118.108 -0.949 . . . . 2.5600000000000001 112.771 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.52 -45.57 19.04 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.68 1.582 . . . . 2.8199999999999998 112.117 166.185 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -90.22 -41.07 11.8 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.926 1.084 . . . . 3.4700000000000002 113.926 -167.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.4 mt -107.0 28.68 7.78 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.216 1.007 . . . . 2.4399999999999999 112.803 -170.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -67.63 23.83 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 117.059 2.244 . . . . 1.99 117.059 -171.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.466 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 0.2 OUTLIER -127.65 -42.88 1.59 Allowed 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.267 -1.521 . . . . 2.0299999999999998 111.731 -178.372 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.9 ptp -77.54 -19.97 54.91 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.667 1.187 . . . . 2.77 113.555 164.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.1 tt -99.92 104.9 16.57 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.254 1.422 . . . . 2.9500000000000002 111.046 -175.292 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.3 t -71.63 109.28 5.45 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.581 -0.699 . . . . 5.2199999999999998 111.3 168.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 49.79 -88.39 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.68 1.992 . . . . 7.2599999999999998 114.062 136.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.3 p -130.89 -19.91 2.87 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.439 1.495 . . . . 3.4700000000000002 112.33 167.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.64 -41.44 99.59 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 119.976 1.262 . . . . 2.7000000000000002 112.081 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -82.88 -48.98 10.14 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 117.552 0.676 . . . . 3.5499999999999998 112.345 165.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -55.13 -37.13 66.52 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.901 1.445 . . . . 4.9699999999999998 114.901 -172.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -63.84 -31.58 72.81 Favored 'General case' 0 N--CA 1.479 1.024 0 O-C-N 120.883 -1.136 . . . . 3.3599999999999999 114.015 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.77 -40.19 96.08 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 122.96 0.504 . . . . 2.1000000000000001 111.653 168.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.86 98.68 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.131 0.572 . . . . 1.27 112.291 172.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -54.67 -29.66 53.27 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.256 1.022 . . . . 2.5800000000000001 112.626 174.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -24.72 59.92 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.177 -1.577 . . . . 6.0499999999999998 114.004 175.616 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 15.4 mt -65.82 -43.0 89.88 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 120.523 -0.471 . . . . 1.0900000000000001 110.973 163.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.5 mm -59.61 -48.32 87.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 123.205 0.602 . . . . 0.93999999999999995 110.739 -177.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -59.32 -38.13 79.53 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.092 0.473 . . . . 1.8 112.258 178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 -65.92 -30.46 71.05 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.782 0.833 . . . . 3.4900000000000002 113.071 175.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.16 -30.69 22.28 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.351 1.46 . . . . 1.95 111.827 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -64.87 -32.38 74.06 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.441 1.496 . . . . 3.1499999999999999 113.147 166.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.0 -23.31 66.55 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.122 1.156 . . . . 2.2000000000000002 114.122 170.354 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -122.71 -7.84 8.5 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.839 1.792 . . . . 2.4500000000000002 115.839 -167.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.35 117.97 13.05 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.302 1.865 . . . . 3.4399999999999999 112.757 -177.082 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -78.6 63.63 3.44 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.908 2.483 . . . . 4.04 111.926 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.78 7.87 62.6 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.344 0.974 . . . . 2.9900000000000002 114.228 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.8 mmt85 -70.12 175.16 4.72 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.268 1.427 . . . . 5.6299999999999999 111.957 176.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 25.0 mm -140.02 150.18 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 126.191 1.797 . . . . 2.3500000000000001 106.853 161.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.7 t -127.0 165.16 19.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.536 1.534 . . . . 1.52 111.902 169.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -67.62 -51.78 46.14 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 122.54 1.162 . . . . 2.02 111.93 175.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -25.02 67.39 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.422 2.289 . . . . 3.3999999999999999 113.914 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.6 -59.26 5.45 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.049 1.339 . . . . 3.46 111.888 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -58.06 -42.31 85.21 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.063 -1.023 . . . . 2.3300000000000001 111.466 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 20.9 t-105 -62.33 -48.27 80.55 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.922 -0.561 . . . . 0.62 111.767 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.1 t -69.82 -32.75 71.35 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 117.637 -1.173 . . . . 1.72 111.718 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.9 mt -66.93 -40.94 87.76 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 117.798 -1.096 . . . . 0.67000000000000004 112.553 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 12.1 mm -50.26 -44.58 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-N 120.174 1.352 . . . . 0.75 111.688 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.05 -19.13 50.3 Favored Glycine 0 CA--C 1.539 1.545 0 CA-C-O 119.459 -0.634 . . . . 0.63 114.579 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.45 -23.29 60.84 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 118.72 1.26 . . . . 0.59999999999999998 114.013 177.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -94.98 -44.97 13.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-N 119.446 1.623 . . . . 1.04 109.647 165.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.3 m -83.44 35.43 0.5 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.055 2.542 . . . . 1.48 112.035 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -93.59 -78.9 1.42 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 125.009 1.29 . . . . 1.0 110.761 172.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.2 -41.27 16.86 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.885 2.39 . . . . 1.1599999999999999 112.263 -176.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -70.17 -12.95 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 113.761 1.023 . . . . 1.2 113.761 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.78 -43.66 92.54 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.343 0.974 . . . . 0.93000000000000005 111.816 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -61.45 -34.23 75.07 Favored 'General case' 0 C--O 1.221 -0.397 0 O-C-N 120.442 -1.411 . . . . 2.6899999999999999 112.291 171.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 tt -66.88 -41.08 87.85 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.924 0.89 . . . . 1.24 111.271 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.2 mt -51.37 -62.58 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-O 121.642 0.734 . . . . 0.93000000000000005 109.541 162.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -60.41 -27.77 67.73 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.113 1.153 . . . . 1.9199999999999999 114.113 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.305 3.9 pt-20 -89.45 -9.33 50.57 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.715 1.206 . . . . 3.1600000000000001 112.769 178.664 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.439 ' C ' ' H ' ' A' ' 99' ' ' GLN . 5.5 tp-100 -89.48 -30.51 18.23 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.882 1.673 . . . . 3.5099999999999998 111.826 169.365 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -63.99 6.27 0.18 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 126.849 2.059 . . . . 3.2999999999999998 113.314 165.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLN . . . . . 0.439 ' H ' ' C ' ' A' ' 97' ' ' GLN . 10.2 mm-40 . . . . . 0 C--N 1.324 -0.533 0 C-N-CA 126.153 1.781 . . . . 2.23 110.273 -173.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.466 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 46.5 m-85 . . . . . 0 N--CA 1.478 0.931 0 N-CA-C 115.554 1.686 . . . . 2.29 115.554 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 36.0 p -64.27 157.79 25.03 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.069 0.947 . . . . 1.0600000000000001 109.871 178.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -59.59 -33.98 72.15 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-O 117.108 -1.425 . . . . 3.7200000000000002 110.952 173.291 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.27 -43.29 95.29 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 120.641 1.564 . . . . 0.82999999999999996 111.323 176.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -57.52 5.68 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.822 0.849 . . . . 2.9500000000000002 110.598 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -42.79 -44.25 4.34 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.37 1.868 . . . . 4.75 114.278 164.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.875 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -65.27 -44.75 87.03 Favored 'General case' 0 C--O 1.223 -0.337 0 O-C-N 120.821 -1.175 . . . . 0.52000000000000002 112.586 174.217 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.3 -42.66 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.936 1.244 . . . . 0.66000000000000003 110.506 172.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 71.0 mt -53.03 -48.03 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.344 1.058 . . . . 0.75 110.57 168.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.3 t -66.58 -35.09 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.396 1.078 . . . . 0.62 112.82 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -67.87 -40.0 83.66 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.567 -1.333 . . . . 1.0 111.222 173.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 29.7 t -67.91 -38.48 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 126.036 1.734 . . . . 0.60999999999999999 111.993 175.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.93 -53.05 62.57 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.153 0.981 . . . . 3.5699999999999998 110.294 167.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 121' ' ' ASN . . . . . 0.42 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 27.0 t30 -66.57 -7.34 19.52 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.214 1.561 . . . . 2.1099999999999999 115.214 -177.382 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -87.56 -65.43 1.02 Allowed 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.367 -0.833 . . . . 2.48 111.972 160.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -69.69 -22.31 63.43 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.921 1.452 . . . . 1.79 114.921 -166.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 124' ' ' LYS . . . . . 0.42 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 10.4 ptmt -53.78 -22.34 9.25 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 121.265 1.848 . . . . 2.1400000000000001 113.436 177.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -84.39 7.82 18.3 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.641 1.976 . . . . 2.5499999999999998 114.907 176.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 30.9 m . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 125.989 1.715 . . . . 2.5 110.161 170.155 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 18.9 pt . . . . . 0 CA--C 1.551 0.982 0 N-CA-C 114.821 1.415 . . . . 3.1699999999999999 114.821 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 71.1 m -118.33 155.08 31.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.818 1.247 . . . . 2.6400000000000001 109.867 165.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -50.92 -36.01 36.25 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.17 1.388 . . . . 1.95 114.144 -171.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 4.9 m -52.34 -17.41 1.16 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.811 2.044 . . . . 1.8500000000000001 115.43 174.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 1.4 m -75.43 -37.33 60.48 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.502 1.121 . . . . 1.26 112.545 175.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -58.39 -49.74 76.16 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.277 1.031 . . . . 1.99 111.948 -175.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -55.82 -29.2 59.39 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.455 1.102 . . . . 2.23 113.77 175.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -86.69 -44.73 11.6 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.645 1.178 . . . . 3.8799999999999999 111.365 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 2.7 tmm? -52.67 -45.77 66.92 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.182 0.593 . . . . 1.1399999999999999 111.641 167.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 21.3 mt -55.51 -52.51 63.45 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.624 1.57 . . . . 1.5 112.869 170.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -61.09 -18.48 58.15 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.7 1.2 . . . . 2.2200000000000002 113.406 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.29 -44.14 5.25 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.848 1.055 . . . . 2.23 113.848 177.316 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -79.42 -38.14 35.45 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.715 1.206 . . . . 3.5899999999999999 113.626 -178.06 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.7 mt -111.81 28.08 9.08 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.421 0.897 . . . . 2.5099999999999998 113.421 -169.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -71.09 9.71 0.68 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 116.689 2.107 . . . . 1.51 116.689 -165.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 151' ' ' HIS . . . . . 0.481 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 0.5 OUTLIER -108.01 -32.13 7.68 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 120.041 -1.662 . . . . 2.0499999999999998 111.851 -173.933 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 21.1 ptp -83.01 -27.71 30.17 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.045 1.738 . . . . 2.79 112.473 159.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 5.5 tt -94.79 97.49 10.08 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.089 1.356 . . . . 3.2000000000000002 110.749 -176.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 30.3 t -74.64 104.36 5.29 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.99 0.9 . . . . 5.2000000000000002 110.416 167.167 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 54.75 -100.01 0.1 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.802 1.241 . . . . 7.8899999999999997 112.809 138.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 41.5 p -130.75 14.29 5.36 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.86 1.664 . . . . 4.1299999999999999 113.766 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -86.4 -64.7 1.44 Allowed Glycine 0 N--CA 1.466 0.663 0 N-CA-C 109.876 -1.29 . . . . 2.9100000000000001 109.876 160.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -67.2 -46.34 74.19 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 118.409 -0.805 . . . . 3.77 111.753 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -59.4 -22.91 62.11 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 120.691 1.587 . . . . 4.7199999999999998 114.95 -176.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp -52.28 -38.1 57.37 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.888 1.222 . . . . 4.3300000000000001 113.118 168.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -63.88 -48.03 78.27 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.824 0.45 . . . . 1.8700000000000001 110.91 172.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -56.62 -49.37 75.16 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.523 0.601 . . . . 1.03 111.693 176.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -66.31 -33.0 74.76 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.726 0.811 . . . . 2.3900000000000001 112.351 -175.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -47.25 82.04 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.004 -1.06 . . . . 6.7000000000000002 112.894 167.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.67 -47.8 76.12 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.044 0.84 . . . . 1.3200000000000001 111.019 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 38.9 mm -50.48 -51.64 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 123.404 0.682 . . . . 0.96999999999999997 110.493 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -73.73 -31.03 63.16 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.322 0.582 . . . . 3.02 112.265 -173.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 38.2 m-20 -62.42 -27.47 69.12 Favored 'General case' 0 CA--C 1.555 1.165 0 N-CA-C 112.548 0.573 . . . . 4.1799999999999997 112.548 169.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.47 -28.76 20.63 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.999 1.72 . . . . 2.1699999999999999 111.54 177.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -63.75 -28.97 70.24 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.741 -1.224 . . . . 2.98 113.309 164.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.27 -14.07 62.72 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 114.345 1.239 . . . . 2.29 114.345 166.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -125.71 -13.3 6.47 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 116.628 2.084 . . . . 2.4100000000000001 116.628 -170.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -139.88 122.35 16.15 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 122.057 2.208 . . . . 3.5800000000000001 113.233 -174.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -79.07 66.06 4.41 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 127.514 2.325 . . . . 4.0999999999999996 112.137 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.1 5.57 66.17 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.731 1.157 . . . . 3.2000000000000002 114.75 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt85 -68.43 178.21 2.08 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.154 1.782 . . . . 5.6900000000000004 112.415 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 21.5 mm -137.6 151.83 26.49 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 126.84 2.056 . . . . 2.6099999999999999 105.461 158.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 9.8 t -132.46 164.05 27.41 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.22 1.408 . . . . 1.5600000000000001 113.277 170.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -63.91 -55.46 22.52 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 122.881 1.324 . . . . 2.29 111.359 175.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -27.27 68.13 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.606 2.363 . . . . 3.5299999999999998 113.71 178.764 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -57.04 -60.39 3.65 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.995 1.318 . . . . 3.3900000000000001 111.153 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -55.42 -46.45 76.67 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.234 -0.916 . . . . 2.21 111.477 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 23.4 t-105 -62.64 -47.29 84.37 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.967 -0.54 . . . . 0.63 111.55 -177.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.5 t -70.7 -32.18 69.32 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 117.658 -1.163 . . . . 1.6399999999999999 111.664 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 46.1 mt -67.33 -40.51 85.9 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-O 117.24 -1.362 . . . . 0.62 112.105 175.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 13.1 mm -49.03 -46.13 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 CA-C-N 120.691 1.587 . . . . 0.66000000000000003 111.901 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -60.98 -19.6 56.77 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 123.997 0.808 . . . . 0.68999999999999995 114.381 178.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -78.12 -18.37 76.68 Favored Glycine 0 CA--C 1.531 1.077 0 CA-C-N 118.687 1.244 . . . . 0.77000000000000002 113.54 174.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -101.61 -48.17 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-N 119.482 1.641 . . . . 0.97999999999999998 109.976 166.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 25.7 m -80.45 68.58 6.68 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 127.038 2.135 . . . . 1.3899999999999999 109.45 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -129.67 -83.49 0.33 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.731 1.634 . . . . 0.91000000000000003 110.961 177.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -61.89 -39.29 52.54 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 122.479 2.119 . . . . 1.24 111.656 178.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.95 -11.31 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 113.461 0.911 . . . . 1.27 113.461 177.25 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.12 -42.87 83.78 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.534 1.061 . . . . 0.87 111.293 177.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -61.42 -35.42 77.5 Favored 'General case' 0 C--O 1.22 -0.475 0 O-C-N 120.508 -1.37 . . . . 2.9500000000000002 112.262 169.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.85 -43.7 95.34 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.149 0.98 . . . . 1.5 111.165 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 78.7 mt -50.17 -62.11 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-O 121.43 0.633 . . . . 0.94999999999999996 109.824 163.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -58.67 -31.06 67.84 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.865 1.061 . . . . 2.0899999999999999 113.865 -173.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.258 3.8 pt-20 -88.7 -12.28 42.79 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.691 1.196 . . . . 3.23 112.76 -179.416 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -84.28 -34.19 23.83 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.308 1.443 . . . . 3.77 111.252 169.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -63.19 2.93 0.31 Allowed 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 126.421 1.889 . . . . 3.25 113.222 166.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -128.21 -72.48 0.62 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.92 1.688 . . . . 2.5 111.21 -176.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 . . . . . 0 N--CA 1.476 0.867 1 C-N-CA 132.14 4.176 . . . . 4.1799999999999997 116.513 170.622 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 . . . . . 0 C--O 1.241 0.607 0 N-CA-C 112.861 0.689 . . . . 2.6699999999999999 112.861 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.31 153.59 40.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.771 -0.826 . . . . 1.0700000000000001 108.771 -176.252 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -59.81 -43.31 94.56 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-O 119.125 -0.464 . . . . 2.0899999999999999 110.891 178.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.91 -44.44 94.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.086 1.754 . . . . 1.8100000000000001 111.639 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -71.15 -53.8 13.27 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 125.837 1.655 . . . . 3.1099999999999999 110.819 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -58.55 -27.5 64.63 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.107 -0.996 . . . . 5.3899999999999997 111.828 167.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.813 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -71.6 -37.39 70.97 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 119.474 -2.016 . . . . 0.56999999999999995 111.72 172.436 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 91.4 t -60.41 -37.46 74.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.84 1.655 . . . . 0.67000000000000004 110.504 167.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 13.3 mt -55.23 -54.1 28.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 CA-C-N 120.335 1.425 . . . . 0.77000000000000002 112.196 165.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.4 t -58.5 -44.36 88.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 119.633 1.106 . . . . 0.56999999999999995 112.951 -179.184 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.6 mp -63.2 -42.32 99.31 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.58 1.082 . . . . 0.91000000000000003 111.393 175.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.6 t -65.34 -41.3 90.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 123.819 0.848 . . . . 0.62 110.825 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.58 -43.08 99.51 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.396 0.544 . . . . 3.1499999999999999 112.161 166.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.57 -23.76 64.9 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.704 -1.247 . . . . 3.9100000000000001 113.556 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -75.43 -72.83 0.28 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.907 0.883 . . . . 1.8100000000000001 112.455 158.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -58.95 -26.65 64.6 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.39 1.626 . . . . 2.0899999999999999 115.39 -167.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -47.45 -32.66 5.3 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.986 1.266 . . . . 2.6000000000000001 112.555 173.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -93.11 -19.22 21.72 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.257 1.823 . . . . 2.3799999999999999 115.219 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.488 1.464 0 CA-C-N 120.455 1.479 . . . . 2.5899999999999999 110.109 -168.56 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.0 pt . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 116.032 1.864 . . . . 2.1499999999999999 116.032 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.4 t -77.67 137.51 38.56 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.41 -1.431 . . . . 2.7200000000000002 110.068 164.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mttp -60.7 -21.86 63.34 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 121.063 -1.023 . . . . 2.2999999999999998 112.161 172.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.4 p -67.66 -32.95 73.99 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 120.492 -1.38 . . . . 1.78 113.427 171.4 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.5 m -63.59 -39.68 94.99 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.593 1.088 . . . . 1.0900000000000001 111.543 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.463 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 25.9 t80 -52.1 -60.47 3.16 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.816 0.846 . . . . 2.1000000000000001 111.733 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -61.88 -28.68 69.67 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.458 0.54 . . . . 3.0099999999999998 112.458 -176.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -83.79 -42.01 16.95 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.288 0.566 . . . . 2.8399999999999999 112.098 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 15.7 tmm? -58.58 -37.48 75.87 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.681 -1.262 . . . . 1.54 111.099 170.496 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.6 mt -69.56 -8.03 43.65 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.302 1.593 . . . . 1.51 115.302 167.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -92.14 -7.72 47.69 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 120.932 -1.105 . . . . 3.1000000000000001 113.405 163.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -62.84 1.51 Allowed 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.404 1.261 . . . . 1.54 114.404 174.268 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -82.14 -4.61 57.32 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 119.338 -2.101 . . . . 2.6600000000000001 114.011 -168.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.86 24.81 5.0 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.802 2.041 . . . . 1.7 111.794 175.737 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -74.87 -26.76 59.91 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 115.418 1.636 . . . . 2.0899999999999999 115.418 -164.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 16.8 m80 -70.02 -20.54 63.26 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.472 1.487 . . . . 3.0699999999999998 111.072 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.5 tpp -70.72 3.98 2.81 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.28 1.432 . . . . 1.7 114.323 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.1 mp -85.35 119.37 25.64 Favored 'General case' 0 C--O 1.225 -0.23 0 O-C-N 120.734 -1.229 . . . . 3.1499999999999999 110.27 174.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.7 t -110.08 5.45 22.11 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 114.911 -1.041 . . . . 5.0499999999999998 112.552 175.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 t70 164.94 158.85 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 129.992 3.317 . . . . 4.9800000000000004 109.492 -177.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -25.08 -48.5 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 129.959 3.304 . . . . 3.5899999999999999 114.206 157.477 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.18 -33.61 75.88 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 125.545 1.545 . . . . 2.1000000000000001 113.515 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 -71.35 -23.71 61.97 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.074 0.937 . . . . 3.3799999999999999 112.929 177.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.46 ' CZ ' ' HA ' ' A' ' 56' ' ' ARG . 0.7 OUTLIER -81.39 -45.34 16.24 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-N 119.301 0.955 . . . . 6.7999999999999998 112.487 164.213 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.8 mmtm -55.24 -34.57 64.11 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.906 0.776 . . . . 3.21 112.892 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.27 -27.58 36.11 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.442 1.275 . . . . 1.0700000000000001 114.442 172.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.38 -43.41 50.37 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 119.149 0.886 . . . . 0.93999999999999995 111.62 171.011 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -60.45 -36.63 78.69 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.279 1.432 . . . . 2.8500000000000001 112.771 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -58.19 -30.21 66.26 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.514 0.931 . . . . 3.3500000000000001 113.514 173.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.9 mt -78.06 -42.18 33.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 118.415 -0.802 . . . . 1.0 111.425 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.7 mm -60.73 -43.65 95.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 118.951 0.796 . . . . 1.1599999999999999 110.373 -175.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -62.09 -28.72 69.81 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.536 0.939 . . . . 2.2400000000000002 113.536 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.6 m-20 -81.64 -44.63 16.92 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.283 1.433 . . . . 3.0099999999999998 113.01 175.394 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.87 -30.19 26.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.612 1.165 . . . . 2.3399999999999999 111.703 -171.07 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -71.5 -22.93 61.73 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.914 1.079 . . . . 2.77 113.914 -177.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.55 -2.4 3.4 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 113.88 1.067 . . . . 2.5299999999999998 113.88 164.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -138.4 -173.31 3.5 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 127.514 2.326 . . . . 3.8500000000000001 110.287 -176.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 7.2 m80 55.52 45.34 25.22 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.97 1.47 . . . . 4.2000000000000002 114.97 158.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.402 ' C ' ' H ' ' A' ' 73' ' ' ARG . 0.3 OUTLIER -134.09 155.46 50.01 Favored 'General case' 0 C--O 1.232 0.158 0 O-C-N 121.378 -0.826 . . . . 6.6799999999999997 112.592 166.657 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.56 -18.9 0.41 Allowed Glycine 0 CA--C 1.538 1.515 0 CA-C-O 118.918 -0.934 . . . . 4.96 113.392 -161.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.402 ' H ' ' C ' ' A' ' 71' ' ' ASP . 87.5 mmt-85 -141.38 149.83 41.61 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 128.359 2.664 . . . . 4.9000000000000004 110.42 172.435 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.4 mm -138.02 148.16 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.296 1.839 . . . . 3.0600000000000001 109.83 173.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.7 m -117.39 144.44 44.96 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.148 1.779 . . . . 1.96 108.681 177.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -59.37 -36.67 76.19 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.773 1.273 . . . . 1.9299999999999999 112.112 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.83 -20.54 65.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.512 2.725 . . . . 3.02 114.488 177.463 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -56.8 -58.91 6.05 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.888 1.222 . . . . 3.3199999999999998 109.888 171.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -58.79 -44.39 90.73 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.343 -0.848 . . . . 2.3799999999999999 112.035 -175.619 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.6 t-105 -62.07 -47.66 83.67 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 118.561 -0.733 . . . . 0.66000000000000003 112.138 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.2 t -70.3 -28.14 64.95 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.446 1.021 . . . . 1.8400000000000001 112.124 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.463 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 57.9 mt -68.04 -40.96 82.75 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 117.631 -1.176 . . . . 0.64000000000000001 111.75 172.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 25.6 mm -54.76 -42.03 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 CA-C-N 121.545 1.975 . . . . 0.56999999999999995 111.977 176.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -65.38 -19.39 66.49 Favored Glycine 0 N--CA 1.472 1.041 0 C-N-CA 124.111 0.862 . . . . 0.66000000000000003 114.149 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.09 -22.29 63.62 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-N 118.307 1.054 . . . . 0.66000000000000003 113.706 177.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.1 mp -90.42 -40.82 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 118.829 1.314 . . . . 0.81999999999999995 109.955 163.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.3 m -80.75 80.61 7.19 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.452 1.501 . . . . 1.3500000000000001 109.074 -175.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -153.98 -75.61 0.02 OUTLIER Glycine 0 CA--C 1.532 1.132 0 C-N-CA 125.752 1.644 . . . . 0.76000000000000001 112.861 -174.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -62.37 -45.77 14.03 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.74 2.293 . . . . 0.97999999999999998 111.641 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 pt -72.87 -16.37 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 114.839 1.422 . . . . 1.2 114.839 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -50.51 -58.53 5.56 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.792 1.633 . . . . 1.1100000000000001 112.715 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -60.69 -40.23 91.4 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.112 -0.992 . . . . 2.9100000000000001 112.466 176.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.3 tt -58.63 -47.15 85.35 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 124.424 1.09 . . . . 1.1499999999999999 110.579 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 42.4 mt -47.7 -58.49 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.792 1.237 . . . . 1.1399999999999999 111.117 174.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -70.55 -34.65 72.49 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.57 -0.706 . . . . 2.5600000000000001 112.099 -175.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.284 4.3 pt-20 -77.15 -24.19 51.57 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.636 -0.665 . . . . 2.9100000000000001 111.876 -175.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -59.0 -58.35 9.04 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.262 1.825 . . . . 2.1200000000000001 112.438 164.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -71.62 -12.54 61.4 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.024 0.829 . . . . 3.52 112.431 -171.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 . . . . . 0 N--CA 1.47 0.526 0 O-C-N 121.209 -0.932 . . . . 1.8700000000000001 111.146 163.336 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 . . . . . 0 N--CA 1.476 0.825 0 N-CA-C 112.664 0.616 . . . . 2.23 112.664 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.17 156.61 37.18 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.712 0.805 . . . . 1.3200000000000001 109.774 -173.387 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -63.03 -39.85 95.98 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-O 117.78 -1.105 . . . . 2.4900000000000002 111.341 175.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.16 -47.37 81.35 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.784 1.278 . . . . 1.01 109.895 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.08 -56.1 7.78 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 126.57 1.948 . . . . 2.8399999999999999 111.593 -173.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -57.92 -29.87 65.47 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 120.75 -1.219 . . . . 4.71 112.238 169.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.813 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.43 -40.81 77.01 Favored 'General case' 0 C--O 1.224 -0.251 0 O-C-N 119.826 -1.796 . . . . 0.48999999999999999 111.992 169.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 53.2 t -59.65 -31.93 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.762 1.619 . . . . 0.72999999999999998 111.162 171.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 35.2 mt -60.78 -54.37 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 CA-C-N 119.859 1.209 . . . . 0.75 110.872 166.174 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.24 -36.92 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.479 1.112 . . . . 0.5 113.268 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.83 -44.76 76.48 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.474 1.034 . . . . 0.93999999999999995 111.39 173.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.4 t -64.12 -39.44 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.947 0.899 . . . . 0.57999999999999996 111.406 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -69.9 -38.15 76.21 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.112 0.782 . . . . 3.3700000000000001 113.112 170.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -59.31 -23.07 62.14 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.582 -1.324 . . . . 3.6000000000000001 113.017 173.318 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -81.44 -68.82 0.66 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.671 0.788 . . . . 1.9199999999999999 112.704 163.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -60.24 -25.75 65.9 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.892 1.441 . . . . 2.0299999999999998 114.892 -168.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -47.87 -33.19 7.13 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.922 1.237 . . . . 2.6099999999999999 112.925 172.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -89.47 -16.82 29.94 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.862 1.43 . . . . 2.1600000000000001 114.862 177.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.483 1.224 0 CA-C-O 123.235 1.493 . . . . 2.4500000000000002 109.914 -167.789 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 19.7 pt . . . . . 0 N--CA 1.488 1.445 0 N-CA-C 115.292 1.59 . . . . 2.1800000000000002 115.292 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 29.8 t -94.29 137.88 32.93 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.469 -1.395 . . . . 2.73 109.97 164.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 138' ' ' LYS . . . . . 0.405 ' HE2' HD12 ' B' ' 169' ' ' LEU . 23.0 mttp -68.78 -17.07 63.97 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.732 -1.23 . . . . 2.6099999999999999 111.469 171.69 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 10.0 p -65.53 -27.68 68.63 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.589 -1.319 . . . . 1.6799999999999999 113.116 165.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 12.6 m -77.94 -39.29 43.2 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.364 0.984 . . . . 1.1799999999999999 111.545 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.476 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 47.7 t80 -47.58 -57.48 5.39 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.008 0.923 . . . . 2.1000000000000001 111.171 173.125 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.3 ptt180 -62.12 -26.73 68.47 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.361 0.874 . . . . 2.9100000000000001 113.361 -176.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -87.82 -43.68 11.66 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.425 1.09 . . . . 2.4399999999999999 111.941 -176.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.46 -41.41 69.45 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.393 1.477 . . . . 1.27 111.245 170.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 71.2 mt -71.02 -4.3 24.17 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.54 1.936 . . . . 1.6000000000000001 115.183 171.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -98.92 -10.09 23.27 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.325 1.45 . . . . 2.96 112.725 165.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.19 -57.31 2.09 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.867 1.267 . . . . 1.3799999999999999 113.658 174.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -86.76 -6.03 58.94 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.505 -1.372 . . . . 2.7799999999999998 114.044 -169.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.35 14.85 8.3 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.784 2.034 . . . . 1.75 112.618 176.029 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -66.87 -26.87 67.1 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.264 1.579 . . . . 1.9199999999999999 115.264 -163.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -70.86 -14.21 62.32 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.182 1.355 . . . . 2.9500000000000002 112.304 178.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.6 tpp -80.25 5.37 14.82 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.339 1.455 . . . . 1.76 113.731 174.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.9 mp -91.49 132.04 36.53 Favored 'General case' 0 C--O 1.227 -0.122 0 O-C-N 120.678 -1.264 . . . . 3.1800000000000002 109.404 177.472 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 20.1 m -140.4 16.88 2.39 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.165 -0.959 . . . . 5.21 112.118 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 18.7 t70 172.13 158.57 0.1 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 129.4 3.08 . . . . 5.4199999999999999 109.762 173.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 3.7 m -25.2 -52.87 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 129.498 3.119 . . . . 4.2400000000000002 113.326 156.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.0 -33.5 69.25 Favored Glycine 0 CA--C 1.525 0.674 0 C-N-CA 124.817 1.199 . . . . 2.4199999999999999 113.262 -175.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -70.92 -23.83 62.33 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 118.516 1.158 . . . . 3.3300000000000001 113.516 -178.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -84.4 -50.05 8.14 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.084 0.857 . . . . 7.2800000000000002 112.62 164.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -54.33 -34.46 61.1 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 119.007 0.821 . . . . 3.2599999999999998 112.552 -178.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -53.62 -29.44 37.95 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.41 1.263 . . . . 1.0700000000000001 114.41 173.149 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -74.12 -40.34 62.72 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.224 0.92 . . . . 0.88 112.274 171.159 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -70.13 -27.63 64.71 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.292 1.037 . . . . 1.9199999999999999 112.876 -177.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 23.4 mtmt -60.05 -27.82 67.26 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 121.138 -0.976 . . . . 3.4100000000000001 113.274 168.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 6.5 mt -78.14 -40.89 36.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.702 -0.681 . . . . 0.95999999999999996 110.998 173.058 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 19.1 mm -61.06 -44.69 98.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 118.393 0.542 . . . . 1.29 110.926 -178.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -61.94 -27.66 68.99 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.491 0.923 . . . . 2.6000000000000001 113.491 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 m-20 -83.2 -45.23 14.12 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.158 1.383 . . . . 3.0600000000000001 113.092 174.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 169' ' ' LEU . . . . . 0.405 HD12 ' HE2' ' B' ' 138' ' ' LYS . 0.1 OUTLIER -96.72 -31.34 12.72 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.311 1.044 . . . . 2.96 112.673 -166.086 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -79.83 -8.4 59.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.703 1.201 . . . . 3.4300000000000002 112.966 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -74.97 -7.13 52.73 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.894 1.278 . . . . 2.9199999999999999 113.484 159.323 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -134.48 -173.41 3.28 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.439 2.296 . . . . 4.0099999999999998 110.514 -178.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 57.6 73.08 0.48 Allowed 'General case' 0 CA--C 1.552 1.034 0 CA-C-O 122.809 1.29 . . . . 4.0 113.269 164.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -155.81 159.23 39.23 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.791 1.237 . . . . 6.0999999999999996 110.899 172.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 69.01 -27.43 0.3 Allowed Glycine 0 CA--C 1.534 1.221 0 C-N-CA 124.381 0.991 . . . . 5.3799999999999999 112.337 -160.316 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 81.9 mmt-85 -134.58 149.65 50.63 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.027 2.531 . . . . 5.1799999999999997 110.302 167.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 26.2 mm -140.3 152.24 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.893 2.077 . . . . 3.4500000000000002 107.315 172.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.4 m -117.38 144.01 45.39 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.503 1.521 . . . . 1.99 109.501 -177.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -58.91 -38.93 80.02 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 122.986 1.374 . . . . 1.8400000000000001 111.937 177.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -63.5 -20.98 66.05 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.305 2.642 . . . . 2.96 114.346 175.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -57.5 -55.48 34.21 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.919 1.236 . . . . 2.9700000000000002 109.713 171.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -55.39 -51.24 67.47 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.838 -0.539 . . . . 2.3999999999999999 111.507 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.3 t-105 -61.05 -45.58 94.19 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 118.927 -0.559 . . . . 0.66000000000000003 112.351 -178.289 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.7 t -72.12 -27.53 62.68 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 117.81 -1.091 . . . . 1.6899999999999999 112.343 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.476 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 74.4 mt -65.21 -44.71 87.46 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.769 1.168 . . . . 0.78000000000000003 111.535 168.685 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 36.8 mm -52.89 -38.55 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 CA-C-N 121.578 1.99 . . . . 0.94999999999999996 113.417 -177.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.2 -18.96 67.77 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 123.928 0.775 . . . . 0.72999999999999998 113.924 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -77.7 -25.16 63.31 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 118.522 1.161 . . . . 0.81000000000000005 113.321 176.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -87.55 -43.06 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 118.44 1.12 . . . . 0.94999999999999996 110.238 164.06 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 8.0 m -86.41 86.04 7.33 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.912 1.285 . . . . 1.51 109.177 -170.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -160.07 -74.37 0.02 OUTLIER Glycine 0 CA--C 1.533 1.206 0 C-N-CA 126.259 1.885 . . . . 0.72999999999999998 113.18 -171.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.59 -45.59 17.19 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.917 2.411 . . . . 0.95999999999999996 111.751 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.5 pt -71.82 -19.31 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 116.874 -1.536 . . . . 1.25 114.533 172.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -46.79 -58.91 3.43 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 121.71 2.05 . . . . 1.1100000000000001 112.902 178.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.13 -40.96 87.08 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.42 -1.425 . . . . 3.2799999999999998 112.583 177.462 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.2 tt -61.01 -46.67 89.8 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 118.465 0.575 . . . . 1.46 110.334 -178.231 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 49.7 mt -49.36 -48.21 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 126.141 1.776 . . . . 1.3400000000000001 111.903 175.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -76.72 -42.78 40.02 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.254 -0.579 . . . . 2.52 111.601 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -76.13 -21.64 56.38 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.888 -0.508 . . . . 2.8900000000000001 111.896 -169.151 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -50.74 -59.76 3.75 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 126.516 1.926 . . . . 2.1400000000000001 112.888 162.117 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -75.56 0.75 16.3 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 122.196 0.998 . . . . 3.4199999999999999 111.631 -170.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -98.09 -53.91 3.23 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.715 1.606 . . . . 2.3900000000000001 110.257 165.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 113.563 0.949 . . . . 5.1299999999999999 113.563 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.471 0.579 0 N-CA-C 108.121 -1.066 . . . . 2.6200000000000001 108.121 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 70.0 p -59.6 141.18 55.5 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 118.956 0.798 . . . . 1.2 110.751 -170.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.404 ' HG2' HG21 ' B' ' 117' ' ' VAL . 6.6 tt0 -65.39 -21.76 66.71 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 117.992 -1.004 . . . . 3.3799999999999999 112.33 -175.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -47.92 64.69 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.019 0.827 . . . . 0.80000000000000004 110.912 169.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -69.64 -52.21 27.9 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.863 0.756 . . . . 3.1299999999999999 110.783 -178.048 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -44.57 -45.94 9.71 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.193 1.397 . . . . 4.4900000000000002 114.01 164.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.911 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -63.0 -48.07 80.4 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 118.05 -0.976 . . . . 0.5 112.321 174.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 93.8 t -58.93 -35.52 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 120.061 1.3 . . . . 0.65000000000000002 111.296 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.0 mt -54.13 -46.77 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 CA-C-N 120.066 1.303 . . . . 0.79000000000000004 112.312 165.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 53.9 t -71.62 -42.01 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 120.459 -1.4 . . . . 0.68000000000000005 112.938 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.19 -30.49 68.25 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.886 -1.134 . . . . 1.0 111.052 174.146 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.3 t -73.49 -48.74 40.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-O 117.038 -1.458 . . . . 0.57999999999999996 111.799 172.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -38.54 81.97 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 121.416 1.916 . . . . 3.4100000000000001 112.949 176.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -64.88 -32.64 74.44 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.786 1.032 . . . . 2.1299999999999999 113.786 -176.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.461 ' CZ ' HG21 ' A' ' 23' ' ' VAL . 36.0 t80 -65.63 -57.51 7.94 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.69 -0.631 . . . . 2.2799999999999998 110.713 167.634 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.479 ' HA ' HG22 ' A' ' 23' ' ' VAL . 55.4 m-85 -68.97 -24.7 64.28 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.927 1.084 . . . . 1.78 113.927 -170.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.5 pttt -66.71 -24.8 66.29 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 121.27 1.85 . . . . 2.54 112.661 168.177 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -100.33 10.7 40.85 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.053 1.741 . . . . 2.8599999999999999 114.433 172.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.479 HG22 ' HA ' ' A' ' 20' ' ' TYR . 34.1 m . . . . . 0 CA--C 1.541 0.615 0 C-N-CA 125.626 1.57 . . . . 2.8100000000000001 108.207 164.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.5 tt . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 108.986 -0.746 . . . . 3.3599999999999999 108.986 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.0 m -114.27 142.15 46.66 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 107.77 -1.196 . . . . 2.8399999999999999 107.77 148.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.5 mttp -63.31 -19.58 64.73 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.614 -1.304 . . . . 2.7599999999999998 113.143 -168.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 5.3 p -49.97 -20.15 0.87 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.442 2.297 . . . . 2.1800000000000002 115.877 163.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 m -92.48 -18.34 23.33 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.565 1.691 . . . . 1.6100000000000001 115.565 170.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.412 ' CE1' HD11 ' A' ' 42' ' ' LEU . 27.7 t80 -60.47 -47.16 87.36 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 118.592 -2.567 . . . . 2.3100000000000001 111.296 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -58.04 -20.77 41.64 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.91 1.684 . . . . 2.5499999999999998 114.344 170.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.65 -49.13 6.25 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 126.591 1.956 . . . . 3.7999999999999998 108.853 -171.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 1.2 tmm? -48.67 -49.89 35.56 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.413 1.485 . . . . 1.49 111.295 163.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.412 HD11 ' CE1' ' A' ' 38' ' ' PHE . 38.4 mt -59.98 -9.96 3.64 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 115.627 1.714 . . . . 1.1899999999999999 115.627 172.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -112.23 -16.87 12.9 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.551 1.54 . . . . 2.0 112.589 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.8 -42.61 11.8 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.999 0.818 . . . . 2.9399999999999999 112.837 166.398 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -84.76 -53.16 5.54 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.099 1.36 . . . . 3.0 111.746 -174.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.3 mt -96.14 39.82 1.14 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.769 1.228 . . . . 2.54 112.334 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -76.41 -12.15 60.01 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.838 1.421 . . . . 1.5800000000000001 114.838 -169.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -88.19 -22.45 24.01 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.814 1.188 . . . . 1.6599999999999999 111.318 178.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.3 tpp -63.81 -6.87 6.44 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 128.054 2.541 . . . . 2.3799999999999999 114.336 172.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.2 mp -100.55 -179.9 4.23 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 128.393 2.677 . . . . 2.8300000000000001 113.754 -168.21 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.8 m -177.28 -101.19 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 129.086 2.954 . . . . 4.5999999999999996 107.148 175.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.59 17.3 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 128.202 2.601 . . . . 4.5199999999999996 115.066 -171.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.6 m 68.53 -1.85 1.8 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.425 2.29 . . . . 3.8900000000000001 111.316 -152.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.36 -47.26 69.51 Favored Glycine 0 N--CA 1.471 0.972 0 C-N-CA 125.119 1.342 . . . . 2.5099999999999998 113.874 -165.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -59.58 -51.83 68.14 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 117.699 0.749 . . . . 4.71 112.17 174.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -55.34 -28.9 56.83 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.584 1.327 . . . . 5.0800000000000001 114.584 171.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -55.18 -39.46 69.59 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 122.567 2.439 . . . . 3.6800000000000002 111.984 173.219 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.34 -12.06 60.97 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.078 1.51 . . . . 1.53 115.078 174.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.26 -52.25 6.38 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.598 1.159 . . . . 1.3100000000000001 112.284 163.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.92 -30.87 71.88 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.685 0.794 . . . . 2.71 111.758 -175.475 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.0 ptmm? -60.91 -27.4 68.16 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.999 1.111 . . . . 3.3900000000000001 113.999 171.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.3 mt -83.39 -32.49 26.15 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.227 0.611 . . . . 1.3799999999999999 112.297 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.1 mm -53.6 -55.54 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.719 1.207 . . . . 1.48 110.334 178.058 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -62.69 -39.4 93.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.227 1.011 . . . . 3.5800000000000001 112.531 -177.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.24 -28.97 56.99 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.775 1.23 . . . . 3.5600000000000001 113.767 171.361 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.5 mt -104.27 -26.4 12.5 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.763 1.394 . . . . 2.6600000000000001 114.763 177.328 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -66.39 -15.25 63.15 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.55 1.068 . . . . 3.6200000000000001 111.821 165.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.32 -27.32 59.22 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 115.07 1.507 . . . . 2.6299999999999999 115.07 160.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -109.62 -20.39 12.86 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.625 1.713 . . . . 2.4300000000000002 115.625 -168.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -139.15 124.84 19.54 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.584 -1.322 . . . . 4.4299999999999997 113.541 -166.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -77.59 17.96 0.48 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.202 1.801 . . . . 4.7300000000000004 115.422 -170.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.76 5.28 66.69 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 124.08 0.848 . . . . 2.4700000000000002 112.658 -159.1 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.23 134.73 57.34 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.408 1.104 . . . . 4.8499999999999996 109.204 146.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 34.8 mm -150.39 115.69 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 127.375 2.27 . . . . 2.1600000000000001 107.97 -176.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.8 t -95.8 -172.38 2.58 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.731 1.612 . . . . 2.6499999999999999 111.609 167.355 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -78.24 -40.45 37.23 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.474 1.11 . . . . 2.0899999999999999 112.034 170.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.75 -32.28 73.73 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.847 2.459 . . . . 3.1899999999999999 112.981 -168.338 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -58.59 -50.97 71.85 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 124.786 1.235 . . . . 4.0800000000000001 110.49 176.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -57.41 -49.66 75.48 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.588 -0.695 . . . . 2.6099999999999999 112.489 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 14.0 t-105 -61.83 -39.73 92.82 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 118.779 0.718 . . . . 0.85999999999999999 111.778 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.0 m -59.64 -47.12 86.86 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.283 1.433 . . . . 2.1899999999999999 111.082 174.018 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.86 -48.57 79.92 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.123 -0.941 . . . . 0.87 111.976 178.078 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.3 mm -55.09 -34.68 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 120.506 1.503 . . . . 1.02 112.84 -170.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -69.6 -21.21 76.2 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.072 0.844 . . . . 0.70999999999999996 113.753 177.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.47 -23.74 77.33 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.394 0.997 . . . . 0.73999999999999999 113.081 173.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.1 mp -89.74 -48.5 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.219 1.01 . . . . 1.1599999999999999 110.344 163.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.9 m -82.7 67.2 8.66 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 126.096 1.758 . . . . 1.3200000000000001 108.974 -173.21 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -146.69 -77.33 0.02 OUTLIER Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.596 1.569 . . . . 1.01 112.103 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -60.99 -40.66 50.43 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.545 2.83 . . . . 1.24 114.181 -170.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.7 pt -86.57 -14.91 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 119.455 1.025 . . . . 1.6399999999999999 113.146 173.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.48 -35.77 80.39 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.352 0.978 . . . . 1.29 113.155 -172.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -55.33 -44.69 76.09 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.094 -1.004 . . . . 2.6200000000000001 112.75 167.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.6 tt -60.7 -36.57 79.13 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.247 1.019 . . . . 1.2 111.222 -178.15 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.2 mt -50.39 -61.09 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 123.79 0.836 . . . . 0.89000000000000001 110.151 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.1 t60 -62.16 -35.36 78.55 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.245 -0.91 . . . . 1.8999999999999999 112.846 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -70.11 -23.07 62.97 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 122.986 0.514 . . . . 3.23 111.018 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -81.05 -30.28 34.84 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.228 1.411 . . . . 2.71 113.944 171.193 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -67.8 3.89 1.32 Allowed 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 120.292 1.405 . . . . 2.8300000000000001 112.182 166.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 . . . . . 0 CA--C 1.537 0.444 0 C-N-CA 125.705 1.602 . . . . 2.1699999999999999 111.08 170.285 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.538 0.497 0 CA-C-O 118.067 -0.968 . . . . 2.7200000000000002 110.989 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 77.4 p -54.01 139.85 33.2 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.863 1.21 . . . . 1.1699999999999999 110.018 -171.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -60.41 -36.67 78.68 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-O 116.433 -1.746 . . . . 3.73 109.514 -176.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.92 -50.56 66.13 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.61 1.55 . . . . 0.72999999999999998 111.364 174.269 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -68.02 -50.56 54.66 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.856 0.753 . . . . 3.0 111.737 -177.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -49.72 -40.93 42.31 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.705 -1.247 . . . . 4.7000000000000002 113.831 168.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.911 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.91 -40.53 75.53 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 124.971 1.308 . . . . 0.56000000000000005 111.766 177.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 95.6 t -60.79 -42.56 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 120.018 1.281 . . . . 0.79000000000000004 110.719 168.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 21.0 mt -52.46 -45.38 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 CA-C-N 120.436 1.471 . . . . 0.77000000000000002 111.934 168.117 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.404 HG21 ' HG2' ' A' ' 7' ' ' GLU . 22.4 t -68.62 -38.63 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 O-C-N 120.885 -1.134 . . . . 0.55000000000000004 113.232 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -58.02 -35.41 71.23 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.979 -1.076 . . . . 1.0900000000000001 111.536 170.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 93.9 t -74.71 -44.67 46.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 117.575 -1.203 . . . . 0.66000000000000003 111.042 -178.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.51 -37.94 85.55 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 120.551 1.523 . . . . 3.71 112.719 174.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -65.28 -33.24 75.52 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.833 1.049 . . . . 2.1699999999999999 113.833 -176.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -66.77 -55.57 14.37 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 121.266 -0.896 . . . . 2.1299999999999999 110.843 168.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 123' ' ' TYR . . . . . 0.437 ' HA ' HG22 ' B' ' 126' ' ' VAL . 51.4 m-85 -68.55 -24.21 64.6 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.791 1.034 . . . . 1.79 113.791 -171.582 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 36.7 pttt -69.18 -20.77 64.0 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.925 1.693 . . . . 2.4199999999999999 113.264 168.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -98.75 -0.02 43.57 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.828 1.651 . . . . 2.6099999999999999 115.001 170.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 126' ' ' VAL . . . . . 0.437 HG22 ' HA ' ' B' ' 123' ' ' TYR . 27.7 m . . . . . 0 N--CA 1.477 0.922 0 C-N-CA 126.118 1.767 . . . . 2.7000000000000002 109.45 171.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.3 tt . . . . . 0 N--CA 1.471 0.586 0 CA-C-O 120.808 0.337 . . . . 3.3199999999999998 110.928 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 60.3 m -92.08 138.54 31.45 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.679 -0.859 . . . . 3.3100000000000001 108.679 167.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -53.86 -26.02 22.6 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 120.532 -1.355 . . . . 2.75 114.259 -175.026 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 20.0 p -71.23 -8.65 55.0 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.811 2.044 . . . . 2.0600000000000001 116.057 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 2.2 m -80.59 -42.7 21.83 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.988 1.267 . . . . 1.48 112.459 -172.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.513 ' CE1' HD11 ' B' ' 145' ' ' LEU . 3.5 t80 -57.91 -49.06 78.03 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.661 1.184 . . . . 1.9399999999999999 112.011 -176.445 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -54.39 -20.69 7.88 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.162 1.171 . . . . 2.2400000000000002 114.162 173.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -105.39 -34.56 7.8 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.981 0.912 . . . . 2.4500000000000002 113.261 -173.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.6 tmm? -49.91 -49.96 47.96 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.554 1.142 . . . . 1.3500000000000001 110.697 158.059 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 145' ' ' LEU . . . . . 0.513 HD11 ' CE1' ' B' ' 141' ' ' PHE . 77.1 mt -57.05 -11.24 1.44 Allowed 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.813 1.783 . . . . 1.1000000000000001 115.813 168.73 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -106.35 -14.62 15.05 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 120.351 1.432 . . . . 2.1400000000000001 112.42 177.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.96 -38.27 6.67 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.201 1.4 . . . . 1.6899999999999999 113.387 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -77.68 -57.3 3.89 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.677 1.191 . . . . 3.2200000000000002 109.65 173.442 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.6 mt -91.95 42.3 1.1 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.26 1.024 . . . . 2.4500000000000002 111.643 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -71.76 -9.36 58.17 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.198 1.184 . . . . 2.0699999999999998 114.198 -172.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -92.98 -31.76 14.78 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.541 1.064 . . . . 1.6000000000000001 111.491 179.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 22.2 tpp -56.76 -1.73 0.07 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 128.897 2.879 . . . . 2.3399999999999999 115.933 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.7 mp -100.43 -173.98 2.54 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.638 2.375 . . . . 2.8399999999999999 114.427 -166.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 16.6 m -176.25 -104.98 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 129.824 3.25 . . . . 4.5099999999999998 107.393 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.44 12.73 0.06 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 128.068 2.547 . . . . 4.8899999999999997 115.511 -171.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 67.64 13.81 9.36 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.992 1.717 . . . . 4.5099999999999998 110.444 -134.38 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.19 -48.01 85.88 Favored Glycine 0 N--CA 1.473 1.155 0 C-N-CA 126.089 1.804 . . . . 3.04 115.854 -161.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -66.33 -48.65 69.59 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.611 1.205 . . . . 4.5899999999999999 111.42 174.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.0 ttt-85 -53.54 -28.22 30.32 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.664 1.357 . . . . 4.8200000000000003 114.664 175.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 55.9 mmtt -53.78 -36.17 62.11 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 122.247 2.294 . . . . 5.2300000000000004 111.535 173.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.44 -11.59 59.86 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.284 1.587 . . . . 1.3500000000000001 115.284 175.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -81.14 -51.58 8.3 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.274 1.03 . . . . 1.1399999999999999 111.616 164.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.18 -33.76 75.14 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.816 0.446 . . . . 2.6299999999999999 111.737 -173.226 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 7.6 ptmm? -58.11 -28.38 64.58 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.386 1.254 . . . . 3.4199999999999999 114.386 172.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 30.0 mt -79.09 -33.04 44.79 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.875 -0.516 . . . . 1.1599999999999999 112.163 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.4 mm -64.0 -52.19 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 123.686 0.794 . . . . 1.3999999999999999 109.372 -174.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -60.45 -38.01 82.8 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.828 1.251 . . . . 3.4300000000000002 112.251 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.02 -33.69 72.34 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.434 1.094 . . . . 3.2200000000000002 112.774 172.411 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.02 -21.57 19.66 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.193 -0.942 . . . . 3.52 112.401 -177.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -65.21 -19.62 66.06 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.16 1.384 . . . . 2.7400000000000002 113.519 166.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -73.06 -24.17 60.65 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.012 1.115 . . . . 2.1600000000000001 114.012 162.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 -116.71 -10.37 11.13 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.88 1.808 . . . . 2.2799999999999998 115.88 -165.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.51 138.11 24.58 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 121.326 1.876 . . . . 4.25 114.76 -173.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -87.4 1.15 54.2 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.416 1.635 . . . . 4.3899999999999997 115.416 -172.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 97.27 9.84 54.99 Favored Glycine 0 CA--C 1.533 1.194 0 O-C-N 121.201 -0.937 . . . . 2.52 112.907 -161.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.4 153.81 42.82 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 119.064 -1.054 . . . . 4.71 109.044 131.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 36.2 mm -152.74 140.58 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 128.814 2.846 . . . . 2.5299999999999998 106.32 178.163 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 3.7 t -106.2 167.51 9.76 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 119.849 1.204 . . . . 2.6000000000000001 112.431 163.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -57.51 -44.35 84.96 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.502 1.144 . . . . 2.1099999999999999 112.144 172.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -29.72 70.68 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.448 2.699 . . . . 3.52 112.248 -171.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.98 -46.38 81.73 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.024 0.93 . . . . 3.8300000000000001 111.024 178.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -57.57 -47.62 81.59 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.256 0.935 . . . . 2.4199999999999999 111.859 175.226 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.4 t-105 -60.06 -46.12 90.6 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.541 0.609 . . . . 0.85999999999999999 111.354 178.311 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 89.9 m -57.07 -46.09 82.76 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.968 1.307 . . . . 2.4500000000000002 110.766 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 71.9 mt -65.86 -40.67 91.89 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 117.056 -1.449 . . . . 1.0 112.603 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 25.3 mm -53.23 -39.24 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 CA-C-N 121.02 1.736 . . . . 0.88 112.261 -177.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.77 -18.63 62.04 Favored Glycine 0 CA--C 1.535 1.332 0 CA-C-N 119.446 1.021 . . . . 0.60999999999999999 114.034 176.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -77.78 -20.75 73.14 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-N 118.721 1.26 . . . . 0.84999999999999998 113.623 175.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.1 mp -94.44 -45.29 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.394 1.078 . . . . 1.49 110.666 166.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 23.8 m -82.16 80.01 8.5 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 125.937 1.695 . . . . 1.3999999999999999 107.727 -177.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -155.9 -78.98 0.02 OUTLIER Glycine 0 CA--C 1.531 1.067 0 CA-C-O 118.656 -1.08 . . . . 1.04 113.138 -174.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.09 -40.08 35.7 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.337 2.691 . . . . 1.0900000000000001 113.268 -172.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 18.9 pt -88.25 -14.69 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 N-CA-C 113.62 0.97 . . . . 1.6599999999999999 113.62 171.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -58.07 -39.56 78.81 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.926 1.239 . . . . 1.2 113.19 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -57.81 -45.61 85.85 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 120.617 -1.302 . . . . 2.8799999999999999 112.631 168.025 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.8 tt -59.2 -38.25 79.44 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 124.186 0.994 . . . . 1.4299999999999999 111.337 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 76.9 mt -49.59 -61.71 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 118.742 0.701 . . . . 1.02 110.281 167.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -59.02 -34.95 72.48 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 120.928 -1.108 . . . . 2.1000000000000001 113.331 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -70.24 -26.34 63.79 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.529 0.732 . . . . 3.3100000000000001 111.204 177.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -77.4 -32.48 54.82 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 117.569 -1.205 . . . . 2.6000000000000001 113.596 172.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -70.58 5.59 1.79 Allowed 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 120.288 1.404 . . . . 2.6899999999999999 112.391 169.25 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -114.08 -74.48 0.62 Allowed 'General case' 0 CA--C 1.534 0.335 0 O-C-N 120.223 -1.548 . . . . 2.4500000000000002 110.741 166.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.262 0 C-N-CA 129.981 3.313 . . . . 4.6399999999999997 115.759 168.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 . . . . . 0 N--CA 1.485 1.308 0 N-CA-C 106.967 -1.494 . . . . 2.5099999999999998 106.967 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.6 p -67.4 148.3 51.77 Favored 'General case' 0 N--CA 1.481 1.125 0 O-C-N 121.539 -0.726 . . . . 1.01 109.804 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -64.82 -19.26 65.76 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-O 118.015 -0.993 . . . . 2.6400000000000001 113.251 176.215 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.39 -53.96 35.68 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 121.439 1.927 . . . . 1.0600000000000001 109.011 172.012 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -63.65 -52.91 58.67 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.36 1.064 . . . . 3.2799999999999998 109.666 -179.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.3 tptt -60.54 -30.64 69.88 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 120.756 -1.215 . . . . 6.0499999999999998 113.497 174.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.841 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.02 -37.81 78.86 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 119.758 -1.839 . . . . 0.67000000000000004 113.076 170.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 71.8 t -56.03 -46.76 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.688 1.131 . . . . 0.62 110.062 164.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.8 mt -54.14 -52.25 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.977 1.262 . . . . 0.80000000000000004 111.683 172.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.5 t -60.36 -39.16 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.764 1.166 . . . . 0.64000000000000001 112.262 -177.291 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mp -68.76 -34.1 75.02 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.328 -0.857 . . . . 1.1499999999999999 113.058 173.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.3 t -75.25 -42.24 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.156 0.982 . . . . 0.67000000000000004 111.391 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -63.32 -37.73 88.38 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.893 0.769 . . . . 3.7200000000000002 111.572 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -55.26 -26.73 41.81 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 114.223 1.194 . . . . 1.97 114.223 175.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -87.87 -60.14 2.05 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.292 1.037 . . . . 2.2400000000000002 112.282 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -60.5 -28.45 68.38 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-O 118.824 -0.608 . . . . 1.72 112.442 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -54.86 -19.67 7.06 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 119.888 -1.758 . . . . 2.7400000000000002 114.465 172.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -93.31 10.08 33.56 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 114.933 1.457 . . . . 2.3599999999999999 114.933 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.477 0.923 0 CA-C-N 120.482 1.492 . . . . 2.8900000000000001 109.526 162.158 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 7.0 pt . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 111.448 0.166 . . . . 3.29 111.448 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.0 p -111.86 148.99 32.47 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.588 -1.32 . . . . 3.96 113.337 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.419 ' HE3' ' CG ' ' A' ' 70' ' ' HIS . 21.1 mttp -64.3 -32.24 73.76 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.624 -0.672 . . . . 2.4900000000000002 111.998 174.037 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 p -69.84 -38.84 76.64 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.508 1.123 . . . . 2.2999999999999998 113.417 179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.4 m -76.23 -34.71 59.22 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 117.831 -1.081 . . . . 1.51 113.064 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -53.97 -52.75 59.69 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.881 1.673 . . . . 2.04 112.448 -177.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -61.42 -25.33 67.13 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.274 0.842 . . . . 2.1400000000000001 113.274 177.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -89.37 -51.2 5.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.419 1.487 . . . . 3.1800000000000002 110.293 -170.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 11.2 tmm? -48.39 -41.13 28.08 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.352 1.461 . . . . 1.71 111.965 163.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.9 mt -58.54 -32.05 68.52 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.788 1.403 . . . . 1.05 114.788 173.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -92.02 -3.34 55.95 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.587 1.54 . . . . 2.0299999999999998 113.418 177.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.96 -65.22 0.99 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.356 1.063 . . . . 1.75 111.614 164.43 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -75.29 -18.53 60.03 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.849 -1.157 . . . . 2.5099999999999998 112.78 -169.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.93 16.8 19.32 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.906 1.282 . . . . 2.1099999999999999 113.605 177.176 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -49.95 -34.49 20.87 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 114.642 1.349 . . . . 1.77 114.642 -175.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.413 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 53.9 m-70 -69.16 -21.17 64.01 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.848 1.425 . . . . 1.5600000000000001 114.848 -175.566 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 52.1 mtm -114.44 -15.44 12.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.91 0.884 . . . . 2.0699999999999998 112.981 169.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 tt -74.61 68.49 1.65 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 123.294 1.521 . . . . 2.7000000000000002 110.361 163.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.4 t -94.83 -70.5 0.71 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 126.052 1.741 . . . . 3.6200000000000001 108.767 171.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -77.23 138.51 39.47 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.5 0.667 . . . . 7.0300000000000002 112.019 -165.19 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.2 m -50.06 -29.61 9.19 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.968 1.307 . . . . 4.1900000000000004 112.776 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.64 -48.2 85.86 Favored Glycine 0 CA--C 1.532 1.101 0 CA-C-O 118.648 -1.084 . . . . 3.0499999999999998 113.087 175.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -51.31 -60.5 3.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.559 1.143 . . . . 3.79 110.062 172.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -67.1 -37.74 84.47 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 113.57 0.952 . . . . 4.5599999999999996 113.57 -171.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.74 -40.01 88.15 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 117.581 -1.199 . . . . 4.5499999999999998 113.541 176.693 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -53.48 -49.4 67.56 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 127.093 2.746 . . . . 1.3300000000000001 110.76 174.073 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.66 -54.45 33.18 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.786 1.634 . . . . 0.94999999999999996 113.15 171.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.81 -29.0 69.87 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-O 118.493 -0.765 . . . . 2.0899999999999999 112.799 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt -61.0 -33.26 72.97 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-N 121.113 1.779 . . . . 3.0800000000000001 112.742 171.564 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.4 mt -68.78 -38.03 79.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.55 -0.295 . . . . 1.1399999999999999 110.682 -178.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 23.3 mm -56.44 -53.61 38.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 125.326 1.45 . . . . 1.21 111.76 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -67.34 -37.23 82.94 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.157 0.983 . . . . 1.8500000000000001 111.678 178.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -63.29 -33.73 76.14 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.025 0.379 . . . . 3.2999999999999998 112.025 173.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 14.0 tp -78.37 -20.57 50.97 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 120.867 -1.146 . . . . 3.8199999999999998 112.1 -177.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -56.56 -25.68 52.9 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.922 0.889 . . . . 3.4300000000000002 113.127 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.91 -2.96 49.72 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 115.656 1.724 . . . . 2.6400000000000001 115.656 172.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -130.03 19.9 5.44 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.956 1.253 . . . . 2.9399999999999999 114.154 -166.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.419 ' CG ' ' HE3' ' A' ' 35' ' ' LYS . 42.3 t-80 -146.25 92.21 2.15 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.235 -1.541 . . . . 6.9699999999999998 113.643 -157.415 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -73.54 36.0 0.09 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 127.026 2.13 . . . . 5.0700000000000003 113.089 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.79 10.2 84.95 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 126.569 2.033 . . . . 2.5699999999999998 113.672 -169.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -107.03 158.88 16.71 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.805 2.442 . . . . 4.7300000000000004 111.12 -172.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.4 mm -130.95 138.16 54.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 108.473 -0.936 . . . . 2.2200000000000002 108.473 161.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.2 t -73.46 -129.05 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 127.68 2.392 . . . . 2.8700000000000001 109.999 170.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -133.19 -44.15 0.85 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 120.143 -1.598 . . . . 2.04 110.242 164.347 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -64.76 -20.14 66.19 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.95 1.093 . . . . 4.54 113.95 -176.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -53.2 -56.28 17.65 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.642 1.177 . . . . 3.73 112.043 173.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -58.12 -45.79 86.71 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.283 0.947 . . . . 2.25 112.151 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.5 t-105 -65.3 -40.9 94.41 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.613 0.765 . . . . 0.71999999999999997 111.981 -178.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.8 m -59.71 -46.02 90.36 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.577 1.951 . . . . 1.97 111.676 171.092 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.5 mt -56.8 -42.82 80.17 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.751 0.705 . . . . 1.03 111.639 176.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.8 mm -52.67 -40.65 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 CA-C-N 119.749 1.159 . . . . 0.64000000000000001 112.582 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.54 -24.96 72.65 Favored Glycine 0 N--CA 1.476 1.329 0 C-N-CA 124.557 1.075 . . . . 0.58999999999999997 113.559 177.326 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -71.34 -23.22 78.31 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 121.445 -1.032 . . . . 0.57999999999999996 113.447 176.053 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -90.13 -45.04 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 118.616 1.208 . . . . 0.84999999999999998 110.568 162.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.6 m -85.72 64.67 8.75 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 127.821 2.448 . . . . 1.3 108.883 -172.128 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -144.02 -60.73 0.02 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.201 1.382 . . . . 1.25 111.742 -177.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -66.21 -72.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.991 3.127 . . . . 1.1000000000000001 110.647 165.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.4 pp -66.91 -14.11 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.483 1.038 . . . . 1.3700000000000001 113.666 -170.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.0 -33.94 74.03 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.67 0.989 . . . . 1.1299999999999999 113.67 -177.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -42.15 95.09 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.871 -1.143 . . . . 2.98 112.523 170.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.2 tt -56.52 -39.21 72.95 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 124.456 1.102 . . . . 1.3899999999999999 110.516 -173.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 22.2 mt -45.39 -62.8 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.675 1.59 . . . . 0.90000000000000002 111.837 169.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -69.31 -29.38 67.21 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.687 0.795 . . . . 1.76 112.515 -175.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.264 2.5 pt-20 -83.35 -16.89 44.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.112 0.869 . . . . 2.96 112.421 177.155 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 -83.32 -42.11 17.49 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 115.205 1.557 . . . . 2.3599999999999999 115.205 173.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -69.83 4.28 2.09 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 123.512 1.625 . . . . 2.3999999999999999 112.028 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 . . . . . 0 C--N 1.329 -0.319 0 C-N-CA 127.722 2.409 . . . . 2.6499999999999999 109.7 176.853 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.413 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 17.4 m-85 . . . . . 0 N--CA 1.487 1.401 0 N-CA-C 107.826 -1.176 . . . . 2.5499999999999998 107.826 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.8 p -70.2 147.62 49.6 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 118.833 0.742 . . . . 1.01 109.478 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -64.8 -18.77 65.39 Favored 'General case' 0 C--O 1.213 -0.831 0 N-CA-C 113.549 0.944 . . . . 2.9500000000000002 113.549 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.94 -54.36 27.34 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 121.072 1.76 . . . . 1.0800000000000001 108.843 172.245 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -62.84 -52.15 64.25 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.801 1.241 . . . . 3.2200000000000002 110.429 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 25.2 tptt -60.79 -29.93 69.74 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.543 0.942 . . . . 6.8300000000000001 113.543 173.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.841 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.3 -37.5 77.82 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.045 -1.659 . . . . 0.71999999999999997 112.858 170.609 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 91.3 t -57.61 -45.37 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-N 119.964 1.256 . . . . 0.67000000000000004 109.58 166.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 6.9 mt -53.84 -53.86 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.252 0.933 . . . . 0.93000000000000005 111.455 171.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 18.4 t -58.21 -42.85 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 119.532 1.06 . . . . 0.67000000000000004 111.864 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 4.4 mp -66.25 -41.82 89.42 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.296 -0.877 . . . . 1.1299999999999999 112.731 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 50.2 t -67.43 -40.88 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.85 0.86 . . . . 0.76000000000000001 111.328 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 59.9 tt0 -65.44 -39.79 92.48 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 118.718 0.69 . . . . 3.7000000000000002 112.42 171.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -60.25 -19.45 54.75 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.173 1.351 . . . . 2.4399999999999999 114.123 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -91.2 -60.66 1.84 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.989 1.316 . . . . 2.0800000000000001 112.522 170.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -59.13 -27.5 65.66 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.104 0.866 . . . . 1.8 113.135 -176.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -49.11 -19.37 0.43 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.383 1.623 . . . . 2.7000000000000002 115.383 177.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -83.55 -13.29 54.79 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 116.077 1.88 . . . . 2.3100000000000001 116.077 174.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 N--CA 1.482 1.16 0 CA-C-N 121.187 1.812 . . . . 4.2300000000000004 109.527 174.153 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 10.0 pt . . . . . 0 N--CA 1.473 0.723 0 CA-C-O 120.815 0.34 . . . . 3.0699999999999998 110.818 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 79.5 p -116.42 141.23 48.44 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.012 -1.055 . . . . 3.9700000000000002 113.08 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 11.9 mttp -53.7 -28.42 33.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.133 1.373 . . . . 2.3500000000000001 112.925 173.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 9.5 p -72.94 -34.3 66.47 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.937 1.295 . . . . 2.6000000000000001 113.982 176.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 45.4 t -82.43 -43.23 17.55 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 117.799 -1.096 . . . . 2.9900000000000002 113.335 -169.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.471 ' CE1' HD11 ' B' ' 145' ' ' LEU . 12.3 t80 -54.72 -48.42 72.55 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.939 1.699 . . . . 1.99 112.566 -176.554 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -60.36 -27.21 67.21 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.504 0.927 . . . . 2.3300000000000001 113.504 176.324 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -92.94 -50.28 5.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.836 1.654 . . . . 3.1299999999999999 111.266 -170.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 10.7 tmm? -51.27 -39.84 57.61 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.724 1.21 . . . . 1.79 111.575 167.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 145' ' ' LEU . . . . . 0.471 HD11 ' CE1' ' B' ' 141' ' ' PHE . 14.0 mt -54.47 -36.99 64.7 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.481 1.289 . . . . 1.25 114.481 174.024 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.84 -4.8 59.22 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.926 1.239 . . . . 2.0099999999999998 113.467 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.28 -61.21 1.56 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.227 1.011 . . . . 1.6399999999999999 111.505 163.362 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.27 -18.22 46.68 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.878 1.671 . . . . 2.5 112.775 -164.731 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.25 20.56 13.1 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 126.319 1.848 . . . . 2.1000000000000001 113.147 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -51.8 -33.04 33.82 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.946 1.462 . . . . 1.6599999999999999 114.946 -173.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -69.24 -26.34 64.74 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.826 1.047 . . . . 1.47 113.826 -174.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 53.3 mtm -109.71 -14.47 14.33 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.026 0.93 . . . . 2.27 112.702 171.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.09 65.0 1.09 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 122.919 1.342 . . . . 2.71 111.037 163.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 3.5 t -88.63 -67.47 0.83 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.245 -1.343 . . . . 3.5 108.853 170.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -80.79 139.23 36.15 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.61 0.719 . . . . 7.2599999999999998 112.185 -161.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 51.1 m -49.13 -31.99 9.16 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.867 1.267 . . . . 4.2199999999999998 112.303 173.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.58 -50.72 64.45 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.855 -0.97 . . . . 3.0800000000000001 112.802 176.402 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -49.31 -60.92 2.4 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.539 1.136 . . . . 3.75 110.634 171.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -69.58 -35.74 75.63 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.716 1.006 . . . . 4.4500000000000002 113.716 -170.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.0 -40.17 90.9 Favored 'General case' 0 CA--C 1.511 -0.542 0 O-C-N 120.454 -1.404 . . . . 4.5700000000000003 112.946 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -50.47 -51.45 46.9 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 126.593 2.433 . . . . 1.5600000000000001 110.551 174.162 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -48.9 -56.43 8.82 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.144 0.978 . . . . 0.70999999999999996 112.554 173.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.48 -34.61 71.09 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.868 0.867 . . . . 1.8999999999999999 112.738 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -59.82 -34.13 72.67 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 120.628 1.558 . . . . 3.1699999999999999 113.231 172.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.2 mt -68.93 -34.0 74.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.35 -0.387 . . . . 0.87 111.55 -178.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 23.3 mm -64.31 -48.7 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 123.515 0.726 . . . . 0.96999999999999997 110.876 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -68.77 -34.83 76.23 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.413 1.085 . . . . 1.8700000000000001 112.059 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 28.8 m-20 -62.33 -43.19 99.41 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 120.569 0.223 . . . . 3.1800000000000002 111.343 169.248 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 12.4 tp -67.34 -19.97 65.52 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 120.865 -1.147 . . . . 3.52 112.671 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.35 -26.3 64.94 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.77 0.656 . . . . 3.7400000000000002 112.77 176.382 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.76 -5.11 56.7 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.318 1.599 . . . . 2.6099999999999999 115.318 171.088 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -120.39 12.88 11.76 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.049 1.34 . . . . 3.0699999999999998 114.103 -167.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -143.35 90.57 2.18 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 120.377 -1.452 . . . . 6.8899999999999997 114.196 -153.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -72.58 39.39 0.08 Allowed 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 126.446 1.898 . . . . 5.2800000000000002 113.207 173.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 69.73 6.34 55.07 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 125.99 1.757 . . . . 2.4500000000000002 114.103 -171.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -96.64 163.23 13.11 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.602 1.961 . . . . 4.46 110.875 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 19.2 mm -129.32 143.82 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 107.769 -1.197 . . . . 2.4399999999999999 107.769 157.18 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 22.1 t -75.2 -138.18 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.953 2.101 . . . . 2.54 110.728 171.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -125.14 -46.26 1.81 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 119.865 -1.772 . . . . 1.99 110.514 161.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -62.04 -19.89 63.37 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.44 1.274 . . . . 4.46 114.44 -178.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -52.15 -52.86 49.14 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.275 1.03 . . . . 3.4199999999999999 111.996 172.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -62.62 -45.53 92.44 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.917 -1.114 . . . . 2.98 111.554 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.0 t-105 -62.43 -44.64 95.94 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.517 0.727 . . . . 0.76000000000000001 112.306 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 58.4 m -55.68 -50.9 69.03 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.778 1.631 . . . . 1.97 110.956 170.158 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 81.9 mt -60.35 -33.23 72.12 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.194 -0.908 . . . . 0.69999999999999996 112.967 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 29.3 mm -55.49 -42.47 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 CA-C-N 120.564 1.529 . . . . 0.73999999999999999 111.807 174.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.37 -24.72 73.68 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.745 1.164 . . . . 0.64000000000000001 113.651 178.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.02 -19.77 77.38 Favored Glycine 0 CA--C 1.536 1.353 0 O-C-N 121.269 -1.136 . . . . 0.68999999999999995 113.566 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 5.0 mp -93.74 -47.37 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 118.421 1.111 . . . . 0.80000000000000004 110.63 160.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.4 m -83.63 62.73 7.02 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 128.425 2.69 . . . . 1.3700000000000001 109.174 -173.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -142.29 -60.77 0.03 OUTLIER Glycine 0 CA--C 1.528 0.9 0 C-N-CA 125.695 1.617 . . . . 1.23 111.301 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -64.3 -73.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 124.146 3.23 . . . . 1.2 111.048 165.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.4 pp -66.37 -14.58 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 119.708 1.14 . . . . 1.3400000000000001 113.805 -169.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.63 -32.49 73.53 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.639 1.176 . . . . 1.2 114.08 -176.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -44.93 91.43 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.603 -1.311 . . . . 3.0800000000000001 112.537 168.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.1 tt -57.48 -36.51 71.58 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.414 1.086 . . . . 1.54 111.325 -172.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 29.2 mt -45.44 -63.05 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.872 1.669 . . . . 0.87 110.997 170.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -65.63 -35.4 80.7 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.607 0.763 . . . . 1.8100000000000001 111.91 -176.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.297 2.2 pt-20 -76.91 -20.25 56.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.544 1.066 . . . . 3.0800000000000001 112.51 177.706 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 5.2 mm100 -80.76 -42.75 21.28 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 115.329 1.604 . . . . 2.4700000000000002 115.329 174.053 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -70.44 6.18 1.49 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 123.609 1.671 . . . . 2.5 112.385 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -125.36 -68.44 0.84 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.506 2.322 . . . . 2.48 110.407 176.109 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.295 11.3 pt20 . . . . . 0 N--CA 1.477 0.879 1 C-N-CA 131.944 4.097 . . . . 3.8700000000000001 115.681 -177.79 . . . . . . . . 2 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 113.946 1.091 . . . . 2.4700000000000002 113.946 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.8 p -73.14 154.23 40.42 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.107 0.563 . . . . 1.29 111.451 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.34 2.11 8.21 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.259 1.023 . . . . 2.6200000000000001 113.1 169.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.11 -56.33 4.16 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.598 -1.314 . . . . 1.1499999999999999 109.306 158.309 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -76.94 -50.51 13.07 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 120.854 -1.154 . . . . 2.73 112.837 -168.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.0 tmtt? -58.38 -24.86 61.17 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.209 -0.932 . . . . 5.2300000000000004 111.494 169.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -74.31 -43.23 57.58 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 119.662 -1.899 . . . . 0.68999999999999995 112.721 168.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 77.0 t -55.29 -35.65 37.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 CA-C-N 120.612 1.551 . . . . 0.68000000000000005 111.258 169.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 38.2 mt -53.88 -58.9 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.026 0.83 . . . . 1.02 111.081 165.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 49.2 t -61.37 -40.16 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.28 1.032 . . . . 0.92000000000000004 113.424 -177.053 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.7 mp -65.26 -40.06 93.46 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.522 1.056 . . . . 1.04 111.843 177.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.0 t -63.84 -43.8 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-O 118.747 -0.644 . . . . 0.59999999999999998 110.605 171.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.46 -43.53 75.57 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.695 0.68 . . . . 3.6499999999999999 111.51 173.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.75 -15.87 63.85 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.979 1.474 . . . . 2.3900000000000001 114.979 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -86.3 -53.41 5.04 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.109 -0.994 . . . . 2.1699999999999999 111.306 167.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -60.61 -39.41 88.05 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.804 0.668 . . . . 1.9299999999999999 112.804 -175.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -19.76 65.06 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 114.981 1.475 . . . . 3.5899999999999999 114.981 173.654 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -95.44 -28.98 14.65 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.695 1.198 . . . . 2.6800000000000002 112.603 172.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.6 t . . . . . 0 N--CA 1.485 1.321 0 CA-C-N 118.974 0.806 . . . . 3.27 110.771 165.28 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.4 pt . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 108.995 -0.743 . . . . 2.9199999999999999 108.995 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.7 m -60.14 136.64 58.08 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.24 0.829 . . . . 2.48 113.24 -166.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.463 ' HB3' HG23 ' A' ' 63' ' ' ILE . 10.9 mtpp -55.75 -31.85 62.9 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 120.877 -1.14 . . . . 4.7199999999999998 113.518 176.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.72 -30.86 14.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.774 1.63 . . . . 2.6899999999999999 113.151 169.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.9 m -77.58 -36.29 52.12 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.985 -1.072 . . . . 1.79 112.622 -174.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 12.5 t80 -53.01 -56.19 17.95 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.283 0.947 . . . . 1.8799999999999999 111.023 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.402 ' HG3' HH11 ' A' ' 39' ' ' ARG . 13.9 ptt85 -61.62 -8.39 4.42 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.844 1.258 . . . . 3.04 113.966 -178.443 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -117.0 -32.79 4.94 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.943 1.297 . . . . 4.2199999999999998 113.715 -174.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 5.6 tmm? -50.97 -42.98 60.41 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.873 0.76 . . . . 1.4199999999999999 109.399 150.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.1 mt -62.68 -19.02 63.44 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 115.502 1.668 . . . . 1.3 115.502 169.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -91.57 -35.5 14.23 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 119.714 1.143 . . . . 2.6499999999999999 112.106 172.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -81.27 -50.98 8.88 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.042 0.837 . . . . 1.8799999999999999 112.271 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -78.46 -30.58 47.49 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.907 0.776 . . . . 2.6800000000000002 111.769 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.16 19.41 20.64 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.055 1.342 . . . . 1.5700000000000001 113.763 -177.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -48.09 -35.38 11.25 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.143 1.777 . . . . 1.4299999999999999 115.228 -173.275 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.474 ' H ' ' CD2' ' A' ' 48' ' ' HIS . 7.4 m-70 -65.21 -21.11 66.71 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.437 1.495 . . . . 1.79 114.588 -178.258 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 39.4 ttm -95.22 10.52 35.71 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.462 1.505 . . . . 2.7000000000000002 114.325 -169.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.7 mp -81.11 169.81 16.96 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.818 1.247 . . . . 3.54 112.489 178.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.3 m -157.12 36.35 0.29 Allowed 'General case' 0 N--CA 1.476 0.838 0 O-C-N 119.843 -1.786 . . . . 4.3600000000000003 110.386 -164.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.6 t70 92.71 -175.06 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 129.592 3.157 . . . . 4.0599999999999996 107.865 -146.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 52.8 p -66.38 -12.76 58.69 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.971 1.708 . . . . 2.8799999999999999 114.764 170.018 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.46 -30.72 42.12 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 125.668 1.604 . . . . 1.6200000000000001 114.644 -171.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -69.24 -45.55 69.52 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.483 1.513 . . . . 3.23 110.65 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.9 ttt-85 -65.74 -47.33 75.66 Favored 'General case' 0 C--N 1.346 0.448 0 O-C-N 121.461 -0.774 . . . . 5.1900000000000004 110.039 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.8 mmtt -55.94 -29.04 59.51 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.09 0.774 . . . . 4.1299999999999999 113.09 175.395 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.86 -39.27 69.79 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 117.759 -1.115 . . . . 1.5800000000000001 112.305 171.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.62 -44.37 93.48 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.386 1.075 . . . . 1.0 111.969 172.003 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -53.01 -37.57 61.6 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.376 1.07 . . . . 2.2599999999999998 112.731 175.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -61.3 -34.53 75.37 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 120.195 -1.565 . . . . 3.6699999999999999 112.797 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.4 mt -74.5 -38.2 62.93 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.04 1.336 . . . . 1.1399999999999999 111.852 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.463 HG23 ' HB3' ' A' ' 35' ' ' LYS . 17.8 mm -49.56 -59.18 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 117.726 -1.13 . . . . 1.25 109.595 170.343 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -62.51 -36.15 81.66 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 119.603 1.092 . . . . 2.8900000000000001 113.091 -174.327 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -62.71 -34.48 77.23 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.859 1.263 . . . . 2.6699999999999999 113.009 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -86.36 -44.85 11.74 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.368 1.067 . . . . 3.29 112.266 176.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -62.43 -38.76 90.97 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.281 1.433 . . . . 2.54 111.724 -168.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.78 -18.72 13.71 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.66 1.184 . . . . 2.3199999999999998 114.117 171.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -113.43 -0.54 14.44 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.082 1.753 . . . . 3.1099999999999999 113.099 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -135.24 128.77 32.54 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 120.964 1.711 . . . . 3.9100000000000001 112.042 -163.702 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -79.49 46.56 0.76 Allowed 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 122.599 1.19 . . . . 4.8200000000000003 112.042 -175.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 59.45 2.24 1.5 Allowed Glycine 0 CA--C 1.538 1.489 0 C-N-CA 125.24 1.4 . . . . 4.0599999999999996 113.043 -157.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -79.06 100.63 7.44 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 120.609 -1.524 . . . . 7.8799999999999999 110.977 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.5 pt -69.58 166.4 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.965 1.706 . . . . 3.4100000000000001 112.976 162.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 64.2 m -141.87 169.36 17.74 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.451 1.5 . . . . 2.1699999999999999 110.973 166.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -52.62 -55.74 20.25 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.31 1.053 . . . . 2.0499999999999998 111.927 179.008 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.02 -37.82 64.49 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 128.733 2.813 . . . . 2.98 111.785 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -74.77 -46.98 33.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.588 1.155 . . . . 3.6800000000000002 110.603 -171.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -51.12 -54.09 28.28 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.725 0.693 . . . . 1.8300000000000001 111.002 167.023 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 22.6 t-105 -62.78 -46.87 86.01 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 118.375 0.534 . . . . 0.56999999999999995 111.873 -171.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 39.1 p -61.31 -43.49 98.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 117.785 -1.102 . . . . 2.8399999999999999 111.549 178.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 23.8 mt -56.44 -36.88 69.51 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.173 -0.918 . . . . 0.98999999999999999 113.231 175.717 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.1 mm -51.07 -36.52 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-N 120.127 1.33 . . . . 0.84999999999999998 111.232 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.49 -19.65 76.42 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.479 1.037 . . . . 0.68000000000000005 114.646 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.11 -11.84 84.96 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 119.083 1.441 . . . . 0.64000000000000001 113.44 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.8 mp -105.0 -45.71 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.041 1.336 . . . . 0.80000000000000004 110.263 165.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.7 m -80.71 88.18 5.79 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 126.582 1.953 . . . . 1.26 107.782 178.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -172.22 -77.6 0.05 OUTLIER Glycine 0 CA--C 1.528 0.856 0 CA-C-O 118.384 -1.231 . . . . 0.85999999999999999 112.602 -170.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -59.71 -41.53 54.61 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.417 2.745 . . . . 1.0800000000000001 112.756 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.8 pt -77.39 -11.39 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 114.216 1.191 . . . . 1.1499999999999999 114.216 174.224 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.16 -32.63 74.07 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 113.936 1.087 . . . . 1.05 113.936 -166.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -43.68 97.57 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.856 -1.153 . . . . 3.4100000000000001 111.963 169.571 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.5 tt -61.43 -37.82 84.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.892 1.277 . . . . 1.4199999999999999 110.875 -169.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 97.3 mt -50.06 -67.14 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.29 1.436 . . . . 1.0900000000000001 110.97 168.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -59.7 -29.83 68.38 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.598 -1.314 . . . . 1.78 112.998 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.24 -29.68 65.41 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.944 0.898 . . . . 2.9100000000000001 111.781 174.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -77.81 -37.96 47.48 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.782 2.033 . . . . 4.9400000000000004 110.984 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -63.01 4.1 0.2 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 123.483 1.611 . . . . 2.5899999999999999 113.331 171.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 . . . . . 0 C--N 1.326 -0.444 0 C-N-CA 125.301 1.44 . . . . 3.0 110.925 169.384 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 113.555 0.946 . . . . 2.3199999999999998 113.555 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 20.7 p -67.98 154.8 40.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 122.608 0.363 . . . . 1.0900000000000001 110.105 -175.51 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -57.92 -38.39 75.81 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-O 118.322 -0.846 . . . . 2.4900000000000002 111.471 174.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.1 -53.52 49.18 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.523 1.056 . . . . 0.79000000000000004 110.67 173.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 12.1 tm-20 -74.64 -47.4 32.28 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.613 -0.68 . . . . 2.8399999999999999 111.769 -170.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -60.95 -28.1 68.72 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.873 0.869 . . . . 4.8799999999999999 111.908 171.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -70.38 -41.43 73.07 Favored 'General case' 0 C--O 1.222 -0.39 0 O-C-N 119.559 -1.963 . . . . 0.48999999999999999 112.565 166.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 64.3 t -59.71 -37.04 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 120.572 1.533 . . . . 0.67000000000000004 110.698 171.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 26.2 mt -53.41 -59.17 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 118.913 0.778 . . . . 0.82999999999999996 111.166 164.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 44.3 t -61.45 -40.83 87.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-N 119.342 0.973 . . . . 0.69999999999999996 113.307 -175.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.7 mp -63.18 -45.47 91.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.593 1.157 . . . . 1.0600000000000001 111.68 174.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 44.5 t -57.16 -46.45 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-O 118.794 -0.622 . . . . 0.67000000000000004 110.302 173.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.1 -44.77 75.23 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 118.849 0.749 . . . . 3.46 111.391 173.365 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -67.36 -15.67 63.81 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.933 1.457 . . . . 2.25 114.933 -179.332 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -85.04 -58.19 2.79 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.442 -0.786 . . . . 2.4300000000000002 111.151 166.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -57.74 -38.47 75.39 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.133 0.79 . . . . 1.8799999999999999 113.133 -175.219 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -19.59 65.98 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.534 1.309 . . . . 3.5099999999999998 114.534 175.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -92.86 -32.58 14.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.509 1.123 . . . . 2.4900000000000002 112.337 169.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 97.7 t . . . . . 0 N--CA 1.487 1.414 0 CA-C-N 119.348 0.976 . . . . 3.2000000000000002 111.043 167.453 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 3.8 pt . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 109.56 -0.533 . . . . 3.02 109.56 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 2.9 m -59.53 138.86 57.56 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.995 1.109 . . . . 2.23 113.995 -164.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -56.89 -37.75 71.81 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 120.426 -1.421 . . . . 4.7000000000000002 110.48 169.144 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 66.0 m -55.94 -13.36 1.82 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.803 2.041 . . . . 3.46 116.093 167.584 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 74.5 m -88.76 -39.19 14.11 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.42 1.463 . . . . 1.75 111.975 169.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -52.54 -48.23 66.22 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 120.242 1.383 . . . . 2.2000000000000002 111.819 -179.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 19.6 ptt85 -55.23 -18.76 6.59 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.776 1.399 . . . . 3.3500000000000001 114.776 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -114.8 -32.12 5.91 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.759 1.223 . . . . 3.3999999999999999 113.659 -172.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 6.3 tmm? -50.67 -46.46 58.63 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.725 -0.472 . . . . 1.48 109.725 153.294 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 4.4 mt -63.87 -27.63 69.29 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 114.923 1.453 . . . . 1.3300000000000001 114.923 170.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -77.35 -33.46 55.34 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 120.258 1.39 . . . . 2.5299999999999998 112.177 175.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -84.77 -55.33 4.15 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.392 0.677 . . . . 1.54 112.801 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -77.0 -19.52 57.17 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.639 0.654 . . . . 2.71 112.589 -174.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.52 20.02 12.51 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.464 1.506 . . . . 1.8600000000000001 113.294 -177.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -52.13 -26.0 10.24 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 116.159 1.911 . . . . 1.3899999999999999 116.159 -172.307 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 151' ' ' HIS . . . . . 0.403 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 6.6 m-70 -77.47 -25.19 50.29 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.87 -1.144 . . . . 1.8400000000000001 113.576 -175.219 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 32.1 ttm -80.01 27.81 0.3 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.338 1.455 . . . . 2.8799999999999999 113.973 -171.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.6 mp -102.71 173.69 6.22 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.437 1.895 . . . . 4.0199999999999996 113.289 -171.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 62.5 m -162.22 43.53 0.14 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 126.032 1.733 . . . . 4.5599999999999996 109.469 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 7.5 t70 82.82 -175.98 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.575 2.35 . . . . 4.4900000000000002 108.498 -144.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 70.7 p -66.46 -15.82 63.64 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 128.468 2.707 . . . . 2.9199999999999999 114.87 -178.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.71 -37.27 67.98 Favored Glycine 0 N--CA 1.476 1.309 0 CA-C-N 120.622 1.555 . . . . 1.7 113.328 -173.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.97 -39.62 94.55 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.387 1.475 . . . . 3.52 110.79 176.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 43.2 ttt-85 -71.59 -38.81 70.84 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.327 -0.858 . . . . 4.71 112.942 167.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -57.48 -33.44 68.0 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.237 -1.539 . . . . 3.1400000000000001 111.175 178.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 161' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' B' ' 164' ' ' LYS . . . -65.28 -13.95 59.6 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 115.973 1.842 . . . . 1.27 115.973 171.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.01 -49.53 10.14 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.822 1.249 . . . . 0.92000000000000004 110.817 164.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -59.48 -34.53 72.7 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 125.047 1.339 . . . . 2.8500000000000001 111.686 -176.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 164' ' ' LYS . . . . . 0.497 ' HG2' ' HA ' ' B' ' 161' ' ' ALA . 1.9 ptmm? -55.55 -31.1 61.86 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 120.861 -1.149 . . . . 3.98 113.684 169.696 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 23.4 mt -82.8 -37.33 24.65 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.332 -0.855 . . . . 1.1599999999999999 112.391 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 26.8 mm -47.89 -60.61 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.098 0.959 . . . . 0.97999999999999998 109.299 173.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -58.25 -39.26 78.71 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.37 0.878 . . . . 1.9199999999999999 113.37 -174.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -62.69 -29.6 70.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.594 1.558 . . . . 2.8399999999999999 112.637 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -99.69 -47.2 5.16 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.308 1.443 . . . . 3.5899999999999999 110.839 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -53.61 -48.03 69.67 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 128.863 2.865 . . . . 2.6200000000000001 111.533 -178.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.52 -15.1 15.76 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 115.009 1.485 . . . . 3.2000000000000002 115.009 175.025 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -118.28 5.74 11.89 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.982 1.713 . . . . 4.0599999999999996 112.852 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.02 134.18 42.12 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 119.749 -1.844 . . . . 4.2699999999999996 113.627 -164.004 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -79.83 58.86 2.96 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 122.422 1.106 . . . . 4.6399999999999997 111.604 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 62.8 19.54 60.96 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.169 1.842 . . . . 4.1900000000000004 113.451 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -88.67 153.34 21.19 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 122.835 1.302 . . . . 7.7800000000000002 114.06 -163.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 5.3 pt -132.15 169.65 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 128.022 2.529 . . . . 3.8700000000000001 109.784 170.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 58.6 m -142.09 176.66 8.79 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.019 1.328 . . . . 1.71 109.562 165.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -59.15 -52.58 65.11 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 122.371 1.081 . . . . 2.1899999999999999 110.083 168.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -43.71 87.17 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 129.053 2.941 . . . . 3.0600000000000001 111.128 -178.765 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -72.64 -47.43 47.65 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.454 1.102 . . . . 3.6000000000000001 110.691 -174.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -51.33 -51.53 53.56 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.931 1.241 . . . . 1.9199999999999999 111.598 168.35 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -65.25 -41.79 93.94 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.394 0.516 . . . . 0.69999999999999996 112.394 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 41.7 p -65.5 -37.21 86.13 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 117.908 -1.044 . . . . 2.6499999999999999 111.777 176.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 76.3 mt -57.33 -39.91 76.88 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.973 0.806 . . . . 0.57999999999999996 112.549 172.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 42.2 mm -54.07 -44.79 64.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 119.773 1.17 . . . . 0.91000000000000003 111.596 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -70.15 -5.63 54.3 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 125.081 1.324 . . . . 1.03 114.266 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -93.3 -11.97 57.86 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-O 118.495 -1.169 . . . . 0.67000000000000004 113.775 170.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.9 mp -95.35 -56.21 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 119.036 1.418 . . . . 1.1699999999999999 107.895 164.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 42.1 m -74.65 98.01 3.33 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 126.252 1.821 . . . . 1.4199999999999999 108.119 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -170.45 -80.18 0.05 OUTLIER Glycine 0 CA--C 1.532 1.143 0 C-N-CA 124.985 1.279 . . . . 1.01 112.787 -172.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -62.53 -43.38 22.21 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.126 2.551 . . . . 1.4299999999999999 112.125 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 10.4 pt -72.49 -10.35 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 114.313 1.227 . . . . 1.3799999999999999 114.313 173.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 194' ' ' ALA . . . . . 0.44 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -60.92 -35.18 76.03 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.109 1.152 . . . . 1.23 114.109 -174.263 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -48.82 80.06 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.471 -1.393 . . . . 3.7400000000000002 111.734 166.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.14 -37.83 78.21 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.183 1.393 . . . . 1.5700000000000001 111.917 -174.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 197' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' B' ' 194' ' ' ALA . 96.5 mt -53.29 -60.7 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.441 1.496 . . . . 1.22 111.935 168.603 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -63.74 -30.67 71.74 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.381 -0.824 . . . . 1.8 112.094 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -71.72 -27.28 62.9 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.4 -0.812 . . . . 2.96 111.86 175.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -73.98 -39.67 63.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.821 1.248 . . . . 5.3499999999999996 110.248 179.028 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.6 1.81 0.53 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 125.408 1.483 . . . . 3.1000000000000001 112.905 172.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -109.73 -71.35 0.77 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 120.427 -1.42 . . . . 2.8999999999999999 111.579 167.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 . . . . . 0 CA--C 1.532 0.268 0 CA-C-N 114.92 -1.037 . . . . 5.9800000000000004 112.414 -164.751 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 . . . . . 0 N--CA 1.477 0.898 0 CA-C-O 120.844 0.354 . . . . 2.4100000000000001 111.22 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 70.5 p -57.53 148.21 24.53 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.84 0.856 . . . . 1.0700000000000001 109.634 176.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.618 ' HG2' HG21 ' B' ' 117' ' ' VAL . 4.1 tp10 -59.17 -31.42 68.97 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 118.554 0.615 . . . . 2.2799999999999998 111.445 175.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.87 -41.75 98.23 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.681 -0.637 . . . . 1.1100000000000001 111.0 177.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -53.09 13.17 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 118.407 -0.806 . . . . 3.3700000000000001 110.495 175.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -42.32 -43.09 3.36 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.343 1.057 . . . . 4.9000000000000004 112.5 170.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.17 -42.09 76.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 125.054 1.342 . . . . 0.54000000000000004 112.668 -178.211 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 54.3 t -56.52 -46.41 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.99 0.814 . . . . 0.90000000000000002 109.762 167.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 16.3 mt -54.77 -49.15 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-N 118.413 0.551 . . . . 0.90000000000000002 111.432 174.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.615 HG21 ' HG2' ' B' ' 110' ' ' GLU . 32.7 t -65.07 -41.71 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 118.997 0.817 . . . . 0.59999999999999998 112.341 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.56 -41.38 97.29 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.251 -0.905 . . . . 0.93999999999999995 111.233 176.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 80.1 t -72.66 -37.33 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.275 1.43 . . . . 0.83999999999999997 112.486 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -55.51 -54.75 40.01 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.312 1.045 . . . . 3.04 110.142 170.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -71.12 -9.57 58.28 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.198 1.184 . . . . 2.7400000000000002 114.198 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.431 ' HB2' ' CE2' ' A' ' 79' ' ' TYR . 60.0 t80 -79.95 -65.62 0.98 Allowed 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.853 -1.154 . . . . 2.48 112.22 167.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -63.69 -28.63 70.03 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 118.934 -0.555 . . . . 2.25 112.053 -170.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.0 mtpt -46.35 -38.59 9.01 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.354 1.462 . . . . 2.6499999999999999 114.44 168.336 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -92.41 -26.09 18.18 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.808 -0.557 . . . . 2.3300000000000001 111.325 -176.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.8 t . . . . . 0 N--CA 1.473 0.678 0 C-N-CA 126.243 1.817 . . . . 3.0699999999999998 112.881 176.051 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.3 tt . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 108.379 -0.971 . . . . 2.9300000000000002 108.379 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.8 m -163.9 163.29 23.71 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 127.081 2.152 . . . . 3.7599999999999998 109.433 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.4 pttt -47.15 -13.3 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.273 0 N-CA-C 118.011 2.597 . . . . 2.79 118.011 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.3 m -78.98 -28.02 43.5 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 119.912 -1.743 . . . . 2.3799999999999999 114.501 169.031 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.8 m -77.66 -48.76 16.02 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.624 1.102 . . . . 1.53 111.477 -171.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.431 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 9.8 t80 -49.13 -49.6 41.38 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.166 0.986 . . . . 2.0099999999999998 112.032 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -58.3 -30.24 66.5 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 118.23 -0.891 . . . . 3.79 113.16 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -96.58 -40.93 8.79 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.172 1.389 . . . . 2.8799999999999999 113.533 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 43.3 ttp -49.43 -42.1 41.83 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.863 1.665 . . . . 2.5899999999999999 112.044 163.66 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.431 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 12.0 mt -55.01 -19.99 8.18 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 114.398 1.258 . . . . 0.96999999999999997 114.398 170.465 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -98.75 -11.23 22.09 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.447 1.499 . . . . 2.6499999999999999 113.009 177.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 -59.5 1.77 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.275 1.03 . . . . 1.6100000000000001 112.118 170.597 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -76.9 -26.42 54.13 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.708 1.203 . . . . 3.5899999999999999 113.156 -172.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.15 43.91 2.34 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.006 1.722 . . . . 1.6200000000000001 111.745 -179.001 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -84.24 -17.86 38.38 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 116.566 2.061 . . . . 1.3400000000000001 116.566 -171.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.523 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 10.5 m-70 -80.92 -25.99 37.08 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 120.917 1.69 . . . . 1.7 113.244 -168.051 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 76.0 mtm -97.59 15.5 23.21 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.182 1.393 . . . . 2.5499999999999998 113.257 164.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.26 -152.56 0.29 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.194 1.798 . . . . 2.6299999999999999 110.853 174.54 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.1 t 69.11 -35.91 0.32 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.849 2.059 . . . . 6.6100000000000003 113.78 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -35.03 18.26 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 127.3 2.24 . . . . 6.3499999999999996 113.075 174.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 95.1 m 74.41 -23.45 0.23 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 127.329 2.252 . . . . 2.7999999999999998 114.123 169.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.26 -48.97 76.15 Favored Glycine 0 CA--C 1.532 1.154 0 CA-C-N 120.549 1.522 . . . . 2.25 110.244 160.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -37.47 -65.2 0.33 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.073 2.549 . . . . 4.1699999999999999 111.254 159.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.9 tpm_? -56.77 -46.52 81.41 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 114.613 1.338 . . . . 5.8099999999999996 114.613 -175.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -66.28 -35.86 81.49 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.534 0.733 . . . . 3.02 111.586 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.19 -32.87 66.89 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 118.086 -0.959 . . . . 1.1200000000000001 112.885 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.56 -44.12 95.05 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.422 1.089 . . . . 0.93999999999999995 112.78 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.99 -22.73 59.5 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.172 0.804 . . . . 3.4900000000000002 113.172 -175.374 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -54.88 -37.79 66.73 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 121.552 -0.718 . . . . 3.1099999999999999 112.167 164.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 12.6 mt -74.63 -43.7 54.13 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.159 -0.928 . . . . 1.1499999999999999 111.175 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.0 mm -60.22 -39.04 79.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 118.408 -0.806 . . . . 1.3500000000000001 111.384 -175.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -72.32 -37.58 68.88 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.889 0.876 . . . . 2.3999999999999999 113.297 176.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -62.82 -34.9 78.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.902 1.281 . . . . 3.3799999999999999 112.552 171.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.1 tp -82.27 -36.64 26.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.259 1.424 . . . . 2.5800000000000001 111.454 178.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -43.71 -57.13 3.37 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.8 2.04 . . . . 4.4199999999999999 113.024 -169.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.42 -16.34 3.56 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.702 2.001 . . . . 2.3199999999999998 114.844 -177.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -110.89 -1.62 16.4 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.918 1.287 . . . . 2.3300000000000001 113.059 -173.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 30.6 m80 -138.06 101.21 4.36 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.024 -1.047 . . . . 3.4500000000000002 112.755 -166.536 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.13 27.4 0.14 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.942 2.097 . . . . 4.6600000000000001 114.349 -171.097 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.77 32.8 58.72 Favored Glycine 0 CA--C 1.533 1.161 0 O-C-N 120.112 -1.618 . . . . 2.4300000000000002 110.643 -150.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.8 mmt-85 -95.34 159.17 15.13 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.051 1.34 . . . . 5.9100000000000001 108.615 162.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.4 mm -145.26 140.66 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 126.454 1.902 . . . . 2.23 107.895 -173.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 t -116.97 173.47 6.63 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.671 0.748 . . . . 1.9199999999999999 112.15 166.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -78.19 -47.47 17.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.355 1.062 . . . . 2.3300000000000001 111.988 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -73.3 -23.86 60.33 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.092 2.157 . . . . 2.77 113.372 -178.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -48.07 -61.19 2.1 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.807 2.043 . . . . 3.27 111.075 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.431 ' CE2' ' HB2' ' A' ' 19' ' ' PHE . 6.8 t80 -54.98 -49.29 71.81 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.312 -0.868 . . . . 1.95 111.485 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.486 ' CZ2' HG21 ' B' ' 186' ' ' ILE . 19.6 t-105 -61.0 -48.18 83.01 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.239 0.615 . . . . 1.0600000000000001 111.881 -178.25 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.5 t -73.28 -25.15 60.56 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.752 -1.118 . . . . 2.1099999999999999 112.647 -178.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.7 mt -69.45 -36.11 76.3 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.562 1.073 . . . . 0.92000000000000004 112.274 170.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.449 HG21 ' CZ2' ' B' ' 183' ' ' TRP . 21.4 mm -48.23 -44.11 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 CA-C-N 120.336 1.425 . . . . 0.79000000000000004 111.408 177.285 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.45 -15.1 44.72 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 124.159 0.885 . . . . 0.73999999999999999 114.998 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.86 -19.81 60.71 Favored Glycine 0 CA--C 1.533 1.161 0 CA-C-N 118.741 1.27 . . . . 0.71999999999999997 114.077 172.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.0 mp -99.13 -52.49 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-N 119.139 1.47 . . . . 0.92000000000000004 109.24 170.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.1 m -73.91 59.23 0.69 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 128.225 2.61 . . . . 1.45 108.387 167.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -146.11 -69.63 0.01 OUTLIER Glycine 0 CA--C 1.525 0.692 0 C-N-CA 126.711 2.1 . . . . 1.0700000000000001 109.299 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -58.0 -50.88 9.0 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.273 2.649 . . . . 1.52 112.742 173.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.9 pp -90.8 -11.82 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 113.827 1.047 . . . . 1.46 113.827 -175.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.58 -29.99 70.66 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 120.842 -1.161 . . . . 1.74 113.448 -174.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -37.74 67.42 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.036 -1.04 . . . . 3.6299999999999999 113.792 168.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.6 tt -56.58 -40.35 75.09 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.829 1.252 . . . . 2.02 110.807 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 57.0 mt -47.92 -62.8 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.059 1.344 . . . . 1.3799999999999999 110.1 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -73.24 -24.82 60.52 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.966 -1.084 . . . . 1.8100000000000001 112.794 -174.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -67.65 -27.89 67.24 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-O 118.489 -0.767 . . . . 3.6400000000000001 110.136 168.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -90.27 -38.59 13.31 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.328 1.851 . . . . 2.3199999999999998 115.745 178.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -61.37 -2.66 0.74 Allowed 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 121.47 1.941 . . . . 2.2000000000000002 112.054 167.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 N--CA 1.451 -0.392 0 C-N-CA 126.129 1.771 . . . . 1.9199999999999999 111.838 165.53 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.523 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 85.8 m-85 . . . . . 0 N--CA 1.475 0.802 0 N-CA-C 110.168 -0.308 . . . . 2.6699999999999999 110.168 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 81.3 p -64.14 156.8 27.32 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 121.372 -0.83 . . . . 1.22 110.373 171.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 110' ' ' GLU . . . . . 0.615 ' HG2' HG21 ' A' ' 14' ' ' VAL . 1.5 tp10 -60.38 -19.52 56.08 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.219 0.463 . . . . 2.71 111.49 171.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -44.9 66.07 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.599 1.56 . . . . 1.01 111.369 172.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.37 -44.57 62.38 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 117.69 -1.147 . . . . 2.9399999999999999 111.634 173.116 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 113' ' ' LYS . . . . . 0.407 ' O ' HG23 ' B' ' 117' ' ' VAL . 1.7 mmmp? -43.83 -48.05 8.23 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.621 1.555 . . . . 4.6600000000000001 111.088 165.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -66.21 -53.36 38.18 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 118.045 -0.978 . . . . 0.81000000000000005 113.606 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 42.6 t -52.84 -46.61 52.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 CA-C-N 119.707 1.14 . . . . 0.92000000000000004 111.131 174.468 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 93.8 mt -53.16 -52.35 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.846 1.258 . . . . 1.3799999999999999 110.926 170.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 117' ' ' VAL . . . . . 0.618 HG21 ' HG2' ' A' ' 7' ' ' GLU . 21.8 t -67.62 -37.96 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-N 119.97 1.259 . . . . 0.56000000000000005 112.543 -175.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -61.78 -41.86 98.26 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.062 0.945 . . . . 0.98999999999999999 111.055 175.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 72.9 t -75.07 -40.44 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.886 1.274 . . . . 0.81999999999999995 112.302 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -51.93 -56.42 14.24 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.724 1.21 . . . . 3.0800000000000001 110.086 170.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -69.78 -15.08 63.06 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.811 1.041 . . . . 3.0099999999999998 113.811 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -83.79 -60.85 1.99 Allowed 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.406 -0.809 . . . . 2.02 113.103 172.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -58.34 -32.9 68.96 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.66 -0.65 . . . . 2.3399999999999999 112.16 -174.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -41.24 -44.54 2.67 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.102 1.761 . . . . 2.6699999999999999 114.293 169.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -89.16 -29.52 19.26 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.46 0.704 . . . . 2.2599999999999998 112.282 -176.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 56.1 t . . . . . 0 N--CA 1.474 0.763 0 C-N-CA 126.217 1.807 . . . . 3.3900000000000001 111.991 176.765 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.7 tt . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 107.544 -1.28 . . . . 3.0899999999999999 107.544 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 6.2 m -161.79 162.82 29.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 124.354 1.062 . . . . 3.5299999999999998 110.273 173.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 30.3 pttt -50.98 -11.06 0.08 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 128.301 2.64 . . . . 2.6600000000000001 117.066 -179.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.0 m -80.99 -27.9 35.73 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 119.706 -1.872 . . . . 2.1299999999999999 114.418 166.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 26.8 m -76.86 -46.4 24.81 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.572 -1.33 . . . . 1.3200000000000001 112.058 -169.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -51.23 -50.16 59.68 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.513 1.125 . . . . 2.4199999999999999 112.438 175.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -65.01 -12.28 48.57 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.979 1.103 . . . . 3.5299999999999998 113.979 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -98.37 -43.67 6.83 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 120.171 1.351 . . . . 2.48 111.225 170.05 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 63.2 ttp -54.04 -41.85 68.54 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.279 1.831 . . . . 2.9100000000000001 112.479 177.376 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 11.7 mt -59.86 -29.3 68.2 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.913 -1.117 . . . . 1.53 113.625 172.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -80.48 -9.82 59.76 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.901 1.281 . . . . 2.6099999999999999 112.885 176.162 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.99 -64.72 1.01 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.551 1.14 . . . . 1.55 111.366 167.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -75.85 -13.71 60.28 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.557 -1.339 . . . . 3.1899999999999999 114.279 -172.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.2 18.13 9.12 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.104 1.362 . . . . 1.6699999999999999 112.748 177.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -53.75 -28.45 34.58 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 115.365 1.617 . . . . 1.26 115.365 -171.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -66.98 -25.89 66.54 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 114.128 1.159 . . . . 1.6200000000000001 114.128 -169.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 68.1 mtm -105.14 11.59 32.99 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.407 1.083 . . . . 2.5 112.598 171.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 153' ' ' LEU . . . . . 0.453 HD23 ' H ' ' B' ' 154' ' ' SER . 0.2 OUTLIER -99.21 -163.76 1.07 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.448 1.899 . . . . 2.3999999999999999 110.398 -178.701 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.453 ' H ' HD23 ' B' ' 153' ' ' LEU . 5.3 t 70.53 -23.16 0.17 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.235 1.814 . . . . 7.0899999999999999 113.988 -177.576 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -65.54 16.67 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 128.309 2.644 . . . . 7.0099999999999998 114.638 177.7 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 98.8 m 62.41 -65.83 0.09 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 128.853 2.861 . . . . 4.1900000000000004 113.548 -179.087 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -54.01 -40.52 66.15 Favored Glycine 0 N--CA 1.468 0.825 0 C-N-CA 125.543 1.544 . . . . 2.4399999999999999 112.692 -172.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -43.74 -67.5 0.27 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.77 1.628 . . . . 4.1600000000000001 112.232 168.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 25.0 ttt-85 -73.79 -29.58 62.26 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.105 -0.997 . . . . 5.04 112.528 -173.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -61.19 -42.42 98.55 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.574 -1.328 . . . . 3.1400000000000001 112.137 171.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.12 -37.61 74.91 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.55 0.944 . . . . 1.23 113.55 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -58.02 -47.18 83.84 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.851 1.26 . . . . 0.95999999999999996 112.856 173.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.06 -23.59 60.58 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.438 -0.789 . . . . 3.3999999999999999 112.906 -173.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -54.5 -36.64 64.4 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.683 -0.635 . . . . 3.02 112.058 164.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 7.4 mt -73.76 -46.04 48.11 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.523 -0.762 . . . . 1.04 110.712 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 7.1 mm -60.31 -42.73 91.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.691 0.678 . . . . 1.26 112.002 -175.211 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -68.65 -36.46 78.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.486 1.114 . . . . 1.98 113.223 177.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -70.24 -37.62 75.01 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.06 1.344 . . . . 2.8399999999999999 111.57 174.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 10.5 tp -74.48 -32.74 62.65 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.62 1.168 . . . . 2.5800000000000001 111.506 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -46.4 -54.58 8.83 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 125.822 1.649 . . . . 4.0300000000000002 112.808 -172.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -61.53 -4.95 1.52 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.337 1.855 . . . . 2.27 115.771 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -121.35 -2.76 9.49 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.526 1.13 . . . . 2.27 113.423 -176.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 66.7 m80 -137.15 89.61 2.45 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.889 -1.132 . . . . 3.6099999999999999 111.978 -167.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.78 29.32 0.09 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.581 2.752 . . . . 4.75 114.564 -167.051 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.35 32.23 58.22 Favored Glycine 0 CA--C 1.534 1.24 0 O-C-N 120.268 -1.52 . . . . 2.5699999999999998 110.557 -149.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 47.1 mmt-85 -103.23 151.32 22.79 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.231 1.812 . . . . 5.9100000000000001 107.388 161.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 33.2 mm -144.49 140.78 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 127.281 2.232 . . . . 2.2400000000000002 106.713 -172.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.1 t -119.81 171.3 8.51 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.754 0.788 . . . . 1.97 112.559 171.023 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -77.99 -46.46 21.0 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.062 0.945 . . . . 2.4300000000000002 112.327 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -71.2 -23.6 62.06 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.473 1.909 . . . . 2.7799999999999998 113.213 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -48.51 -60.5 2.64 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 127.083 2.153 . . . . 3.1800000000000002 111.061 175.656 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -57.17 -46.21 83.01 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.299 -0.876 . . . . 1.95 111.602 -179.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 183' ' ' TRP . . . . . 0.449 ' CZ2' HG21 ' A' ' 83' ' ' ILE . 19.9 t-105 -61.86 -46.19 90.52 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.366 0.666 . . . . 1.0600000000000001 112.395 -178.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 6.5 t -69.05 -36.75 78.04 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.803 0.729 . . . . 1.76 111.299 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 81.6 mt -61.18 -37.22 82.15 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.458 1.026 . . . . 0.71999999999999997 113.288 174.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 186' ' ' ILE . . . . . 0.486 HG21 ' CZ2' ' A' ' 80' ' ' TRP . 15.3 mm -49.51 -44.85 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 120.049 1.295 . . . . 0.91000000000000003 110.795 176.147 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -64.67 -13.13 55.23 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.607 1.098 . . . . 0.63 114.601 -177.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -83.41 -20.64 59.95 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-N 118.7 1.25 . . . . 0.79000000000000004 113.906 170.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 5.1 mp -96.06 -55.56 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 119.429 1.615 . . . . 1.0900000000000001 108.797 171.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 27.6 m -73.11 59.17 0.52 Allowed 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 128.638 2.775 . . . . 1.48 108.555 169.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -142.84 -72.11 0.03 OUTLIER Glycine 0 CA--C 1.525 0.717 0 C-N-CA 126.882 2.182 . . . . 1.05 108.458 175.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -58.94 -51.27 7.17 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.208 2.605 . . . . 1.4399999999999999 113.169 174.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.0 pp -87.18 -10.77 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.5 1.046 . . . . 1.5800000000000001 113.087 -175.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.06 -31.04 70.41 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 120.975 -1.078 . . . . 1.71 113.054 -173.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 195' ' ' LYS . . . . . 0.411 ' HB2' ' HE3' ' B' ' 195' ' ' LYS . 0.0 OUTLIER -56.59 -36.75 69.72 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 117.815 -1.088 . . . . 3.3900000000000001 113.048 172.588 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.7 tt -55.98 -40.15 72.86 Favored 'General case' 0 C--O 1.217 -0.605 0 C-N-CA 124.342 1.057 . . . . 2.4100000000000001 110.671 -177.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 88.2 mt -48.4 -61.71 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.63 1.172 . . . . 1.25 110.869 171.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -65.54 -34.97 79.5 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 121.595 -0.691 . . . . 1.8100000000000001 111.729 -176.011 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -68.49 -21.3 64.62 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 118.728 -0.653 . . . . 3.5499999999999998 110.769 176.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -91.85 -38.77 12.13 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.063 1.745 . . . . 2.2799999999999998 114.751 173.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -59.98 -6.69 1.41 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 121.229 1.831 . . . . 2.3999999999999999 112.208 164.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -104.65 -93.32 0.35 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.453 1.501 . . . . 2.1899999999999999 112.105 162.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.142 0 C-N-CA 128.424 2.689 . . . . 3.98 113.934 -172.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.5 m-30 . . . . . 0 N--CA 1.482 1.162 0 N-CA-C 111.747 0.277 . . . . 2.1200000000000001 111.747 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.8 p -73.68 159.19 33.38 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.807 0.843 . . . . 1.25 110.351 169.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -64.95 -20.52 66.51 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.702 -0.624 . . . . 2.54 111.661 170.495 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.89 -45.76 77.02 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 118.749 -0.643 . . . . 0.93999999999999995 109.926 173.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.16 -49.68 66.56 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 117.331 -1.318 . . . . 3.4700000000000002 112.187 172.143 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -41.6 -48.46 4.03 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 121.045 1.748 . . . . 5.04 112.273 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.787 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -72.71 -47.31 48.15 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-O 117.306 -1.33 . . . . 0.64000000000000001 112.727 -177.856 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.64 -40.42 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 CA-C-N 121.14 1.791 . . . . 0.63 110.619 173.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 88.4 mt -54.17 -58.46 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.207 1.003 . . . . 1.0700000000000001 110.696 168.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.9 t -61.58 -35.15 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 125.542 1.537 . . . . 0.68999999999999995 112.964 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -69.71 -39.17 77.03 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.85 0.86 . . . . 1.02 110.515 175.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 68.6 t -75.56 -34.41 29.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.024 0.929 . . . . 0.71999999999999997 111.339 178.098 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -61.64 -45.5 93.76 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 124.916 1.286 . . . . 3.0499999999999998 111.262 168.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -58.56 -23.54 58.71 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.612 0.967 . . . . 2.1499999999999999 113.612 174.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -82.98 -60.87 2.02 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.822 -1.174 . . . . 2.1499999999999999 112.489 170.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -69.07 -13.74 62.61 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.761 1.023 . . . . 2.0 113.761 -174.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.5 mttp -31.83 -48.24 0.15 Allowed 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 127.872 2.469 . . . . 2.2799999999999998 112.851 162.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -98.38 6.22 47.48 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.543 1.137 . . . . 2.3599999999999999 112.664 -171.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.2 t . . . . . 0 N--CA 1.477 0.918 0 C-N-CA 124.552 1.141 . . . . 2.8900000000000001 110.189 -170.066 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 42.6 pt . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 110.109 -0.33 . . . . 2.46 110.109 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.5 m -66.14 140.66 58.23 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.561 -1.337 . . . . 2.4399999999999999 111.549 178.148 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -61.95 -17.74 57.95 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.342 1.238 . . . . 2.7999999999999998 114.342 -169.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.0 p -54.37 -33.34 58.96 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.802 -1.186 . . . . 2.1200000000000001 112.231 168.458 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.1 m -60.05 -25.59 65.47 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.644 -1.285 . . . . 1.55 113.737 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 54.7 t80 -65.5 -62.51 1.48 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.308 1.413 . . . . 2.0899999999999999 111.441 175.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -58.26 -21.92 50.41 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.202 1.001 . . . . 2.25 112.653 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.405 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 25.5 mt-10 -93.23 -44.74 8.18 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 124.662 1.185 . . . . 3.8399999999999999 113.459 -174.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -32.1 68.04 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.593 1.088 . . . . 1.55 111.137 163.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.6 mt -66.24 -19.23 65.76 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 115.576 1.695 . . . . 1.04 115.576 169.123 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.41 -24.4 13.48 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.963 1.256 . . . . 3.1299999999999999 113.475 171.329 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 1.6 mppt? -86.07 -48.2 8.85 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.78 1.232 . . . . 2.6200000000000001 110.639 -178.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -86.77 -36.97 18.28 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.235 1.014 . . . . 2.9300000000000002 112.238 -178.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.3 mt -103.75 50.04 0.81 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.035 0.934 . . . . 2.5699999999999998 111.883 173.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -68.17 36.3 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 125.575 1.55 . . . . 2.1000000000000001 113.61 175.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -136.42 -96.03 0.23 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.577 1.951 . . . . 1.9399999999999999 110.745 -159.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.1 ptp -56.57 -20.23 19.77 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.638 1.563 . . . . 2.6299999999999999 114.436 174.442 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.2 mp -80.65 64.23 5.36 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 123.801 1.762 . . . . 3.5299999999999998 110.25 162.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.1 m -79.83 -10.74 59.82 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 113.036 -1.893 . . . . 3.9199999999999999 114.425 -158.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -151.96 164.77 36.47 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.659 1.584 . . . . 4.5999999999999996 109.639 160.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.5 m -34.47 -44.15 0.19 Allowed 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 129.443 3.097 . . . . 2.6400000000000001 112.805 160.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.34 -32.09 79.62 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 117.653 -1.637 . . . . 2.2400000000000002 114.39 -179.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -78.6 -47.67 16.67 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.214 1.507 . . . . 2.9100000000000001 109.679 170.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -48.73 -29.62 4.68 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.421 1.889 . . . . 5.3799999999999999 115.571 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.7 mtmt -48.36 -34.42 10.68 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.933 -1.104 . . . . 4.6900000000000004 113.838 168.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.59 -16.49 63.41 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.54 1.311 . . . . 1.0700000000000001 114.54 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.07 -49.01 8.64 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.719 0.808 . . . . 0.89000000000000001 111.67 168.392 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.0 -31.5 72.43 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 112.916 0.709 . . . . 2.4399999999999999 112.916 -179.135 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -57.31 -28.84 63.42 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.105 -0.997 . . . . 2.5800000000000001 112.703 174.188 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 45.9 mt -78.32 -30.52 48.31 Favored 'General case' 0 C--O 1.224 -0.238 0 O-C-N 121.637 -0.664 . . . . 0.91000000000000003 111.404 -178.252 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.5 mm -66.25 -49.02 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 123.94 0.896 . . . . 0.91000000000000003 110.13 -178.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.57 -37.22 85.32 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.94 1.296 . . . . 2.9900000000000002 113.061 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -65.88 -25.05 67.0 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.382 1.473 . . . . 2.5600000000000001 113.979 171.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -87.94 -80.06 0.28 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 117.715 -1.136 . . . . 2.4100000000000001 109.842 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -50.64 -34.7 27.24 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.437 1.471 . . . . 3.5899999999999999 114.771 -158.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -54.37 -18.86 4.57 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 115.249 1.574 . . . . 3.75 115.249 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -132.48 5.48 4.04 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.541 1.936 . . . . 3.73 113.866 168.105 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -141.4 9.79 2.06 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 116.144 1.905 . . . . 4.6799999999999997 116.144 -164.325 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -51.76 145.34 9.65 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.504 1.521 . . . . 7.1799999999999997 112.869 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 71.47 -22.91 0.64 Allowed Glycine 0 CA--C 1.535 1.334 0 C-N-CA 126.333 1.92 . . . . 2.6400000000000001 114.795 -173.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -94.39 135.11 36.17 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.294 1.437 . . . . 5.4900000000000002 110.893 -178.145 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.2 mm -147.07 111.98 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.975 1.71 . . . . 2.46 107.446 177.35 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.4 m -85.3 -158.87 0.4 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.302 1.441 . . . . 2.3700000000000001 111.334 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -109.03 -57.18 2.19 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 119.685 -1.884 . . . . 2.1499999999999999 109.988 170.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -52.32 -25.77 10.47 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 131.407 3.883 . . . . 3.0800000000000001 114.269 170.057 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -51.21 -59.21 4.44 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.422 1.489 . . . . 3.04 111.444 170.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -51.04 -44.71 61.11 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.6 -0.688 . . . . 2.3799999999999999 111.623 176.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 28.4 t-105 -64.52 -46.8 81.36 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.485 -0.769 . . . . 0.57999999999999996 111.996 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.9 t -74.47 -22.88 58.87 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 117.683 -1.151 . . . . 1.79 113.407 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.41 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 84.5 mt -65.68 -44.83 85.01 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.931 1.241 . . . . 0.62 110.331 169.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 27.4 mm -48.96 -43.87 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 CA-C-N 119.94 1.245 . . . . 0.70999999999999996 112.667 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.77 -19.51 43.55 Favored Glycine 0 CA--C 1.537 1.449 0 CA-C-N 119.468 1.031 . . . . 0.68000000000000005 114.07 177.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.11 -19.19 71.79 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 118.885 1.342 . . . . 0.64000000000000001 114.188 172.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -118.41 -43.1 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 CA-C-N 119.117 1.459 . . . . 0.96999999999999997 110.325 175.721 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 17.6 m -77.26 52.67 0.94 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.223 1.809 . . . . 1.4399999999999999 109.749 166.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.68 -64.39 0.03 OUTLIER Glycine 0 CA--C 1.528 0.862 0 C-N-CA 126.955 2.216 . . . . 1.1299999999999999 109.912 179.167 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -63.28 -59.15 0.24 Allowed 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.204 2.603 . . . . 1.23 112.624 173.554 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.1 pt -78.04 -17.55 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 114.028 1.121 . . . . 1.1799999999999999 114.028 -173.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.55 -37.46 75.74 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.308 -0.87 . . . . 1.01 112.505 -173.046 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt -60.91 -29.42 69.58 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 120.639 -1.288 . . . . 5.0999999999999996 113.238 176.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.8 tt -77.85 -23.05 49.04 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.444 1.498 . . . . 1.6000000000000001 112.963 178.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.3 mt -51.75 -48.64 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 118.955 0.798 . . . . 0.95999999999999996 110.466 168.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.41 -33.86 73.1 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 114.194 1.183 . . . . 3.9700000000000002 114.194 -179.549 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.83 -55.65 24.37 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.328 1.051 . . . . 5.6799999999999997 111.71 172.263 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -56.56 -46.05 80.95 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.865 0.866 . . . . 2.6400000000000001 113.299 -175.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -80.29 2.41 24.73 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.677 0.791 . . . . 2.9100000000000001 111.797 -175.037 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.473 0.715 0 C-N-CA 123.734 0.813 . . . . 1.95 111.041 162.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 112.695 0.628 . . . . 2.21 112.695 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 66.1 p -71.66 150.57 44.45 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.312 0.645 . . . . 1.21 110.006 164.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -53.47 -36.9 62.15 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.312 1.045 . . . . 2.3399999999999999 111.097 175.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.61 -42.88 93.64 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.719 1.608 . . . . 0.84999999999999998 111.726 178.573 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -51.47 24.93 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 121.401 -0.812 . . . . 3.3500000000000001 110.323 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -55.14 -30.36 59.64 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.423 1.089 . . . . 5.1100000000000003 112.125 172.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.787 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -72.65 -44.26 62.1 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.563 -1.335 . . . . 0.55000000000000004 113.221 170.812 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 54.0 t -59.18 -39.33 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 120.877 1.671 . . . . 0.62 109.834 172.366 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 63.1 mt -54.77 -57.79 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.853 -1.07 . . . . 0.84999999999999998 110.824 167.284 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 5.6 t -56.55 -39.35 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 CA-C-N 120.502 1.501 . . . . 0.65000000000000002 113.035 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.67 -40.42 84.46 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.359 -0.838 . . . . 1.03 111.953 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 68.7 t -72.74 -34.51 47.35 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.635 0 C-N-CA 123.51 0.724 . . . . 0.65000000000000002 110.987 177.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -65.22 -41.82 94.04 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.523 1.129 . . . . 3.0600000000000001 112.281 172.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 121' ' ' ASN . . . . . 0.421 HD21 ' CG ' ' B' ' 144' ' ' MET . 40.0 t30 -58.67 -24.03 60.48 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.961 -1.087 . . . . 2.1600000000000001 113.603 173.418 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -84.67 -61.12 1.87 Allowed 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.13 -0.981 . . . . 2.1499999999999999 112.674 172.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -68.1 -14.67 63.15 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.44 0.904 . . . . 2.0699999999999998 113.44 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mttp -32.61 -48.14 0.18 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 127.156 2.182 . . . . 2.23 113.349 164.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -97.64 6.78 47.53 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.371 1.468 . . . . 2.1899999999999999 113.235 -172.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 45.9 t . . . . . 0 N--CA 1.474 0.755 0 C-N-CA 124.238 1.015 . . . . 2.7999999999999998 109.982 -171.549 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 31.6 pt . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 109.375 -0.602 . . . . 2.4500000000000002 109.375 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 15.2 m -64.47 140.76 58.9 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.171 -0.956 . . . . 2.3999999999999999 112.212 178.179 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -60.71 -16.73 42.73 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.606 1.335 . . . . 2.6099999999999999 114.606 -169.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 14.3 p -56.76 -33.95 67.11 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.583 -1.323 . . . . 2.0299999999999998 112.48 168.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 63.9 m -57.93 -28.47 64.31 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.862 -1.149 . . . . 1.46 113.293 174.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.449 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 73.8 t80 -62.14 -63.15 1.34 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.295 1.407 . . . . 1.98 111.735 175.697 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -60.1 -20.8 60.02 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.585 0.754 . . . . 2.0299999999999998 112.02 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 143' ' ' GLU . . . . . 0.424 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 26.7 mt-10 -90.24 -50.26 6.08 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 117.8 -1.095 . . . . 3.6200000000000001 112.482 -175.193 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 144' ' ' MET . . . . . 0.421 ' CG ' HD21 ' B' ' 121' ' ' ASN . 0.0 OUTLIER -55.06 -32.07 61.63 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.092 0.86 . . . . 1.3700000000000001 111.54 164.248 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 10.0 mt -61.05 -52.26 65.69 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.247 -0.908 . . . . 1.0900000000000001 112.039 168.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.03 -18.95 60.78 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.643 1.11 . . . . 3.1200000000000001 113.242 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 147' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 2.0 mppt? -92.02 -48.66 6.63 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.972 1.309 . . . . 2.46 111.232 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -93.57 -28.39 16.07 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.518 1.508 . . . . 2.9900000000000002 114.901 -175.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 60.0 mt -104.79 25.07 10.85 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.66 1.184 . . . . 1.9399999999999999 112.201 172.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -54.51 -10.4 0.41 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.84 2.056 . . . . 1.46 116.319 -173.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.64 -64.39 1.15 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.99 -1.069 . . . . 2.0600000000000001 110.509 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.7 ptp -59.26 -33.17 70.72 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.063 0.847 . . . . 3.0 113.005 170.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 2.3 mp -86.79 67.78 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 123.445 1.593 . . . . 3.8900000000000001 110.212 170.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 3.3 m -74.06 -11.16 60.24 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 112.873 -1.967 . . . . 4.1399999999999997 114.978 -157.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -175.72 164.99 3.05 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.298 2.239 . . . . 5.4299999999999997 110.301 178.176 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 9.3 m -29.15 -48.99 0.07 Allowed 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 130.167 3.387 . . . . 3.2799999999999998 113.861 160.243 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -63.75 -32.96 85.92 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-N 119.857 1.208 . . . . 2.52 113.863 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -77.44 -49.16 15.39 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.757 1.223 . . . . 2.77 109.202 170.317 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 17.4 ttp180 -50.08 -29.36 8.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.078 1.751 . . . . 4.96 114.78 179.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 32.9 mtmt -49.83 -30.68 10.25 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.34 1.427 . . . . 4.5300000000000002 114.308 170.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.68 -20.86 52.97 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.363 1.246 . . . . 0.93999999999999995 114.363 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -77.49 -52.5 8.97 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.151 0.887 . . . . 0.71999999999999997 110.675 162.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -61.98 -34.26 75.81 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.387 0.675 . . . . 2.0099999999999998 112.759 -175.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.35 -30.27 64.69 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.396 -0.815 . . . . 2.71 112.958 174.564 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 38.4 mt -74.8 -34.25 62.36 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.649 -0.657 . . . . 0.79000000000000004 111.244 -178.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 28.7 mm -61.84 -48.73 87.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.247 1.019 . . . . 0.87 110.479 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -64.91 -40.93 95.83 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.773 1.229 . . . . 2.9399999999999999 112.32 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -61.0 -26.11 67.37 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.053 1.341 . . . . 2.5600000000000001 113.838 171.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -83.58 -80.13 0.19 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 117.368 -1.301 . . . . 2.5099999999999998 109.465 169.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -50.08 -33.08 17.33 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 120.513 1.506 . . . . 3.46 114.602 -160.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -53.51 -21.01 5.57 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 115.274 1.583 . . . . 3.52 115.274 173.106 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -128.83 9.71 5.89 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.033 1.733 . . . . 3.4500000000000002 113.494 168.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.8 6.3 0.91 Allowed 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 116.397 1.999 . . . . 4.2000000000000002 116.397 -159.731 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -50.96 144.42 8.72 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 122.226 1.012 . . . . 7.0800000000000001 112.7 172.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 71.56 -20.44 0.8 Allowed Glycine 0 CA--C 1.535 1.313 0 C-N-CA 126.211 1.862 . . . . 2.73 114.925 -173.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -99.79 135.11 41.7 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.418 1.487 . . . . 5.3099999999999996 110.422 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.3 mm -145.22 113.71 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 107.023 -1.473 . . . . 2.8399999999999999 107.023 177.135 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 2.4 t -87.19 -173.14 4.27 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.678 1.126 . . . . 1.51 113.14 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -92.89 -56.62 2.93 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.031 -1.668 . . . . 2.1200000000000001 110.769 172.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -61.33 -23.55 65.81 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 129.048 2.939 . . . . 3.02 113.138 176.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -47.62 -58.92 3.68 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.492 1.517 . . . . 3.1499999999999999 110.856 167.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -51.99 -45.52 64.53 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 120.931 -1.106 . . . . 2.29 112.372 177.101 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.3 t-105 -65.82 -47.37 75.25 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.65 -0.69 . . . . 0.58999999999999997 111.875 -178.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 8.2 t -72.7 -24.1 60.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 117.684 -1.15 . . . . 1.72 112.975 177.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.449 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 82.5 mt -65.82 -45.24 83.02 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.882 1.219 . . . . 0.68999999999999995 110.815 170.255 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 34.9 mm -48.03 -43.42 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 CA-C-N 120.734 1.606 . . . . 0.75 112.51 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -58.59 -19.57 42.55 Favored Glycine 0 CA--C 1.538 1.476 0 CA-C-N 118.57 0.623 . . . . 0.72999999999999998 114.497 177.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.74 -19.36 79.24 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 118.619 1.209 . . . . 0.77000000000000002 114.147 174.491 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -117.1 -47.79 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 118.829 1.314 . . . . 1.1699999999999999 110.108 177.168 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 20.7 m -74.23 50.68 0.4 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.679 1.991 . . . . 1.5 109.573 166.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -138.97 -64.48 0.04 OUTLIER Glycine 0 CA--C 1.527 0.815 0 C-N-CA 127.022 2.249 . . . . 1.03 109.481 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -62.0 -54.44 1.5 Allowed 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.198 2.599 . . . . 1.23 112.8 172.251 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 4.2 pt -84.78 -19.38 8.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 N-CA-C 114.672 1.36 . . . . 1.24 114.672 -175.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -53.33 -43.0 67.31 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.963 0.905 . . . . 1.1899999999999999 112.498 -174.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -54.45 -27.93 40.77 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.167 1.173 . . . . 4.75 114.167 175.589 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.22 -19.07 61.78 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.443 1.897 . . . . 1.5600000000000001 111.735 178.658 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 98.2 mt -57.68 -43.71 84.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 O-C-N 120.062 -1.649 . . . . 1.51 110.561 166.595 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -74.89 -0.39 18.38 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 115.145 1.535 . . . . 3.98 115.145 177.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -88.63 -66.09 0.95 Allowed 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.568 1.147 . . . . 4.9400000000000004 111.2 153.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -54.65 -44.94 73.69 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 114.301 1.223 . . . . 2.3799999999999999 114.301 -167.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -80.86 10.71 4.66 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 123.026 1.393 . . . . 2.73 111.006 -175.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -114.65 -54.07 2.6 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.432 1.493 . . . . 2.5099999999999998 109.885 166.214 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 . . . . . 0 CA--C 1.538 0.505 0 C-N-CA 127.153 2.181 . . . . 5.0800000000000001 113.887 178.427 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 114.517 1.303 . . . . 2.6699999999999999 114.517 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.5 p -66.4 147.84 52.72 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.187 0.595 . . . . 1.5600000000000001 109.915 164.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -67.12 -17.8 65.03 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 119.276 -0.392 . . . . 2.2799999999999998 111.712 170.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.6 -48.94 62.86 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.617 1.098 . . . . 0.90000000000000002 110.062 173.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -51.39 66.99 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.421 -0.585 . . . . 3.3700000000000001 109.421 175.514 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -53.89 -37.1 63.39 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.764 0.653 . . . . 4.1900000000000004 112.764 176.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.778 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -62.58 -37.95 88.21 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 117.609 -1.186 . . . . 0.83999999999999997 112.896 172.304 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 16.8 t -58.52 -44.93 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-N 120.914 1.688 . . . . 0.96999999999999997 110.516 168.279 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.8 mt -54.69 -46.93 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 CA-C-N 118.765 0.711 . . . . 0.93000000000000005 110.663 172.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.477 HG21 ' HG2' ' B' ' 110' ' ' GLU . 42.0 t -69.09 -40.49 80.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 124.057 0.943 . . . . 0.66000000000000003 112.994 -176.384 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -62.74 -39.85 95.41 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.122 -0.986 . . . . 0.97999999999999998 111.051 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 84.1 t -74.76 -38.14 43.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.72 0.808 . . . . 0.64000000000000001 112.582 177.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -51.12 -52.16 46.43 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.015 0.926 . . . . 3.1699999999999999 109.848 168.009 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -60.38 -30.66 69.72 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.486 1.291 . . . . 2.0600000000000001 114.486 -175.47 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -80.81 -54.16 5.85 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.225 -0.922 . . . . 1.9199999999999999 111.812 175.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -69.63 -23.44 63.5 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.734 1.013 . . . . 2.1899999999999999 113.734 -174.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 42.2 pttt -60.74 -9.25 3.73 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 115.712 1.745 . . . . 2.3100000000000001 115.712 175.186 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -107.03 2.28 24.94 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.877 1.271 . . . . 2.3999999999999999 114.264 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.485 1.289 0 CA-C-N 120.111 1.323 . . . . 2.5600000000000001 110.987 179.561 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.2 pt . . . . . 0 N--CA 1.477 0.875 0 N-CA-C 110.28 -0.267 . . . . 2.79 110.28 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.0 m -92.97 152.15 19.5 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.624 -0.672 . . . . 2.9700000000000002 110.457 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.1 mtpt -52.48 -33.18 43.57 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.324 1.45 . . . . 2.5600000000000001 114.768 -176.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.3 t -69.59 -23.35 63.52 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.545 1.313 . . . . 2.2400000000000002 114.545 172.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.1 m -77.19 -44.48 29.99 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.85 1.205 . . . . 1.3200000000000001 111.385 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -51.49 -54.2 29.63 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.416 1.007 . . . . 1.9299999999999999 111.85 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -57.88 -27.03 62.9 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.91 1.078 . . . . 2.8700000000000001 113.91 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -94.98 -48.8 5.83 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.63 1.572 . . . . 2.8700000000000001 110.74 -171.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -49.5 -40.12 36.47 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.713 2.405 . . . . 1.3700000000000001 112.24 165.057 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 42' ' ' LEU . 7.1 mt -60.25 -20.27 58.22 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.948 1.462 . . . . 1.1100000000000001 114.948 176.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -92.82 -14.33 27.93 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.592 1.157 . . . . 2.2000000000000002 112.428 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.36 -53.54 3.89 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.553 1.141 . . . . 1.51 112.599 172.666 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -78.34 -16.7 57.43 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.55 -0.719 . . . . 2.4500000000000002 112.287 -174.191 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.51 24.88 9.66 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.427 1.891 . . . . 1.7 111.576 179.12 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -61.94 -39.09 90.87 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.405 2.002 . . . . 1.6200000000000001 116.405 -162.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.516 ' H ' ' CD2' ' A' ' 48' ' ' HIS . 0.5 OUTLIER -69.58 -19.8 63.66 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.975 1.262 . . . . 1.75 113.228 -174.036 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 52.0 tpp -77.64 -26.55 50.57 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.233 1.813 . . . . 2.0899999999999999 113.016 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.0 mp -56.75 111.57 1.05 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.069 0.948 . . . . 2.9100000000000001 110.399 174.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.2 m -100.73 -3.89 29.24 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.364 1.066 . . . . 3.6299999999999999 111.769 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -178.75 175.46 1.06 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 131.366 3.866 . . . . 3.8100000000000001 106.768 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -53.99 -26.08 24.21 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 117.021 -1.466 . . . . 3.6000000000000001 111.78 160.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -51.53 -39.96 46.23 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 127.344 2.402 . . . . 1.96 115.0 -174.573 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -57.07 -47.63 80.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 117.951 0.875 . . . . 3.7200000000000002 110.78 170.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -70.98 -32.24 69.03 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.392 0.677 . . . . 5.3700000000000001 112.207 175.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -58.84 -38.01 77.73 Favored 'General case' 0 N--CA 1.481 1.078 0 O-C-N 119.516 -1.99 . . . . 3.4300000000000002 111.334 173.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.77 -14.22 62.36 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.059 1.503 . . . . 1.23 115.059 172.583 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.64 -53.83 5.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.389 0.995 . . . . 0.93999999999999995 110.82 164.043 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.47 -34.98 69.58 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.965 0.906 . . . . 2.0600000000000001 112.866 -177.142 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -61.34 -24.31 66.36 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.682 0.993 . . . . 2.71 113.682 174.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.5 mt -78.63 -37.5 42.03 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.257 -0.902 . . . . 0.84999999999999998 111.135 174.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.4 mm -58.19 -44.6 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.196 0.998 . . . . 0.87 111.558 -176.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -67.22 -38.8 85.87 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.234 1.813 . . . . 2.27 113.173 176.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -62.56 -27.65 69.33 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.916 -0.49 . . . . 3.4199999999999999 111.972 172.141 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.4 mp -86.82 -19.89 28.33 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 113.565 0.95 . . . . 3.4300000000000002 113.565 174.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.49 -25.21 67.89 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 120.419 1.463 . . . . 3.6200000000000001 111.507 168.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.2 -10.79 59.79 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.474 1.287 . . . . 2.6400000000000001 114.474 170.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -136.79 -14.08 1.65 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.805 1.78 . . . . 2.71 115.805 -171.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -155.45 119.02 4.45 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 121.195 1.816 . . . . 3.3399999999999999 114.036 -159.158 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.9 40.28 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 130.375 3.47 . . . . 4.4400000000000004 116.563 -170.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.18 13.4 76.51 Favored Glycine 0 CA--C 1.537 1.415 0 O-C-N 119.502 -1.999 . . . . 4.9100000000000001 114.283 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -86.38 -171.51 3.59 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.212 1.405 . . . . 7.1299999999999999 108.303 155.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 41.9 pt -147.94 161.6 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.966 1.706 . . . . 4.6900000000000004 107.911 150.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.8 m -74.08 169.1 18.2 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 112.745 0.646 . . . . 2.3199999999999998 112.745 164.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -63.1 -52.91 60.79 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.07 -1.019 . . . . 1.97 111.069 169.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.6 -33.76 60.92 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 128.142 2.577 . . . . 3.0800000000000001 113.224 172.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.83 -38.99 76.7 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 118.44 -0.791 . . . . 4.1500000000000004 112.622 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -53.09 -47.31 68.67 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.655 1.571 . . . . 1.8 110.393 172.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 28.5 t-105 -64.55 -45.86 85.29 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 118.455 -0.783 . . . . 0.59999999999999998 111.987 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.13 -40.64 98.19 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.549 1.068 . . . . 1.6100000000000001 112.039 -177.614 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 91.1 mt -63.88 -34.11 77.2 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.839 -0.6 . . . . 0.62 112.1 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.45 -36.21 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 119.896 1.225 . . . . 0.64000000000000001 111.6 179.008 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.48 -18.02 67.25 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.929 1.252 . . . . 0.66000000000000003 114.41 178.158 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.47 -29.58 59.66 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-N 119.007 1.404 . . . . 0.84999999999999998 112.737 176.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.441 HD12 ' H ' ' A' ' 86' ' ' ILE . 2.8 mp -86.95 -45.14 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.264 1.026 . . . . 0.92000000000000004 109.537 168.228 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.4 m -82.55 57.28 3.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 127.546 2.338 . . . . 1.26 109.989 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -132.74 -67.56 0.08 OUTLIER Glycine 0 CA--C 1.527 0.793 0 C-N-CA 125.825 1.678 . . . . 0.73999999999999999 110.093 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -66.02 -51.77 1.11 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.269 2.646 . . . . 1.03 112.576 175.12 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.6 pt -71.84 -17.83 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 N-CA-C 113.95 1.093 . . . . 1.0900000000000001 113.95 -175.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -50.36 -55.73 14.38 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.763 0.825 . . . . 0.95999999999999996 111.994 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -61.84 -32.69 73.04 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 120.569 -1.332 . . . . 3.1600000000000001 113.168 176.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.0 tt -60.39 -40.79 92.17 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 121.146 1.794 . . . . 1.5600000000000001 111.024 178.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 74.7 mt -53.84 -54.46 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-O 122.156 0.979 . . . . 1.22 110.429 172.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -67.76 -28.38 67.57 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.228 -0.92 . . . . 1.72 113.279 -177.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -73.88 -29.2 61.96 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.597 1.159 . . . . 3.6200000000000001 111.356 173.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -74.16 -42.5 59.81 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.288 1.035 . . . . 2.1299999999999999 111.538 174.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -73.47 17.28 0.15 Allowed 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 123.736 1.731 . . . . 2.96 112.211 172.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 . . . . . 0 CA--C 1.536 0.423 0 C-N-CA 125.522 1.529 . . . . 2.3900000000000001 110.398 161.266 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 118.983 -0.532 . . . . 2.8700000000000001 112.36 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 8.3 p -62.68 152.3 35.84 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.223 -0.658 . . . . 1.22 109.223 173.056 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 110' ' ' GLU . . . . . 0.477 ' HG2' HG21 ' A' ' 14' ' ' VAL . 10.4 tp10 -63.85 -27.54 69.24 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 118.415 -0.802 . . . . 2.52 111.489 170.189 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.56 -46.46 85.8 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.759 1.618 . . . . 0.89000000000000001 109.83 176.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -50.15 32.2 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.597 -0.69 . . . . 2.9300000000000002 111.142 -177.21 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -48.74 -38.66 22.27 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.804 1.241 . . . . 4.9000000000000004 113.255 167.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.778 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -64.98 -42.9 94.14 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 120.783 -1.198 . . . . 0.76000000000000001 113.233 171.126 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 14.0 t -55.74 -42.58 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 CA-C-N 120.917 1.689 . . . . 1.1100000000000001 110.666 170.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 59.9 mt -56.4 -51.22 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 118.638 -0.696 . . . . 1.0800000000000001 110.189 172.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 36.1 t -65.79 -36.6 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.346 0.975 . . . . 0.55000000000000004 113.342 -176.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -64.26 -37.97 89.37 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.997 -1.064 . . . . 0.94999999999999996 111.44 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 89.3 t -83.21 -35.32 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 118.619 -0.705 . . . . 0.91000000000000003 112.396 -178.401 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -51.16 -54.98 20.33 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.511 1.125 . . . . 3.3300000000000001 109.634 165.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -57.78 -37.56 73.92 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 113.207 0.817 . . . . 2.0099999999999998 113.207 -176.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -76.59 -55.87 5.13 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 122.02 -0.425 . . . . 2.25 110.785 -177.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -68.15 -24.05 64.94 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.675 0.991 . . . . 2.23 113.675 -175.296 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -56.81 -16.21 6.17 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 120.979 1.718 . . . . 2.1200000000000001 115.137 176.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -90.69 -0.7 57.78 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.824 1.787 . . . . 2.1299999999999999 115.824 173.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.6 m . . . . . 0 N--CA 1.479 1.003 0 C-N-CA 125.075 1.35 . . . . 2.6200000000000001 109.787 176.988 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 28.5 pt . . . . . 0 N--CA 1.479 0.991 0 CA-C-O 120.572 0.225 . . . . 2.3100000000000001 111.092 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 20.6 m -91.26 155.14 18.77 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 120.396 -1.44 . . . . 2.6200000000000001 110.737 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -55.48 -30.75 61.16 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.016 0.926 . . . . 2.6400000000000001 113.118 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 39.3 t -69.18 -20.4 64.0 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 115.31 1.596 . . . . 2.3900000000000001 115.31 170.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 16.4 m -74.49 -41.46 60.67 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 120.638 1.563 . . . . 1.4199999999999999 111.444 176.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.463 ' CZ ' HD11 ' B' ' 145' ' ' LEU . 35.9 t80 -56.35 -53.46 57.08 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 118.906 0.776 . . . . 2.04 111.29 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.4 ptt180 -57.12 -23.62 48.41 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.109 0.964 . . . . 2.5800000000000001 113.092 178.193 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 tm-20 -99.48 -45.11 5.93 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.024 1.33 . . . . 2.9300000000000002 112.131 -173.408 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 11.9 tmm? -51.62 -36.44 45.83 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.062 1.745 . . . . 1.2 112.175 167.199 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 145' ' ' LEU . . . . . 0.463 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 12.4 mt -65.94 -12.4 54.5 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 115.917 1.821 . . . . 1.0600000000000001 115.917 172.899 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -86.26 -25.14 25.7 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 123.826 0.85 . . . . 2.2799999999999998 112.592 169.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.02 -61.39 1.41 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.761 1.624 . . . . 1.6200000000000001 112.45 -175.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -70.51 -16.12 62.86 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.604 0.761 . . . . 2.6400000000000001 111.658 -175.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.83 17.12 11.85 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.683 1.993 . . . . 1.73 113.472 177.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -49.49 -37.73 27.49 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.468 1.655 . . . . 1.78 115.468 -171.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 151' ' ' HIS . . . . . 0.439 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 12.3 m-70 -63.45 -28.46 69.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.882 1.273 . . . . 1.9399999999999999 113.917 -175.548 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 60.1 tpp -81.79 -22.88 36.89 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.177 1.391 . . . . 2.0499999999999998 113.421 -172.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 11.2 mp -58.13 116.32 3.47 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.251 1.42 . . . . 3.0099999999999998 111.024 176.476 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 45.9 m -97.46 -4.85 37.32 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.836 0.854 . . . . 3.7999999999999998 112.616 172.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 12.4 t70 175.71 179.23 0.16 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 129.939 3.295 . . . . 3.9500000000000002 106.694 -168.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 12.4 t -55.49 -26.23 41.5 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 116.931 -1.509 . . . . 3.5600000000000001 112.077 160.027 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -51.32 -46.1 52.23 Favored Glycine 0 N--CA 1.471 1.023 0 C-N-CA 126.468 1.985 . . . . 2.0 115.46 -171.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -53.81 -45.05 70.68 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.244 1.022 . . . . 3.6899999999999999 111.173 171.169 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.7 ttt-85 -74.13 -33.78 63.67 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.516 0.726 . . . . 5.0800000000000001 111.99 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 60.0 mmtt -56.62 -38.18 71.72 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 120.82 1.645 . . . . 3.3399999999999999 111.448 172.532 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -65.49 -14.46 61.06 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 115.089 1.515 . . . . 1.29 115.089 173.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -85.67 -50.62 7.05 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.565 1.075 . . . . 1.0 111.886 165.188 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.61 -37.63 76.29 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.957 0.903 . . . . 2.1400000000000001 112.458 -178.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -60.42 -25.29 65.85 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.506 0.928 . . . . 2.7000000000000002 113.506 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 15.6 mt -76.21 -37.7 57.41 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.13 -0.981 . . . . 0.80000000000000004 111.123 176.45 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 28.1 mm -57.13 -43.73 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.076 0.95 . . . . 0.85999999999999999 111.337 -175.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -69.32 -41.11 77.15 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.505 1.922 . . . . 2.4199999999999999 113.054 175.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -59.53 -27.18 65.97 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.862 -0.524 . . . . 3.5299999999999998 112.138 170.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 6.2 mp -86.57 -19.62 29.15 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 114.227 1.195 . . . . 3.29 114.227 174.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -22.71 67.04 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 120.296 1.407 . . . . 3.77 112.026 167.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -74.59 -9.56 58.69 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.309 1.225 . . . . 3.0099999999999998 114.309 168.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -138.0 -14.95 1.35 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 116.455 2.02 . . . . 2.77 116.455 -170.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -154.7 122.06 5.68 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 121.079 1.763 . . . . 3.1400000000000001 114.187 -159.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -71.75 41.81 0.08 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 128.936 2.894 . . . . 4.4299999999999997 116.034 -171.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 76.32 0.36 66.26 Favored Glycine 0 CA--C 1.534 1.269 0 O-C-N 119.996 -1.69 . . . . 5.0999999999999996 114.195 177.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -78.94 -175.47 4.53 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.309 1.444 . . . . 7.1200000000000001 108.826 160.299 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 16.6 pt -147.51 155.74 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 128.098 2.559 . . . . 4.4199999999999999 106.871 158.222 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 4.2 m -77.65 -177.53 4.86 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.464 0.706 . . . . 2.3100000000000001 112.687 165.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -69.51 -54.27 15.0 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 122.281 1.038 . . . . 2.1200000000000001 110.462 169.293 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.68 -37.35 18.3 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 128.99 2.916 . . . . 3.1400000000000001 113.7 172.019 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -66.96 -42.97 84.27 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.14 0.976 . . . . 4.7000000000000002 112.886 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -53.8 -47.4 70.86 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.362 -1.462 . . . . 1.8799999999999999 111.176 173.267 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 28.7 t-105 -63.41 -45.07 92.69 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 118.621 -0.704 . . . . 0.70999999999999996 111.484 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.91 -41.71 97.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.734 0.814 . . . . 1.52 111.569 -179.583 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.424 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 87.0 mt -64.82 -33.44 76.01 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.399 -0.81 . . . . 0.63 112.446 179.338 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 36.8 mm -56.98 -34.66 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 CA-C-N 120.698 1.59 . . . . 0.59999999999999998 111.823 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.66 -20.19 69.89 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 124.292 0.949 . . . . 0.66000000000000003 114.079 176.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.78 -27.6 68.74 Favored Glycine 0 CA--C 1.529 0.916 0 CA-C-N 118.282 1.041 . . . . 0.72999999999999998 113.218 177.256 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -89.82 -42.75 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.446 1.099 . . . . 0.95999999999999996 110.127 167.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 6.2 m -83.14 57.34 3.89 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.935 2.094 . . . . 1.3100000000000001 110.5 -177.31 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -126.17 -71.64 0.19 Allowed Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.831 1.682 . . . . 0.71999999999999997 110.57 177.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.5 -44.19 1.15 Allowed 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 123.017 2.478 . . . . 1.0600000000000001 112.71 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 12.9 pt -72.0 -22.35 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 119.091 0.859 . . . . 1.1000000000000001 113.128 -173.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -45.41 -62.65 1.19 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.374 1.47 . . . . 1.0900000000000001 112.988 177.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -64.37 -26.82 68.64 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 120.539 -1.351 . . . . 3.6299999999999999 113.36 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.47 -41.78 97.76 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.796 1.634 . . . . 1.6599999999999999 110.621 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 53.4 mt -53.69 -56.06 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-O 121.867 0.842 . . . . 1.3999999999999999 110.682 170.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 43.4 t60 -63.19 -28.95 70.4 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.09 1.144 . . . . 1.8200000000000001 114.09 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -74.43 -28.24 60.97 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.796 1.238 . . . . 3.71 111.657 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -74.72 -40.56 61.24 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.501 1.12 . . . . 2.25 111.164 171.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -73.2 19.59 0.09 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 126.662 1.985 . . . . 2.8799999999999999 112.293 170.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -127.97 -61.68 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 125.238 1.415 . . . . 2.6099999999999999 109.652 159.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.307 12.2 pt20 . . . . . 0 N--CA 1.475 0.793 0 C-N-CA 130.127 3.371 . . . . 4.9500000000000002 115.366 -171.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 118.918 -0.563 . . . . 2.8500000000000001 110.476 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 60.1 p -65.7 148.87 51.05 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 120.142 1.337 . . . . 1.1699999999999999 110.138 168.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -63.71 -36.65 84.56 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.743 -0.598 . . . . 2.0899999999999999 111.644 -175.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.72 -48.39 80.95 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.273 1.429 . . . . 1.3200000000000001 110.031 174.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -72.82 -43.52 62.58 Favored 'General case' 0 C--O 1.23 0.072 0 CA-C-N 118.142 0.428 . . . . 3.6699999999999999 111.442 -173.422 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -48.51 -42.86 34.34 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.921 1.288 . . . . 5.4100000000000001 111.432 163.488 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.416 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -71.96 -30.22 65.07 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 116.762 -1.59 . . . . 0.76000000000000001 114.511 175.247 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.7 t -55.59 -33.81 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 CA-C-N 122.447 2.385 . . . . 0.94999999999999996 111.095 167.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 16.8 mt -56.89 -63.34 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 CA-C-N 119.588 1.085 . . . . 1.3799999999999999 111.401 162.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.7 t -50.1 -43.31 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.095 1.358 . . . . 0.57999999999999996 113.279 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.4 mp -66.44 -39.93 89.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.541 1.136 . . . . 1.05 112.245 176.08 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.3 t -68.61 -45.98 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.906 0.883 . . . . 0.66000000000000003 110.258 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.3 tt0 -55.88 -44.86 78.54 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.364 0.529 . . . . 3.1200000000000001 111.027 171.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -69.1 -17.42 63.85 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 115.23 1.567 . . . . 2.3999999999999999 115.23 -170.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -80.74 -61.48 1.96 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.208 0.603 . . . . 1.96 111.368 161.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -68.12 -22.9 64.86 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.376 0.88 . . . . 1.9199999999999999 113.376 -164.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -49.1 -24.2 1.53 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 125.018 1.327 . . . . 2.75 113.084 170.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -94.43 -2.76 51.36 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.512 1.525 . . . . 2.1600000000000001 114.998 178.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.479 0.997 0 C-N-CA 125.593 1.557 . . . . 2.25 112.8 -178.368 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.9 pt . . . . . 0 CA--C 1.536 0.426 0 N-CA-C 107.42 -1.326 . . . . 3.1299999999999999 107.42 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.2 m -99.8 168.9 9.6 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 121.69 -0.631 . . . . 2.8199999999999998 111.302 172.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.02 -35.48 15.54 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.835 2.054 . . . . 2.4700000000000002 112.525 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.6 p -55.44 -19.62 9.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.889 2.076 . . . . 1.97 114.843 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m -79.17 -46.44 17.93 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.398 0.999 . . . . 1.54 111.253 175.147 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -51.47 -51.87 51.36 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.556 1.142 . . . . 1.79 111.768 -177.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -52.67 -26.78 14.77 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.177 1.177 . . . . 3.7400000000000002 114.177 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -108.04 -40.08 5.32 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.457 1.103 . . . . 3.7599999999999998 112.792 -172.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -46.32 -46.17 17.97 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.122 0.969 . . . . 1.3200000000000001 110.577 162.48 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.3 mt -45.85 -67.1 0.31 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.453 1.501 . . . . 1.6000000000000001 111.703 165.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -67.27 -12.04 59.06 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 115.544 1.683 . . . . 2.1400000000000001 115.544 -172.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.81 -43.44 10.64 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.505 0.928 . . . . 1.75 113.505 169.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -104.14 -31.06 9.83 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.761 1.225 . . . . 2.7000000000000002 113.375 -166.048 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.3 mt -109.34 62.64 0.6 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 127.819 2.448 . . . . 2.6000000000000001 109.838 164.015 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -94.65 -12.26 27.7 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 115.147 1.536 . . . . 1.3100000000000001 115.147 -177.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 -91.14 -36.76 13.79 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 120.425 -1.422 . . . . 1.6499999999999999 113.014 -173.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.2 mmm -81.31 5.14 18.2 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.302 1.441 . . . . 2.3399999999999999 111.25 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.4 tp -66.88 83.49 0.11 Allowed 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 127.566 2.346 . . . . 3.2000000000000002 110.952 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.6 t -69.38 59.94 0.13 Allowed 'General case' 0 CA--C 1.549 0.94 0 O-C-N 121.281 -0.887 . . . . 5.0599999999999996 111.529 165.654 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.0 t70 51.09 -132.25 1.94 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 129.639 3.176 . . . . 3.9700000000000002 112.879 171.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.1 m -71.42 -36.85 71.44 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 126.665 1.986 . . . . 4.0 109.951 -172.3 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.18 -51.35 59.37 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-N 119.518 1.054 . . . . 2.4700000000000002 111.63 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -60.15 -52.31 65.86 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.28 1.032 . . . . 3.73 112.53 174.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.5 ttt-85 -76.65 -31.66 57.48 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.628 -0.67 . . . . 4.6900000000000004 112.608 -170.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -68.2 -32.6 72.94 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 120.112 -1.617 . . . . 3.6099999999999999 112.33 167.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.68 -19.83 59.46 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.392 1.256 . . . . 1.01 114.392 169.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.85 -56.51 4.53 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 119.994 1.27 . . . . 0.64000000000000001 111.869 162.114 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.96 -31.44 72.55 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.172 1.175 . . . . 2.0899999999999999 114.172 -173.849 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -57.36 -28.4 63.14 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.35 -0.843 . . . . 2.6800000000000002 113.173 173.115 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.8 mt -75.37 -43.72 48.89 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.039 0.935 . . . . 1.0600000000000001 110.802 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.0 mm -56.9 -53.65 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.066 1.746 . . . . 1.0900000000000001 110.728 -175.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -58.92 -29.68 67.26 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.997 1.319 . . . . 1.97 113.624 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.5 -24.72 42.1 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.484 1.914 . . . . 2.46 113.524 176.572 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 mt -124.05 -20.56 5.3 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.672 2.101 . . . . 2.9900000000000002 116.672 -168.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -61.89 -25.33 67.49 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.627 1.103 . . . . 3.2999999999999998 110.734 154.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -79.47 -21.29 45.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.53 1.532 . . . . 2.8700000000000001 114.836 171.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -128.58 17.04 6.43 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 119.939 1.245 . . . . 3.77 114.031 -174.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -153.78 126.99 8.46 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 120.556 -1.34 . . . . 3.8500000000000001 111.736 173.106 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.07 59.26 3.22 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.284 2.234 . . . . 5.2999999999999998 114.226 -148.617 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.65 4.59 26.32 Favored Glycine 0 CA--C 1.534 1.277 0 O-C-N 120.727 -1.233 . . . . 3.02 112.566 -165.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 75.2 mmt-85 -75.29 151.55 38.32 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 127.006 2.122 . . . . 4.9500000000000002 111.413 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.6 mm -140.06 113.52 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 105.134 -2.173 . . . . 2.9100000000000001 105.134 166.217 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.2 m -79.72 173.68 12.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 118.967 0.803 . . . . 1.97 112.153 168.669 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -55.03 -50.12 69.86 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.828 0.823 . . . . 2.0299999999999998 111.403 156.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.76 -26.58 67.79 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.492 1.917 . . . . 3.3199999999999998 113.994 -174.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -58.94 -55.24 37.68 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.938 1.295 . . . . 3.4900000000000002 110.952 173.089 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -54.85 -48.36 73.0 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 120.726 -1.234 . . . . 2.3300000000000001 111.668 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 24.6 t-105 -63.02 -44.03 97.08 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.163 0.801 . . . . 0.57999999999999996 113.163 -177.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.9 t -67.58 -42.68 82.13 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.288 0.949 . . . . 1.8200000000000001 110.997 178.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.1 -39.12 93.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 117.975 -1.012 . . . . 0.70999999999999996 112.337 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 28.7 mm -52.47 -40.58 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 CA-C-N 120.62 1.555 . . . . 0.69999999999999996 111.5 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -68.19 -22.07 74.22 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.843 0.735 . . . . 0.70999999999999996 113.922 -178.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.38 -30.15 76.1 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-N 118.343 1.072 . . . . 0.68000000000000005 112.368 174.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -89.03 -47.73 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.069 0.947 . . . . 0.87 109.514 167.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.2 m -83.62 59.35 5.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.327 2.251 . . . . 1.51 110.948 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -151.06 -57.35 0.01 OUTLIER Glycine 0 CA--C 1.529 0.95 0 C-N-CA 126.642 2.068 . . . . 0.93999999999999995 110.974 -178.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.02 -60.46 0.44 Allowed 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.445 2.097 . . . . 1.1299999999999999 111.569 167.047 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.2 pt -64.24 -18.32 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 115.425 1.639 . . . . 1.24 115.425 -175.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.32 -45.52 69.06 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.282 1.433 . . . . 1.1000000000000001 113.026 -175.436 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -60.75 -36.76 79.72 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.618 0.767 . . . . 5.2300000000000004 112.786 178.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.3 tt -75.15 -44.59 46.03 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.702 1.601 . . . . 1.0900000000000001 109.875 -176.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 42.2 mt -52.51 -60.58 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.495 0.718 . . . . 1.1100000000000001 109.491 168.17 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -55.52 -40.54 71.94 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 118.42 -0.8 . . . . 2.1400000000000001 112.99 -176.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -69.66 -36.7 76.27 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 119.672 -0.811 . . . . 3.3100000000000001 111.638 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -70.82 -34.29 71.57 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 117.708 -1.139 . . . . 3.8799999999999999 113.879 -174.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -63.33 -12.24 28.32 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.443 1.02 . . . . 2.8100000000000001 112.396 172.216 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.052 0 C-N-CA 125.613 1.565 . . . . 2.6400000000000001 112.907 179.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 109.966 -0.383 . . . . 2.98 109.966 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 10.4 p -59.78 147.94 36.21 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 120.707 0.289 . . . . 0.90000000000000002 110.642 -165.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.4 tp10 -63.96 -32.52 74.09 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 121.925 -0.484 . . . . 2.2999999999999998 111.942 -174.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.9 -47.68 76.92 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.427 1.091 . . . . 0.91000000000000003 110.164 171.245 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.04 -44.98 52.44 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 119.544 1.065 . . . . 3.46 112.748 -172.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 44.6 tttm -42.72 -47.21 5.35 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.368 1.467 . . . . 5.04 112.43 157.748 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.416 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -70.27 -31.96 69.56 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 117.165 -1.398 . . . . 0.58999999999999997 114.284 176.186 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 32.8 t -59.72 -33.58 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 121.253 1.842 . . . . 1.02 110.747 171.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 11.8 mt -55.9 -63.59 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 CA-C-N 119.377 0.99 . . . . 1.46 110.58 164.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 83.4 t -55.35 -40.47 57.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.398 1.479 . . . . 0.56999999999999995 112.936 -173.591 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -62.57 -35.01 78.11 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.118 0.967 . . . . 1.1000000000000001 112.319 175.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 70.5 t -80.86 -41.54 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.538 1.135 . . . . 0.57999999999999996 110.735 -177.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 64.7 tt0 -56.96 -45.67 82.71 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.363 0.529 . . . . 3.0600000000000001 111.087 171.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -59.25 -27.94 66.26 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 114.51 1.3 . . . . 2.0099999999999998 114.51 -177.036 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -79.46 -60.35 2.4 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.236 0.926 . . . . 1.9199999999999999 111.296 173.617 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -65.73 -24.14 66.9 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.1 0.778 . . . . 1.96 113.1 -169.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -51.55 -23.51 4.24 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.547 1.314 . . . . 2.8900000000000001 114.547 175.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -89.55 -11.09 43.79 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 115.045 1.498 . . . . 2.3500000000000001 115.045 175.18 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 CA--C 1.546 0.819 0 C-N-CA 126.267 1.827 . . . . 2.1699999999999999 111.864 -169.571 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 8.8 pt . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 108.368 -0.975 . . . . 3.2200000000000002 108.368 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 75.7 m -100.06 174.27 6.25 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.259 0.624 . . . . 3.1299999999999999 110.837 169.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 138' ' ' LYS . . . . . 0.404 ' HE2' ' HB2' ' B' ' 138' ' ' LYS . 3.0 mppt? -48.12 -30.74 4.81 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 113.767 1.025 . . . . 1.99 113.767 177.192 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 14.1 p -50.46 -30.36 12.52 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.628 1.344 . . . . 2.1299999999999999 114.628 172.366 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 51.0 m -82.4 -32.42 29.14 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.41 1.004 . . . . 1.1699999999999999 112.754 174.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.424 ' CE1' HD11 ' B' ' 145' ' ' LEU . 29.0 t80 -60.95 -48.57 81.21 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 120.007 1.276 . . . . 1.9199999999999999 111.38 179.035 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -56.86 -28.63 61.99 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.114 0.783 . . . . 4.0700000000000003 113.114 174.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.36 -52.09 5.83 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 125.253 1.421 . . . . 2.6299999999999999 111.81 -173.563 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 7.0 tmm? -47.24 -41.02 17.77 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.792 1.237 . . . . 1.26 111.402 167.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 145' ' ' LEU . . . . . 0.424 HD11 ' CE1' ' B' ' 141' ' ' PHE . 30.7 mt -56.52 -70.86 0.1 Allowed 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 123.949 0.899 . . . . 1.46 111.502 167.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -72.37 -1.7 16.52 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.742 1.756 . . . . 2.9300000000000002 115.742 -171.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.25 -50.84 3.51 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.704 1.602 . . . . 1.6499999999999999 114.767 166.369 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -100.28 -26.18 14.0 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.102 1.319 . . . . 2.8700000000000001 113.468 -172.308 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 22.2 mt -101.89 65.12 0.98 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.633 1.173 . . . . 2.9199999999999999 110.3 160.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -96.96 -8.79 29.74 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.636 1.347 . . . . 1.28 114.636 -177.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 36.3 m-70 -93.89 -32.08 14.06 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.489 -1.382 . . . . 1.6399999999999999 113.458 -171.217 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.0 mmm -91.25 -2.39 57.46 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.817 2.047 . . . . 2.3700000000000001 111.365 173.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.4 tp -71.47 74.45 0.76 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.857 2.063 . . . . 2.3599999999999999 111.322 -173.36 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 33.8 t -68.64 72.98 0.24 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.302 1.841 . . . . 4.4100000000000001 112.635 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 21.8 t70 38.2 -133.43 0.13 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 130.146 3.378 . . . . 4.3300000000000001 113.258 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 81.8 m -69.76 -40.99 75.76 Favored 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 125.097 1.359 . . . . 4.3499999999999996 111.19 -165.25 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.37 -48.17 87.49 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 119.562 1.074 . . . . 2.5099999999999998 111.747 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -72.47 -41.73 65.72 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.108 0.781 . . . . 3.3799999999999999 113.108 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -67.12 -40.24 86.8 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 120.256 -1.527 . . . . 4.9299999999999997 112.124 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 27.5 mmmt -67.23 -31.36 71.67 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 120.617 -1.302 . . . . 3.8700000000000001 112.401 170.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.49 -19.81 65.81 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 114.651 1.352 . . . . 1.26 114.651 169.611 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.28 -57.7 3.64 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.808 1.185 . . . . 0.83999999999999997 111.632 162.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -65.73 -26.37 67.71 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.736 1.013 . . . . 2.25 113.736 -172.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -56.47 -34.07 66.55 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.014 -1.054 . . . . 2.7799999999999998 112.254 169.574 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 21.0 mt -75.7 -34.59 60.41 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.803 0.441 . . . . 0.76000000000000001 111.593 -177.25 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 38.7 mm -62.47 -55.23 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 124.746 1.218 . . . . 1.0800000000000001 109.744 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -60.73 -33.71 73.31 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.899 0.857 . . . . 1.95 112.88 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -64.48 -24.53 67.65 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.469 1.508 . . . . 2.5499999999999998 113.308 174.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.32 -23.48 4.14 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 115.526 1.676 . . . . 2.6499999999999999 115.526 -165.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -61.74 -13.61 24.78 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.065 -1.022 . . . . 3.2999999999999998 112.139 153.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.86 -12.53 59.41 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 115.435 1.643 . . . . 2.7000000000000002 115.435 163.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -134.48 -3.64 2.66 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.049 1.87 . . . . 3.1800000000000002 116.049 -169.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -149.8 90.36 1.69 Allowed 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 120.853 1.66 . . . . 3.7400000000000002 114.72 -170.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -81.07 116.42 21.0 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.094 1.757 . . . . 6.04 112.894 -178.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 67.02 8.59 50.27 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 115.989 1.156 . . . . 2.6299999999999999 115.989 165.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 36.2 mmt-85 -112.31 163.57 14.23 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.078 1.751 . . . . 5.2199999999999998 110.428 173.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.8 mm -149.82 129.78 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 126.375 1.87 . . . . 2.6200000000000001 106.469 161.416 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 11.3 m -93.25 171.75 8.73 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.216 1.006 . . . . 1.9299999999999999 111.065 171.19 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -71.37 -50.36 32.99 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 122.048 0.928 . . . . 2.25 111.956 173.03 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -70.79 -18.48 62.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.189 2.196 . . . . 3.04 113.621 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -54.38 -55.7 26.02 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.93 1.692 . . . . 3.4399999999999999 111.569 167.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -55.22 -44.8 75.76 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.662 -1.274 . . . . 2.4199999999999999 111.824 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 22.9 t-105 -62.93 -45.62 91.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.742 -0.647 . . . . 0.73999999999999999 112.419 -177.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 6.8 t -71.59 -40.09 70.12 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 118.668 -0.682 . . . . 1.72 111.827 178.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 85.9 mt -56.42 -49.31 74.9 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 117.888 -1.053 . . . . 0.56000000000000005 111.091 173.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 26.7 mm -50.13 -36.97 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-N 120.53 1.514 . . . . 0.65000000000000002 112.63 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.42 -26.87 66.92 Favored Glycine 0 CA--C 1.53 1.023 0 CA-C-O 119.121 -0.821 . . . . 0.58999999999999997 113.257 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -73.9 -31.5 60.0 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 118.313 1.056 . . . . 0.88 113.922 178.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 189' ' ' ILE . . . . . 0.463 HD12 ' H ' ' B' ' 189' ' ' ILE . 1.1 mp -85.99 -36.0 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 118.638 1.219 . . . . 0.83999999999999997 110.877 173.273 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 62.6 m -71.46 -54.63 9.99 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.17 1.388 . . . . 2.9199999999999999 111.475 -176.117 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -46.63 -41.85 13.44 Favored Glycine 0 CA--C 1.539 1.588 0 CA-C-O 117.264 -1.853 . . . . 0.94999999999999996 116.705 -175.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.92 -51.91 2.02 Favored 'Trans proline' 0 C--N 1.353 0.812 0 CA-C-N 122.173 2.986 . . . . 1.28 112.046 175.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 25.2 pt -81.11 -15.49 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 N-CA-C 114.722 1.379 . . . . 0.92000000000000004 114.722 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -49.8 -43.76 48.65 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.692 1.597 . . . . 0.96999999999999997 112.849 -178.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 2.6 ptpp? -59.7 -36.31 76.26 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.962 0.905 . . . . 5.3799999999999999 113.349 175.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 3.4 tt -77.89 -41.31 37.07 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.894 1.678 . . . . 1.46 110.091 -176.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 24.2 mt -56.22 -60.86 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.413 0.685 . . . . 1.1399999999999999 109.347 168.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -54.58 -39.36 67.72 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 113.256 0.836 . . . . 2.2200000000000002 113.256 -177.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -68.89 -38.02 79.39 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 119.745 -0.782 . . . . 3.29 111.627 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -70.14 -34.23 72.78 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 117.959 -1.019 . . . . 3.9399999999999999 113.281 -173.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -63.01 -9.7 11.1 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.407 1.003 . . . . 2.7599999999999998 112.942 171.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -114.15 -39.14 3.96 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.773 1.629 . . . . 2.6899999999999999 113.33 177.853 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 . . . . . 0 CA--C 1.541 0.617 0 C-N-CA 127.185 2.194 . . . . 7.7800000000000002 112.159 -172.885 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 . . . . . 0 CA--C 1.547 0.834 0 N-CA-C 112.322 0.489 . . . . 2.5800000000000001 112.322 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.1 p -62.67 144.95 55.76 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 108.006 -1.109 . . . . 1.0800000000000001 108.006 159.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.41 -43.54 98.57 Favored 'General case' 0 C--O 1.213 -0.834 0 CA-C-O 116.815 -1.564 . . . . 2.5499999999999998 110.071 176.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -46.89 -48.44 21.18 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 120.3 1.409 . . . . 0.93000000000000005 110.363 177.4 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -71.54 -51.21 24.75 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 118.045 -0.979 . . . . 2.9399999999999999 112.581 -175.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 34.5 tptt -61.84 -23.89 66.55 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 121.456 1.935 . . . . 6.0499999999999998 114.082 170.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.798 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -71.04 -38.79 72.55 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 125.338 1.455 . . . . 0.88 111.302 167.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.86 -41.09 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 121.04 1.745 . . . . 0.78000000000000003 110.07 169.256 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.517 HD13 HG23 ' B' ' 197' ' ' ILE . 16.6 mm -53.07 -50.56 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 119.567 1.076 . . . . 1.3600000000000001 111.063 167.239 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.7 t -62.43 -38.03 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.823 1.192 . . . . 0.76000000000000001 111.99 179.543 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp -70.52 -26.84 63.77 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 120.705 -1.247 . . . . 1.1499999999999999 112.584 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 97.3 t -81.41 -38.3 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 118.932 0.787 . . . . 0.76000000000000001 111.311 175.018 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -52.57 -48.66 66.05 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.984 0.914 . . . . 3.3599999999999999 110.512 165.506 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.504 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 3.3 t30 -63.98 -15.39 59.18 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.516 1.673 . . . . 2.48 115.516 -171.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -88.86 -60.56 1.92 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.846 0.858 . . . . 2.0099999999999998 111.886 166.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -68.23 -22.39 64.79 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.383 1.253 . . . . 1.8200000000000001 114.383 -169.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.504 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 9.1 ptmt -52.54 -19.89 2.58 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 115.707 1.743 . . . . 2.5299999999999998 115.707 -177.191 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -96.53 -1.43 47.17 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 115.36 1.615 . . . . 3.4300000000000002 115.36 174.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 19.9 m . . . . . 0 N--CA 1.485 1.292 0 CA-C-N 120.704 1.593 . . . . 2.9700000000000002 112.377 -172.562 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 37.7 pt . . . . . 0 N--CA 1.471 0.613 0 CA-C-O 121.268 0.556 . . . . 2.8599999999999999 111.331 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.0 m -71.05 145.87 49.66 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.646 -0.659 . . . . 2.6400000000000001 110.578 170.335 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -59.39 -25.9 64.67 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 119.765 -1.834 . . . . 1.96 113.12 172.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.1 p -72.71 -20.42 61.22 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 114.04 1.126 . . . . 1.6699999999999999 114.04 169.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 39.6 m -71.54 -21.03 61.95 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 120.748 -1.22 . . . . 1.0700000000000001 111.527 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 51.0 t80 -58.98 -59.24 5.78 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.548 1.067 . . . . 2.1899999999999999 111.206 172.845 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -61.84 -19.67 62.84 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.878 0.871 . . . . 2.5099999999999998 113.301 -176.252 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.41 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 9.6 tt0 -88.82 -49.88 6.56 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 127.175 2.19 . . . . 2.9399999999999999 110.685 179.497 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 7.1 tmm? -54.4 -40.13 67.93 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.642 1.577 . . . . 1.29 111.599 173.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.3 mt -49.77 -32.64 14.3 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.252 1.421 . . . . 1.3300000000000001 113.206 168.469 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.84 -5.61 50.61 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.103 1.32 . . . . 3.25 113.823 -178.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.41 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -97.23 -51.58 4.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.676 0.79 . . . . 1.46 111.186 168.074 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -96.06 -21.38 18.0 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.597 0.962 . . . . 2.8100000000000001 113.597 -167.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.01 34.61 4.84 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.427 1.891 . . . . 1.52 111.616 -176.547 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -80.42 -15.23 57.3 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 116.727 2.121 . . . . 1.53 116.727 -156.28 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 15.3 m-70 -79.73 -49.52 11.94 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 121.324 1.875 . . . . 1.6200000000000001 112.388 -167.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 76.4 mtm -72.13 -19.83 61.71 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.925 1.69 . . . . 1.98 112.861 170.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.7 tp -86.13 50.89 2.07 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.927 1.291 . . . . 3.7400000000000002 110.061 178.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 2.5 m -71.02 -9.03 57.33 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 115.801 1.778 . . . . 4.2199999999999998 115.801 -153.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.403 ' CG ' ' N ' ' A' ' 53' ' ' THR . 22.6 t70 -162.28 174.98 12.1 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.423 1.889 . . . . 5.4000000000000004 111.44 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.403 ' N ' ' CG ' ' A' ' 52' ' ' ASP . 9.5 m -48.66 -37.0 17.24 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 130.232 3.413 . . . . 3.5299999999999998 111.943 162.383 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.0 -45.82 91.97 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 119.235 0.925 . . . . 2.3999999999999999 112.217 172.543 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -69.47 -42.39 74.93 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.93 0.892 . . . . 4.4400000000000004 109.975 175.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.75 -30.45 22.7 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.801 1.64 . . . . 5.0199999999999996 114.114 172.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.5 mtmt -59.96 -22.23 62.23 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.28 1.4 . . . . 3.9500000000000002 113.293 174.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.48 -15.32 57.01 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 114.866 1.432 . . . . 1.45 114.866 169.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.74 -49.31 10.58 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.402 1.081 . . . . 0.80000000000000004 110.799 162.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -67.71 -29.46 68.72 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.735 1.214 . . . . 2.0600000000000001 114.105 -176.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.2 ptmt -50.34 -35.68 28.87 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 119.563 1.074 . . . . 4.0599999999999996 111.663 165.106 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.7 mt -78.23 -44.97 24.17 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 123.305 0.642 . . . . 1.04 111.15 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 23.0 mm -52.55 -49.53 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 123.734 0.646 . . . . 0.96999999999999997 110.468 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -65.43 -40.12 92.92 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.503 0.927 . . . . 1.8799999999999999 113.503 178.282 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -61.97 -29.66 70.4 Favored 'General case' 0 CA--C 1.554 1.123 0 N-CA-C 113.224 0.824 . . . . 3.3100000000000001 113.224 172.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.84 -26.15 21.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.745 1.218 . . . . 2.1899999999999999 112.158 179.209 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -64.16 -22.21 66.85 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.83 -1.168 . . . . 2.8599999999999999 113.772 165.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.43 -15.98 60.89 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 114.294 1.22 . . . . 2.27 114.294 164.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -126.56 -13.38 5.98 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 116.887 2.18 . . . . 2.6000000000000001 116.887 -166.038 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.14 125.31 27.66 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 121.963 2.165 . . . . 3.4500000000000002 111.873 174.802 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -80.1 58.52 3.0 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.933 2.093 . . . . 4.2300000000000004 111.955 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 76.12 2.5 72.6 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.594 1.093 . . . . 3.21 113.819 -174.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -77.22 163.0 26.93 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.407 1.104 . . . . 6.6900000000000004 110.855 177.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 36.0 mm -138.61 140.11 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.479 1.511 . . . . 2.46 108.084 171.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.9 t -95.24 -146.49 0.27 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 127.05 2.14 . . . . 2.6800000000000002 112.061 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -112.92 -59.67 1.99 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.03 1.732 . . . . 2.5499999999999998 109.904 152.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.53 -22.63 61.93 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.079 2.151 . . . . 3.5 112.943 -170.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -47.57 -59.62 3.13 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 127.335 2.254 . . . . 3.1299999999999999 111.09 167.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -54.17 -44.21 71.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.381 0.992 . . . . 2.4199999999999999 112.202 -179.161 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.8 t-105 -63.1 -48.07 80.12 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 118.881 -0.581 . . . . 0.79000000000000004 111.887 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.9 t -71.22 -26.45 62.93 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.931 0.787 . . . . 1.71 112.304 178.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 51.0 mt -66.15 -46.43 77.47 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.448 -1.263 . . . . 0.73999999999999999 111.338 170.339 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.7 mm -51.99 -41.4 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 CA-C-N 121.808 2.094 . . . . 0.82999999999999996 112.038 176.166 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.57 -21.96 71.17 Favored Glycine 0 CA--C 1.532 1.118 0 O-C-N 121.568 -0.708 . . . . 0.89000000000000001 113.565 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.29 -23.36 68.48 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 118.631 -1.094 . . . . 0.90000000000000002 114.279 -177.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.494 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.4 OUTLIER -92.04 -42.68 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 125.441 1.496 . . . . 0.95999999999999996 110.044 166.137 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.2 m -78.77 60.11 2.71 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.528 2.331 . . . . 1.3400000000000001 110.691 -177.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -130.33 -77.2 0.17 Allowed Glycine 0 CA--C 1.532 1.154 0 C-N-CA 126.206 1.86 . . . . 0.87 111.094 173.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -62.32 -38.0 57.23 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.146 2.564 . . . . 0.97999999999999998 112.735 -178.632 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.2 pp -77.82 -14.75 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 112.864 0.69 . . . . 1.1799999999999999 112.864 174.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.67 -33.02 41.56 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.798 -1.188 . . . . 1.0600000000000001 113.512 -174.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.82 -33.57 71.93 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 120.095 -1.628 . . . . 2.8199999999999998 111.657 163.348 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.04 -40.01 90.64 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 118.407 -0.806 . . . . 1.8500000000000001 111.687 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 92.3 mt -45.71 -62.68 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.617 0.767 . . . . 1.03 110.212 164.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -60.43 -42.81 96.86 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.088 -0.505 . . . . 1.79 111.875 -172.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.298 4.1 pt-20 -76.38 -19.97 57.63 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 112.818 0.673 . . . . 3.2799999999999998 112.818 -176.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -85.11 -37.24 20.49 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.984 1.714 . . . . 2.4900000000000002 115.297 173.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -73.07 -16.48 61.48 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.178 0.899 . . . . 2.48 110.992 176.467 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 . . . . . 0 N--CA 1.466 0.338 0 C-N-CA 125.047 1.339 . . . . 2.2999999999999998 111.085 170.12 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 C--O 1.242 0.71 0 N-CA-C 111.552 0.205 . . . . 2.2000000000000002 111.552 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 11.7 p -57.93 151.35 18.42 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.053 -0.721 . . . . 0.98999999999999999 109.053 166.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -68.55 -31.44 70.66 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 116.498 -1.715 . . . . 3.2000000000000002 111.614 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.98 -48.62 70.17 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 121.418 1.917 . . . . 0.93999999999999995 109.746 171.591 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -72.25 -51.35 21.35 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.442 -0.789 . . . . 2.8999999999999999 112.325 -174.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -62.29 -24.07 67.08 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 121.324 1.875 . . . . 7.0700000000000003 114.078 170.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.798 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.43 -43.24 73.78 Favored 'General case' 0 C--O 1.222 -0.376 0 O-C-N 120.233 -1.542 . . . . 0.64000000000000001 111.461 166.505 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.04 -43.17 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 121.512 1.96 . . . . 0.72999999999999998 110.69 169.04 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 22.3 mm -52.93 -55.57 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.045 0.838 . . . . 1.79 111.648 168.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 6.7 t -61.15 -38.71 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.61 1.164 . . . . 0.62 112.32 -177.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.8 mp -66.84 -32.59 73.96 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.237 -0.914 . . . . 1.26 111.848 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 79.4 t -80.01 -38.94 19.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.267 1.027 . . . . 0.68000000000000005 111.025 177.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -55.05 -46.82 75.38 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.279 1.031 . . . . 3.1800000000000002 110.5 168.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -59.44 -24.8 63.83 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 115.303 1.594 . . . . 2.3700000000000001 115.303 -173.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -87.96 -58.4 2.58 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.158 1.383 . . . . 2.2999999999999998 112.302 171.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -64.79 -26.69 68.46 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 112.582 0.586 . . . . 1.72 112.582 -172.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -53.43 -16.51 1.45 Allowed 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.017 1.488 . . . . 2.3399999999999999 115.017 174.275 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -90.24 -5.51 56.27 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 114.744 1.387 . . . . 2.54 114.744 173.214 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 22.4 m . . . . . 0 N--CA 1.484 1.261 0 CA-C-N 121.271 1.85 . . . . 2.7400000000000002 112.418 -171.788 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 31.3 pt . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 112.064 0.394 . . . . 2.1899999999999999 112.064 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 69.0 m -85.95 151.17 23.96 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.201 -0.937 . . . . 2.25 111.172 169.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 138' ' ' LYS . . . . . 0.47 ' HE3' ' HA ' ' B' ' 170' ' ' ASP . 0.0 OUTLIER -58.06 -28.99 65.03 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.238 -1.539 . . . . 2.8100000000000001 112.667 175.764 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 43.9 p -70.5 -24.51 62.86 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.616 -1.303 . . . . 1.6399999999999999 114.218 171.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 20.0 m -72.53 -26.3 61.7 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 120.794 -1.191 . . . . 1.2 112.195 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.425 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 69.6 t80 -60.97 -51.25 70.06 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.137 -0.977 . . . . 2.0099999999999998 112.103 173.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -67.08 -25.93 66.47 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.597 -0.689 . . . . 2.52 112.312 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.92 -52.52 28.49 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 124.314 1.046 . . . . 3.1899999999999999 110.714 170.369 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 2.2 ttm -55.39 -39.83 70.63 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.976 1.31 . . . . 1.5700000000000001 110.696 179.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.7 mt -56.53 -62.1 1.96 Allowed 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 125.825 1.65 . . . . 1.54 112.25 165.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -63.85 -16.76 62.13 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 120.349 1.431 . . . . 3.2999999999999998 114.779 -176.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.78 -56.8 3.31 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.331 0.969 . . . . 1.3799999999999999 112.019 170.661 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -93.88 -19.48 20.93 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 113.606 0.965 . . . . 2.8300000000000001 113.606 -165.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 3.9 mt -122.33 57.21 1.09 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 129.135 2.974 . . . . 1.5900000000000001 109.739 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -96.2 -16.82 21.23 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.724 1.75 . . . . 1.3799999999999999 115.724 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -82.72 -27.51 31.1 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 121.087 1.767 . . . . 1.8799999999999999 114.131 -172.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 65.3 mtm -89.26 6.1 41.85 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.413 1.885 . . . . 2.0499999999999998 113.207 174.067 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 2.3 tp -83.36 -167.37 1.67 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 128.148 2.579 . . . . 3.0600000000000001 111.49 173.251 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 15.5 m -174.6 -45.63 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 128.524 2.73 . . . . 3.9700000000000002 109.266 171.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -151.69 179.07 8.72 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-O 123.437 1.589 . . . . 4.96 112.192 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 12.5 m -35.38 -40.99 0.16 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 128.802 2.841 . . . . 3.0899999999999999 112.673 151.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.96 -47.76 47.43 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 124.923 1.249 . . . . 1.8799999999999999 113.351 176.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -64.15 -48.17 77.04 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.904 0.881 . . . . 4.5300000000000002 110.391 173.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -55.86 -33.4 64.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.992 1.717 . . . . 5.2199999999999998 114.074 -178.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -55.69 -22.95 25.81 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 120.99 -1.069 . . . . 4.8200000000000003 113.721 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -80.94 -14.89 57.56 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.044 1.498 . . . . 1.5600000000000001 115.044 172.171 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -80.15 -52.19 8.06 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.58 1.082 . . . . 0.81999999999999995 110.485 160.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -66.42 -29.8 70.03 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.775 1.23 . . . . 1.95 113.323 -172.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt -50.13 -35.18 24.78 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 118.911 0.778 . . . . 4.1500000000000004 112.406 165.074 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.5 mt -81.32 -40.86 22.96 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.64 -0.663 . . . . 1.02 111.322 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.62 -48.98 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 123.23 0.612 . . . . 0.80000000000000004 111.102 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -65.04 -24.42 67.48 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.002 1.112 . . . . 1.8799999999999999 114.002 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -82.36 -41.05 20.49 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.293 1.22 . . . . 3.1200000000000001 114.293 173.048 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.56 -32.04 20.9 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 121.12 -0.988 . . . . 2.6000000000000001 112.45 -171.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 170' ' ' ASP . . . . . 0.47 ' HA ' ' HE3' ' B' ' 138' ' ' LYS . 7.9 t70 -60.26 -44.88 94.91 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.256 -0.902 . . . . 3.0 111.228 174.5 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.99 -12.0 7.02 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.168 1.787 . . . . 2.0499999999999998 115.363 174.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -117.11 -4.06 11.48 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.758 1.223 . . . . 2.2799999999999998 113.628 -177.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -154.96 95.29 1.73 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.697 1.135 . . . . 3.7400000000000002 110.104 -168.713 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -76.23 79.94 3.02 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.631 1.572 . . . . 4.21 112.858 -164.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 68.24 -4.67 4.56 Favored Glycine 0 CA--C 1.535 1.304 0 O-C-N 121.03 -1.043 . . . . 2.8900000000000001 113.114 -166.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 64.3 mmt-85 -68.52 147.95 51.25 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.799 1.24 . . . . 5.96 109.702 174.275 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 35.6 mm -142.55 137.92 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 126.464 1.905 . . . . 2.52 107.37 176.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 9.1 t -92.12 -142.87 0.2 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.961 1.704 . . . . 2.6099999999999999 111.512 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -117.82 -56.71 2.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.404 1.881 . . . . 2.5899999999999999 110.284 158.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -61.68 -27.41 68.67 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 128.508 2.723 . . . . 3.0 114.32 -177.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -43.54 -58.78 2.46 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.336 1.854 . . . . 3.0099999999999998 111.054 165.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -54.5 -43.88 72.22 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.239 -0.913 . . . . 2.4300000000000002 111.772 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 35.4 t-105 -62.3 -47.94 82.07 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 122.123 -0.361 . . . . 0.75 111.753 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 13.2 t -71.74 -25.81 62.21 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 118.215 -0.898 . . . . 1.6599999999999999 112.274 177.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.425 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 62.1 mt -63.96 -48.97 74.37 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 117.28 -1.343 . . . . 0.70999999999999996 110.737 168.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 38.7 mm -50.27 -41.88 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 CA-C-N 121.348 1.885 . . . . 0.73999999999999999 112.065 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.55 -25.1 72.69 Favored Glycine 0 CA--C 1.531 1.057 0 O-C-N 121.534 -0.729 . . . . 0.91000000000000003 113.744 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.94 -21.68 75.83 Favored Glycine 0 CA--C 1.533 1.182 0 CA-C-O 118.672 -1.071 . . . . 1.02 114.438 -176.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 189' ' ' ILE . . . . . 0.505 HD12 ' H ' ' B' ' 189' ' ' ILE . 0.5 OUTLIER -88.49 -48.4 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 125.12 1.368 . . . . 0.98999999999999999 109.161 163.457 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 1.5 m -86.44 44.71 1.17 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.621 1.968 . . . . 1.6899999999999999 111.9 -165.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -118.42 -71.39 0.39 Allowed Glycine 0 CA--C 1.53 1.027 0 C-N-CA 126.603 2.049 . . . . 0.93000000000000005 111.036 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.14 -30.66 82.54 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.471 2.781 . . . . 1.6000000000000001 114.176 -178.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 7.7 pt -83.88 -13.75 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 119.713 1.142 . . . . 1.29 113.518 172.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.95 -34.94 76.17 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.31 1.226 . . . . 0.87 114.31 -169.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -56.78 -36.29 69.69 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.434 -1.416 . . . . 3.2000000000000002 111.808 168.289 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.02 -40.04 75.44 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 123.625 0.77 . . . . 2.2000000000000002 111.369 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 197' ' ' ILE . . . . . 0.517 HG23 HD13 ' A' ' 13' ' ' ILE . 90.3 mt -47.41 -62.33 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.768 0.827 . . . . 1.1299999999999999 110.85 166.266 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -56.35 -46.67 79.87 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.514 0.561 . . . . 1.6799999999999999 112.514 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.305 2.6 pt-20 -78.6 -13.19 59.95 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.977 0.732 . . . . 2.9100000000000001 112.977 -173.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -81.45 -25.81 35.81 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 115.058 1.503 . . . . 2.3300000000000001 115.058 169.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -75.13 -15.63 60.58 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.12 0.968 . . . . 2.23 111.228 170.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -102.49 -61.81 1.35 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.965 1.306 . . . . 2.3399999999999999 110.876 -179.553 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.254 7.5 pt20 . . . . . 0 N--CA 1.48 1.057 1 C-N-CA 132.026 4.13 . . . . 4.79 115.72 171.744 . . . . . . . . 2 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 . . . . . 0 CA--C 1.544 0.714 0 N-CA-C 112.34 0.496 . . . . 2.5899999999999999 112.34 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 17.1 p -78.95 166.75 22.03 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 120.795 -1.191 . . . . 0.90000000000000002 110.953 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -56.58 -34.13 66.85 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.28 0.632 . . . . 2.25 112.47 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -45.7 90.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.17 1.388 . . . . 0.82999999999999996 110.122 175.043 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -76.23 -47.99 21.93 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.993 0.917 . . . . 2.9300000000000002 111.423 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 40.2 tttm -44.89 -46.69 11.01 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.248 1.419 . . . . 5.8700000000000001 113.104 159.141 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.82 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -63.52 -45.99 88.08 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.563 -1.208 . . . . 0.53000000000000003 112.896 175.695 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.5 t -57.76 -38.61 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 120.87 1.668 . . . . 0.58999999999999997 110.377 174.1 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.4 mt -63.64 -43.37 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 121.634 -0.666 . . . . 1.04 111.277 173.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.8 t -68.28 -39.82 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 124.394 1.077 . . . . 0.48999999999999999 111.986 179.233 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.4 mp -59.83 -45.29 92.85 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.75 1.159 . . . . 0.91000000000000003 110.212 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.6 t -64.66 -42.22 94.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 124.896 1.278 . . . . 0.53000000000000003 112.32 177.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -56.57 -49.28 75.33 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.408 1.083 . . . . 3.3799999999999999 111.13 168.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.406 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -72.16 -24.62 61.47 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.91 0.707 . . . . 2.5899999999999999 112.91 -170.115 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -71.2 -63.15 1.16 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.983 0.513 . . . . 1.95 112.185 161.487 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -63.53 -32.59 74.09 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.792 -0.623 . . . . 1.8799999999999999 112.376 -163.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 18' ' ' ASN . 35.8 pttt -55.57 -23.38 26.66 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.585 1.328 . . . . 2.3100000000000001 114.585 175.248 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -78.95 -31.03 44.9 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.623 -1.298 . . . . 2.3999999999999999 112.607 174.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.1 m . . . . . 0 N--CA 1.486 1.333 0 CA-C-N 120.824 1.647 . . . . 2.0899999999999999 111.72 176.379 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.0 pt . . . . . 0 CA--C 1.533 0.289 0 N-CA-C 108.907 -0.775 . . . . 3.25 108.907 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 72.1 m -113.92 167.64 10.48 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.606 0.763 . . . . 2.9900000000000002 109.512 160.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.41 -18.28 4.01 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 115.583 1.697 . . . . 2.3599999999999999 115.583 176.697 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.3 p -57.15 -20.73 28.01 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.384 -1.447 . . . . 2.1800000000000002 114.286 165.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.7 m -82.44 -33.01 28.69 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.725 -1.234 . . . . 1.26 113.52 171.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -55.3 -52.38 63.63 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.789 1.177 . . . . 2.3700000000000001 111.37 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -16.32 8.81 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.688 1.195 . . . . 2.96 113.976 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -106.86 -38.58 6.03 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 124.826 1.251 . . . . 3.04 112.529 -174.301 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.2 ttm -47.99 -44.58 30.74 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.767 0.827 . . . . 1.6000000000000001 110.286 156.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.2 mt -62.46 -12.64 23.17 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 116.006 1.854 . . . . 0.95999999999999996 116.006 170.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -104.96 -15.56 15.09 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 124.761 1.224 . . . . 2.3300000000000001 113.505 174.622 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.51 -47.56 3.9 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.326 1.051 . . . . 1.49 112.924 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -94.73 -9.53 34.42 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.223 1.374 . . . . 2.9399999999999999 113.967 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -120.14 34.11 5.34 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.849 1.66 . . . . 1.48 112.601 171.389 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -78.65 -21.2 48.69 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 116.209 1.929 . . . . 1.6499999999999999 116.209 -161.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -94.18 -14.35 25.69 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.237 1.381 . . . . 1.96 112.989 -170.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 50.2 mtm -85.53 -18.1 34.43 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.625 1.17 . . . . 2.1200000000000001 112.922 162.038 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.55 125.99 26.93 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 120.643 -1.286 . . . . 3.1499999999999999 108.618 163.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.6 p -171.81 -57.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.568 -0.707 . . . . 3.5 109.449 -158.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -79.49 147.2 32.32 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.511 0.724 . . . . 5.4500000000000002 109.25 155.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.3 m -69.15 -30.17 68.35 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.785 0.834 . . . . 2.3799999999999999 110.473 171.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -55.8 -33.74 60.29 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 124.461 1.029 . . . . 1.74 113.098 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -59.78 -56.0 27.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.319 1.047 . . . . 3.0699999999999998 111.514 -179.174 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.6 ttt-85 -73.33 -33.29 65.05 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.148 0.795 . . . . 4.7999999999999998 113.148 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -55.65 -38.11 69.12 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 119.562 -1.961 . . . . 3.0800000000000001 112.163 171.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.96 -10.14 55.79 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.571 1.693 . . . . 1.25 115.571 172.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.32 -57.32 3.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.585 1.084 . . . . 0.88 111.019 162.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.18 -29.42 70.35 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.49 0.716 . . . . 2.96 112.085 -172.295 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -62.64 -28.07 69.65 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 120.434 -1.416 . . . . 2.5699999999999998 114.311 172.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.9 mt -78.54 -36.76 44.3 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.315 0.646 . . . . 0.91000000000000003 110.554 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.4 mm -51.6 -55.48 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 126.271 1.828 . . . . 1.0 109.55 178.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -60.1 -31.15 69.77 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.67 0.989 . . . . 2.25 113.67 -178.185 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -31.61 65.64 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.405 1.482 . . . . 2.96 112.55 175.345 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.4 -29.98 21.08 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.335 1.454 . . . . 2.1000000000000001 111.587 177.497 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -55.4 -52.01 64.98 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.757 1.623 . . . . 2.9900000000000002 109.503 164.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.97 -14.69 24.47 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 115.553 1.686 . . . . 2.0299999999999998 115.553 175.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -118.73 -7.39 10.52 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.152 1.538 . . . . 2.3500000000000001 115.152 -175.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -147.45 125.28 11.92 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 121.019 1.736 . . . . 3.7599999999999998 111.051 -179.082 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -114.88 149.82 36.56 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.632 0.773 . . . . 5.2300000000000004 110.44 163.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.54 -43.67 0.59 Allowed Glycine 0 CA--C 1.53 1.002 0 C-N-CA 126.598 2.047 . . . . 3.0 114.346 -178.111 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -88.93 140.66 29.21 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.296 1.439 . . . . 5.4299999999999997 112.342 -173.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 46.7 mm -114.29 129.61 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 N-CA-C 106.357 -1.72 . . . . 2.48 106.357 154.56 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.2 t -84.9 -171.71 3.79 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.392 0.615 . . . . 1.7 112.489 -179.223 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -94.51 -57.76 2.39 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 119.253 -2.154 . . . . 1.8899999999999999 110.404 167.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -51.46 -29.13 15.23 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 130.713 3.605 . . . . 3.3300000000000001 114.94 170.721 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -49.72 -58.67 4.87 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.306 1.442 . . . . 3.23 111.306 171.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -52.44 -48.21 65.94 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.211 -0.931 . . . . 1.99 111.652 176.174 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.4 t-105 -64.54 -45.56 86.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 119.054 -0.498 . . . . 0.54000000000000004 111.416 -171.519 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.2 t -71.17 -29.39 65.13 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 117.753 -1.117 . . . . 1.8700000000000001 112.229 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.89 -35.51 76.95 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.459 1.027 . . . . 0.66000000000000003 112.207 174.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.3 mm -52.26 -38.72 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 CA-C-N 120.322 1.419 . . . . 0.67000000000000004 111.359 173.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.79 -14.02 64.64 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.422 1.487 . . . . 0.57999999999999996 115.309 177.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.29 -24.94 64.7 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-N 119.394 1.597 . . . . 0.80000000000000004 112.842 173.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -97.08 -41.99 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.305 1.442 . . . . 1.05 109.96 171.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.4 m -80.93 64.12 5.57 Favored 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 127.014 2.126 . . . . 1.3300000000000001 108.342 173.227 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -159.87 -55.67 0.01 OUTLIER Glycine 0 CA--C 1.531 1.038 0 C-N-CA 126.04 1.781 . . . . 1.3200000000000001 110.937 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.09 -73.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.344 2.696 . . . . 1.3999999999999999 111.341 161.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.5 pt -73.51 -18.33 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 N-CA-C 114.7 1.37 . . . . 1.25 114.7 -170.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.484 ' HA ' HD12 ' A' ' 94' ' ' ILE . . . -55.23 -39.29 69.55 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.227 1.011 . . . . 1.1299999999999999 112.606 -178.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -63.28 -41.79 99.05 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.5 -0.75 . . . . 5.7800000000000002 111.863 175.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.5 tt -65.18 -40.89 94.9 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 117.908 -1.044 . . . . 1.1799999999999999 110.818 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.484 HD12 ' HA ' ' A' ' 91' ' ' ALA . 96.7 mt -45.72 -51.28 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 119.375 0.988 . . . . 1.0 110.726 174.002 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -63.71 -39.18 93.66 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.605 0.965 . . . . 1.96 113.605 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -85.41 -24.09 27.66 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.18 0.9 . . . . 2.7799999999999998 112.978 -177.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -66.89 -46.36 75.15 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.159 1.383 . . . . 2.4500000000000002 109.166 164.521 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -84.16 41.16 0.8 Allowed 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 124.914 2.292 . . . . 3.1099999999999999 111.002 176.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 111.862 -2.426 . . . . 2.4399999999999999 107.361 149.915 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 . . . . . 0 CA--C 1.54 0.576 0 CA-C-O 121.091 0.472 . . . . 2.4300000000000002 111.976 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.3 p -82.74 168.99 16.67 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 121.526 -0.734 . . . . 0.97999999999999998 110.359 177.131 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -63.8 -48.78 75.51 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-O 117.022 -1.466 . . . . 2.5600000000000001 110.509 171.461 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.25 -47.23 36.11 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 120.2 1.363 . . . . 0.75 111.0 178.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -73.49 -53.91 9.5 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 126.078 1.751 . . . . 2.96 112.503 -173.371 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -47.55 -36.64 10.83 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.125 1.37 . . . . 4.5599999999999996 113.299 161.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.82 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -73.61 -38.82 64.96 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 120.716 -1.24 . . . . 0.46999999999999997 112.003 176.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.94 -40.99 79.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 120.914 1.688 . . . . 0.66000000000000003 110.385 166.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 97.1 mt -58.74 -49.04 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 118.867 0.758 . . . . 0.90000000000000002 112.103 171.521 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.8 t -61.38 -43.3 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.98 1.312 . . . . 0.48999999999999999 112.265 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -60.77 -44.01 97.32 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.825 1.193 . . . . 0.93999999999999995 110.778 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 55.5 t -63.38 -42.55 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 124.325 1.05 . . . . 0.52000000000000002 111.836 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -55.54 -47.75 75.81 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 119.972 1.26 . . . . 3.6000000000000001 110.514 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 121' ' ' ASN . . . . . 0.407 ' HA ' ' HE2' ' B' ' 124' ' ' LYS . 0.2 OUTLIER -72.9 -24.9 60.89 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 112.694 0.627 . . . . 2.5600000000000001 112.694 -168.983 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -74.02 -59.72 2.59 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.898 0.479 . . . . 1.97 112.111 163.206 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -64.34 -32.68 74.39 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.6 -0.714 . . . . 1.8300000000000001 112.286 -165.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 124' ' ' LYS . . . . . 0.407 ' HE2' ' HA ' ' B' ' 121' ' ' ASN . 37.4 pttt -54.84 -24.57 23.67 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.437 1.273 . . . . 2.1899999999999999 114.437 175.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -77.39 -31.29 54.09 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 117.49 -1.243 . . . . 2.1299999999999999 112.963 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.486 1.37 0 CA-C-N 120.901 1.682 . . . . 2.0600000000000001 112.125 -179.056 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 3.2 pt . . . . . 0 CA--C 1.533 0.316 0 N-CA-C 108.62 -0.882 . . . . 3.3500000000000001 108.62 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 66.3 m -117.17 168.95 9.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.744 0.818 . . . . 2.9399999999999999 109.457 161.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.6 -16.96 2.77 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 116.02 1.859 . . . . 2.21 116.02 175.691 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.9 p -59.59 -20.48 56.09 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 119.636 -1.915 . . . . 2.1099999999999999 114.455 165.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 23.6 m -78.88 -31.68 45.57 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 120.439 -1.413 . . . . 1.21 112.983 170.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.484 ' CE2' HD11 ' B' ' 145' ' ' LEU . 50.1 t80 -61.05 -49.38 77.58 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.592 1.157 . . . . 2.2400000000000002 112.039 -178.217 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 1.2 ptt180 -55.58 -15.55 3.02 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.899 1.074 . . . . 2.9399999999999999 113.899 173.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -106.03 -38.33 6.34 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 125.451 1.5 . . . . 2.73 112.525 -175.551 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.5 ttm -49.79 -44.39 49.0 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.247 1.019 . . . . 1.5700000000000001 110.45 159.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 145' ' ' LEU . . . . . 0.484 HD11 ' CE2' ' B' ' 141' ' ' PHE . 28.7 mt -65.04 -0.6 1.66 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 126.214 1.806 . . . . 1.21 115.644 171.468 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -120.78 -14.71 8.5 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 125.452 1.501 . . . . 2.3500000000000001 114.046 174.01 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.86 -53.23 2.8 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.171 0.988 . . . . 1.54 113.47 175.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -85.69 -34.65 21.23 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 120.585 1.539 . . . . 2.79 112.545 177.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.22 47.38 0.9 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.753 1.221 . . . . 1.8300000000000001 111.595 179.284 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -89.69 -16.32 30.65 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 115.685 1.735 . . . . 1.6000000000000001 115.685 -160.505 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -97.82 -22.72 16.22 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 120.454 1.479 . . . . 1.6399999999999999 113.278 -167.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 60.2 mtm -79.64 -19.38 49.26 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.672 -1.268 . . . . 2.1000000000000001 111.947 166.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 5.9 mp -63.28 125.54 24.46 Favored 'General case' 0 C--O 1.222 -0.358 0 O-C-N 121.399 -0.813 . . . . 3.02 108.815 160.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 18.4 p -172.74 -68.72 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.996 -1.113 . . . . 3.3399999999999999 107.996 -161.502 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -66.14 139.52 58.15 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.723 0.773 . . . . 5.7000000000000002 109.392 155.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 37.8 m -68.0 -28.02 67.06 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.003 0.921 . . . . 2.5299999999999998 110.441 174.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.76 -32.02 58.45 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.544 1.069 . . . . 1.77 112.953 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -64.78 -55.65 18.42 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.262 1.031 . . . . 3.1600000000000001 111.522 -175.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 31.0 ttt-85 -71.74 -36.22 70.37 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.441 0.904 . . . . 4.5700000000000003 113.441 173.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -53.42 -42.88 67.5 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.829 1.65 . . . . 3.4700000000000002 111.859 172.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.66 -23.3 58.96 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.206 -1.378 . . . . 0.95999999999999996 114.521 174.054 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.4 -52.01 11.75 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.818 1.19 . . . . 0.81000000000000005 111.799 167.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.42 -27.38 68.51 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 124.062 0.945 . . . . 2.5800000000000001 112.807 -175.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.1 mtmt -63.19 -31.21 72.3 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.345 -1.472 . . . . 3.9300000000000002 113.742 169.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 7.9 mt -76.25 -36.72 58.34 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.12 0.568 . . . . 0.95999999999999996 111.209 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 34.8 mm -53.84 -58.81 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.046 1.339 . . . . 1.1299999999999999 110.099 175.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -59.06 -34.8 72.36 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.328 0.862 . . . . 1.8200000000000001 113.328 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -63.68 -36.6 84.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.54 1.136 . . . . 3.1899999999999999 112.205 173.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.67 -28.85 24.44 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.343 1.057 . . . . 2.2999999999999998 111.749 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -55.67 -55.51 31.32 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.252 1.021 . . . . 3.0099999999999998 110.264 163.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -56.52 -24.76 48.76 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.694 1.368 . . . . 1.98 114.694 176.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -103.6 -9.23 19.39 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 114.576 1.324 . . . . 2.3799999999999999 114.576 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -150.55 122.57 8.22 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 121.394 1.906 . . . . 3.77 112.083 -177.504 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -100.42 153.1 19.62 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.289 0.635 . . . . 5.0099999999999998 110.315 153.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.56 -45.54 1.28 Allowed Glycine 0 CA--C 1.53 0.976 0 C-N-CA 126.876 2.179 . . . . 2.79 115.489 168.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 23.6 mmt85 -84.47 154.19 22.9 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.352 1.461 . . . . 5.3399999999999999 111.89 -176.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.9 mm -131.67 129.2 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 126.236 1.814 . . . . 2.4700000000000002 106.324 159.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 2.8 t -87.11 -174.2 4.79 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 112.779 0.659 . . . . 1.74 112.779 -177.367 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -89.82 -58.12 2.62 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 119.234 -2.166 . . . . 1.8899999999999999 110.029 163.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -54.53 -28.51 45.91 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.184 3.394 . . . . 3.1600000000000001 114.19 176.487 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -46.87 -59.93 2.76 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.148 1.379 . . . . 3.3100000000000001 111.287 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -52.0 -46.71 65.01 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.41 -0.806 . . . . 2.0899999999999999 111.498 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 -65.92 -42.65 89.84 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 119.009 -0.519 . . . . 0.59999999999999998 111.908 -174.258 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 11.2 t -70.5 -28.88 65.31 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 117.662 -1.161 . . . . 1.74 112.262 174.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.7 mt -69.92 -40.97 75.25 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.801 1.182 . . . . 0.68000000000000005 112.106 172.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.5 mm -53.44 -37.19 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 CA-C-N 121.232 1.833 . . . . 0.63 111.989 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.22 -13.12 59.59 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 124.917 1.246 . . . . 0.56000000000000005 115.126 177.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -81.31 -19.61 66.33 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-N 119.535 1.668 . . . . 1.04 113.778 173.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.1 mp -100.39 -44.57 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 124.815 1.246 . . . . 1.22 109.411 168.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.7 m -77.82 58.51 1.89 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.86 2.064 . . . . 1.47 109.24 169.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -158.68 -58.54 0.01 OUTLIER Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.359 1.933 . . . . 1.3700000000000001 111.141 -172.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -61.66 -71.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.373 2.715 . . . . 1.6499999999999999 111.242 163.086 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 16.8 pt -76.38 -18.22 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 115.1 1.519 . . . . 1.25 115.1 -170.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.0 -35.26 76.36 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.078 0.77 . . . . 1.26 113.078 -172.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -60.38 -38.49 84.08 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.918 -0.489 . . . . 6.0999999999999996 111.923 175.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.4 tt -71.67 -34.67 69.89 Favored 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 124.343 1.057 . . . . 1.51 111.466 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 91.0 mt -47.16 -50.81 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 CA-C-N 119.83 1.195 . . . . 1.01 110.098 172.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 13.3 t60 -63.86 -25.16 68.04 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.495 1.295 . . . . 1.99 114.495 -176.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -98.35 -27.0 14.3 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.769 1.168 . . . . 2.8300000000000001 113.17 176.189 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -72.0 -45.65 60.15 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 124.546 1.139 . . . . 2.2599999999999998 109.824 173.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -83.26 36.3 0.52 Allowed 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 124.374 2.035 . . . . 3.1200000000000001 110.969 175.043 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -117.06 -52.79 2.5 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 112.803 -1.999 . . . . 2.02 108.247 151.369 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 . . . . . 0 CA--C 1.543 0.71 0 C-N-CA 125.537 1.535 . . . . 5.4699999999999998 114.814 -176.544 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 . . . . . 0 N--CA 1.472 0.636 0 N-CA-C 113.186 0.81 . . . . 2.2999999999999998 113.186 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p -71.51 168.12 18.23 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.952 0.901 . . . . 1.25 111.251 -169.874 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -61.2 -59.92 4.57 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-O 118.502 -0.761 . . . . 2.6800000000000002 109.941 169.287 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -46.64 -41.91 15.48 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.158 1.383 . . . . 0.82999999999999996 111.243 -178.168 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -70.78 -58.02 4.06 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 125.357 1.463 . . . . 2.6899999999999999 113.181 179.131 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -54.24 -26.54 29.26 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 120.622 1.556 . . . . 5.7199999999999998 113.438 168.341 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.869 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -74.75 -42.44 58.22 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 125.456 1.502 . . . . 0.48999999999999999 110.716 174.492 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.5 t -58.9 -38.24 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 120.144 1.338 . . . . 0.69999999999999996 110.754 165.501 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.5 mt -58.25 -48.78 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-O 117.481 -1.247 . . . . 0.81000000000000005 111.183 168.664 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.8 t -60.77 -35.53 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 CA-C-N 121.029 1.74 . . . . 0.63 113.085 178.39 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp -67.15 -48.66 67.36 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.042 -1.036 . . . . 0.94999999999999996 111.775 170.384 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.1 t -57.59 -40.92 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 125.319 1.448 . . . . 0.63 111.797 173.59 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -68.33 -47.87 66.38 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 126.991 2.116 . . . . 3.1499999999999999 111.154 -179.343 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -75.17 -5.27 43.5 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.8 1.037 . . . . 2.6699999999999999 113.8 -179.851 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -84.08 -60.01 2.23 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.272 -0.893 . . . . 2.3900000000000001 112.239 162.277 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -64.64 -30.88 71.91 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.075 -1.016 . . . . 1.76 113.575 -175.0 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -48.8 -34.11 11.73 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 114.277 1.214 . . . . 2.6899999999999999 114.277 167.633 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -95.42 -36.87 11.18 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.865 0.866 . . . . 2.5099999999999998 110.385 -176.012 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.8 t . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 114.244 1.201 . . . . 3.0299999999999998 114.244 175.866 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 29.7 pt . . . . . 0 N--CA 1.467 0.398 0 N-CA-C 109.377 -0.601 . . . . 2.3100000000000001 109.377 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.4 m -98.77 139.83 33.87 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.011 0.924 . . . . 2.2799999999999998 109.353 163.143 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -54.45 -31.04 54.68 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 122.861 1.315 . . . . 2.2599999999999998 113.28 -177.19 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.2 p -60.77 -24.22 65.6 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.864 1.666 . . . . 1.8200000000000001 114.615 173.723 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.5 m -80.78 -33.43 34.94 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.08 0.952 . . . . 1.21 112.425 174.691 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.441 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 28.8 t80 -59.98 -49.28 78.28 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.072 -1.018 . . . . 2.1400000000000001 111.309 178.232 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 24.5 ptt180 -58.97 -25.21 63.36 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.94 0.718 . . . . 2.4300000000000002 112.94 176.159 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -88.08 -47.54 8.42 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 125.298 1.439 . . . . 2.5499999999999998 111.276 -178.741 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -45.77 -43.39 13.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.332 1.453 . . . . 1.3 111.43 167.949 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.441 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 44.5 mt -67.9 -4.26 12.32 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 115.474 1.657 . . . . 1.4199999999999999 115.474 175.252 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -98.22 -19.25 17.97 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.166 1.787 . . . . 2.7400000000000002 113.611 166.657 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.47 -57.1 2.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.371 1.468 . . . . 1.5600000000000001 112.774 -178.669 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -79.2 -15.8 57.51 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.097 -1.002 . . . . 3.6699999999999999 111.849 -178.085 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -126.66 45.85 2.6 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 127.508 2.323 . . . . 1.9299999999999999 110.672 176.101 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -87.34 -16.41 35.11 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 116.057 1.873 . . . . 1.3700000000000001 116.057 -175.314 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -98.57 -17.84 18.46 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 121.402 1.91 . . . . 1.6100000000000001 112.196 -175.744 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.0 tpp -77.03 -13.29 59.98 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.874 1.67 . . . . 1.8700000000000001 112.543 166.423 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.3 tp -72.97 89.85 1.45 Allowed 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 124.142 1.925 . . . . 3.5800000000000001 112.813 -173.648 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.6 t -82.38 71.94 9.44 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 112.999 -1.909 . . . . 4.1299999999999999 110.027 163.284 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.1 t70 82.26 159.78 0.14 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 127.627 2.371 . . . . 3.8700000000000001 116.266 165.114 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -28.21 -41.28 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 130.959 3.704 . . . . 2.21 114.475 159.371 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.91 -50.87 62.76 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-N 119.596 1.089 . . . . 1.6499999999999999 112.36 176.296 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -64.39 -32.21 73.74 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.892 -0.769 . . . . 3.2799999999999998 112.263 172.795 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -66.33 -50.47 63.49 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 120.104 1.32 . . . . 6.1399999999999997 112.871 173.506 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.8 mmmt -49.26 -40.84 35.72 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 119.144 0.884 . . . . 5.2599999999999998 112.283 170.022 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' A' ' 61' ' ' LYS . . . -61.16 -18.72 59.59 Favored 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 115.622 1.712 . . . . 1.1899999999999999 115.622 177.453 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.418 ' HB2' HG12 ' A' ' 86' ' ' ILE . . . -78.2 -52.87 8.03 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.797 0.839 . . . . 0.81000000000000005 111.882 163.188 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -60.28 -29.41 68.79 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.888 2.075 . . . . 2.7200000000000002 113.433 -177.163 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.497 ' HG2' ' HA ' ' A' ' 58' ' ' ALA . 2.1 ptmm? -56.51 -32.03 64.66 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 120.763 -1.21 . . . . 3.5800000000000001 113.015 167.562 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.9 mt -67.38 -42.15 83.83 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.493 -0.754 . . . . 0.92000000000000004 111.507 176.406 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.9 mm -57.79 -50.09 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.774 1.23 . . . . 0.93999999999999995 110.385 -173.013 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -67.31 -36.57 81.76 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.373 1.069 . . . . 1.9399999999999999 112.621 -179.085 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -65.81 -28.44 69.0 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 112.747 0.647 . . . . 3.9100000000000001 112.747 172.628 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 tt -91.94 -21.72 20.41 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.409 1.083 . . . . 2.4100000000000001 113.121 -178.366 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -59.21 -19.1 42.56 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.014 1.116 . . . . 2.5699999999999998 114.014 162.15 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.66 -9.28 59.8 Favored 'General case' 0 CA--C 1.553 1.096 0 N-CA-C 115.26 1.578 . . . . 2.6200000000000001 115.26 164.849 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -148.13 59.22 1.1 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 120.547 1.521 . . . . 3.1600000000000001 114.048 -166.116 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.9 t60 -168.64 112.93 0.59 Allowed 'General case' 0 N--CA 1.48 1.029 0 O-C-N 120.11 -1.619 . . . . 4.6500000000000004 113.34 -173.79 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.93 30.38 0.17 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.276 2.23 . . . . 7.1600000000000001 113.864 -175.785 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.93 8.06 72.25 Favored Glycine 0 CA--C 1.537 1.424 0 O-C-N 120.07 -1.644 . . . . 3.1600000000000001 113.468 -169.826 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 10.8 mmt-85 -98.98 98.7 9.72 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 125.964 1.706 . . . . 4.9100000000000001 108.909 -178.148 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.5 mm -68.69 113.16 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 N-CA-C 105.729 -1.952 . . . . 2.2000000000000002 105.729 164.801 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.8 m -80.25 165.64 22.16 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.049 0.841 . . . . 1.4199999999999999 112.297 167.798 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -59.59 -48.75 80.42 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 122.508 1.147 . . . . 2.0499999999999998 110.407 161.607 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.1 -22.73 66.04 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.722 2.009 . . . . 2.8700000000000001 113.482 177.457 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -66.66 -50.13 63.95 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.304 0.957 . . . . 2.8100000000000001 111.098 174.968 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -56.09 -49.8 72.83 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 120.857 -1.152 . . . . 1.8 111.694 173.314 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.1 t-105 -63.64 -47.99 79.1 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 121.69 -0.631 . . . . 0.52000000000000002 112.206 -176.095 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 t -67.04 -26.79 66.93 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.354 -0.831 . . . . 1.5800000000000001 111.978 -179.945 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.6 mt -72.43 -35.59 68.37 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.306 -1.331 . . . . 0.60999999999999999 112.921 171.725 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.5 mm -57.47 -39.29 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 CA-C-N 121.605 2.002 . . . . 0.68999999999999995 111.912 178.271 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.5 -10.84 67.44 Favored Glycine 0 N--CA 1.475 1.298 0 C-N-CA 124.291 0.948 . . . . 0.73999999999999999 114.045 175.917 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.99 -17.91 66.34 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.792 1.187 . . . . 0.77000000000000002 113.562 176.018 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.418 HG12 ' HB2' ' A' ' 59' ' ' ALA . 0.2 OUTLIER -104.09 -45.7 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.667 1.187 . . . . 1.03 109.637 166.999 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 30.7 m -75.02 96.53 3.21 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.103 1.361 . . . . 1.3100000000000001 109.042 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -168.97 -74.02 0.04 OUTLIER Glycine 0 CA--C 1.532 1.127 0 CA-C-O 118.44 -1.2 . . . . 0.97999999999999998 113.481 -175.807 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -63.18 -45.81 11.5 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.652 2.235 . . . . 1.2 111.531 179.325 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.1 pt -71.82 -13.53 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 114.019 1.118 . . . . 1.1000000000000001 114.019 176.013 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.78 -52.96 63.33 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.148 1.34 . . . . 1.0600000000000001 112.922 177.916 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -61.01 -33.56 73.45 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.423 -1.423 . . . . 3.0800000000000001 112.669 173.957 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.6 -45.55 86.48 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.478 0.711 . . . . 1.0600000000000001 110.865 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.8 mt -49.77 -58.3 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.273 0.629 . . . . 0.98999999999999999 110.277 168.363 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -73.16 -20.01 61.0 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.434 0.901 . . . . 2.5600000000000001 113.434 -169.643 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.287 4.0 pt-20 -88.07 -21.9 24.46 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.586 0.754 . . . . 2.6899999999999999 111.987 175.055 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -79.96 -38.72 31.7 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 125.057 1.343 . . . . 2.7400000000000002 114.336 172.23 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.62 9.84 0.58 Allowed 'General case' 0 N--CA 1.487 1.391 0 CA-C-O 123.659 1.695 . . . . 2.5600000000000001 112.682 177.438 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 . . . . . 0 C--N 1.327 -0.398 0 C-N-CA 126.827 2.051 . . . . 2.6899999999999999 109.965 175.208 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 114.992 1.479 . . . . 2.1800000000000002 114.992 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.7 p -65.29 156.29 32.47 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.232 1.013 . . . . 1.01 110.252 -173.494 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -58.25 -33.82 69.78 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 118.555 0.616 . . . . 2.3500000000000001 112.39 179.767 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 tt -67.57 -44.11 78.99 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.769 1.628 . . . . 0.91000000000000003 110.605 177.956 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -72.83 -46.01 55.33 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.35 -0.844 . . . . 2.77 111.287 -178.428 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -53.05 -39.23 63.1 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.828 1.651 . . . . 5.3099999999999996 111.101 165.503 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.869 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.08 -44.85 78.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 120.686 -1.259 . . . . 0.54000000000000004 112.73 173.269 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 75.7 t -55.4 -41.5 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 121.132 1.787 . . . . 0.65000000000000002 110.608 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 91.1 mt -56.35 -48.33 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 119.322 0.965 . . . . 0.79000000000000004 111.465 170.583 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 37.7 t -65.01 -36.58 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 119.887 1.221 . . . . 0.47999999999999998 113.3 178.876 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.99 -45.83 80.19 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.13 -0.981 . . . . 0.93999999999999995 110.783 172.602 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 48.2 t -62.49 -40.67 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.105 1.362 . . . . 0.72999999999999998 111.647 176.116 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -64.67 -49.07 72.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.462 1.505 . . . . 3.02 111.347 176.163 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -80.65 14.0 2.3 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.232 1.013 . . . . 2.8100000000000001 113.672 -179.052 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -108.31 -58.14 2.03 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.271 1.428 . . . . 2.1099999999999999 111.321 163.963 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -64.35 -27.46 69.04 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 120.71 -1.244 . . . . 1.8200000000000001 113.506 -175.993 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 17.3 mtpt -45.98 -37.41 6.52 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.186 1.18 . . . . 2.3999999999999999 114.186 164.62 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -90.74 -34.6 15.3 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.956 1.302 . . . . 2.6899999999999999 111.258 -176.431 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 67.3 t . . . . . 0 N--CA 1.482 1.138 0 C-N-CA 124.93 1.292 . . . . 3.21 113.485 175.233 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 14.4 pt . . . . . 0 N--CA 1.471 0.607 0 CA-C-O 121.334 0.588 . . . . 2.7400000000000002 111.993 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 51.5 m -93.45 138.66 31.54 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 108.621 -0.881 . . . . 2.3199999999999998 108.621 156.63 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -55.03 -32.13 61.61 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 119.918 1.235 . . . . 2.2000000000000002 113.313 -173.762 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 50.1 p -64.82 -17.3 64.11 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.533 1.533 . . . . 1.6399999999999999 114.798 176.078 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 43.4 m -85.8 -35.94 20.38 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.947 1.249 . . . . 1.21 112.329 -179.608 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.507 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 11.3 t80 -49.92 -54.14 21.59 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.542 1.137 . . . . 2.1600000000000001 111.047 173.756 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -62.11 -17.83 58.93 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.213 0.82 . . . . 2.2599999999999998 113.213 179.505 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -94.94 -43.83 7.99 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.671 1.588 . . . . 2.3100000000000001 112.516 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -49.39 -41.59 39.86 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.926 -1.109 . . . . 1.26 110.483 162.275 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 145' ' ' LEU . . . . . 0.45 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 17.2 mt -67.49 -8.25 32.11 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 116.389 1.996 . . . . 1.4399999999999999 116.389 171.073 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -93.88 -23.02 18.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.95 1.3 . . . . 2.6200000000000001 113.697 164.843 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.13 -60.99 1.43 Allowed 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.841 1.201 . . . . 1.74 113.54 -178.502 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -76.46 -10.68 59.57 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.619 -1.3 . . . . 3.1899999999999999 112.638 -174.573 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.88 31.75 5.24 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 128.012 2.525 . . . . 1.5800000000000001 111.678 175.142 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -69.16 -29.64 67.69 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.967 1.469 . . . . 1.28 114.967 -171.717 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -86.83 -24.98 24.77 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.391 0.996 . . . . 1.55 111.416 -171.786 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 5.0 tpp -61.81 -17.54 56.57 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.189 0.996 . . . . 1.8600000000000001 112.719 167.869 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 16.8 tp -80.9 88.71 5.87 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 123.258 1.504 . . . . 2.8300000000000001 112.168 -169.993 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 40.2 t -71.27 65.37 0.41 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 113.825 -1.534 . . . . 4.3399999999999999 110.63 158.269 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 35.2 t70 95.38 156.09 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 129.37 3.068 . . . . 3.8500000000000001 115.936 166.761 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.6 m -34.16 -38.6 0.06 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 130.878 3.671 . . . . 2.48 114.496 158.94 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -57.89 -43.49 94.79 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 120.1 1.318 . . . . 1.6599999999999999 111.748 176.131 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -68.93 -21.36 64.21 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 113.413 0.894 . . . . 3.5299999999999998 113.413 172.857 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -75.06 -45.45 41.41 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 121.182 1.81 . . . . 6.5599999999999996 112.741 167.617 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -53.18 -40.61 64.49 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.548 0.613 . . . . 4.04 111.419 175.367 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -51.85 -45.28 63.96 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.388 0.884 . . . . 1.5600000000000001 113.388 171.698 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -63.49 -38.65 91.96 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.175 0.99 . . . . 0.84999999999999998 113.176 177.011 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -32.77 74.5 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.694 0.998 . . . . 2.4100000000000001 113.694 175.537 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -53.63 -40.95 66.23 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.423 1.01 . . . . 3.2999999999999998 111.795 173.138 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.38 -39.87 92.25 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.149 -0.932 . . . . 0.80000000000000004 111.416 179.202 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 24.8 mm -61.58 -46.92 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 123.887 0.875 . . . . 0.91000000000000003 110.967 -178.107 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -69.29 -37.48 77.85 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.036 0.446 . . . . 2.3599999999999999 112.184 177.579 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 -64.61 -26.73 68.53 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 112.646 0.61 . . . . 3.6299999999999999 112.646 176.706 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.55 -28.12 18.7 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.613 0.765 . . . . 2.4500000000000002 113.02 179.616 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.42 -37.95 40.55 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.715 0.806 . . . . 2.98 112.663 164.11 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -63.89 -10.67 22.14 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 115.5 1.667 . . . . 2.9900000000000002 115.5 173.681 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -131.46 6.54 4.45 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.86 1.43 . . . . 3.1000000000000001 114.86 -173.069 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 -156.99 114.92 3.2 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 116.121 1.897 . . . . 3.4900000000000002 116.121 -158.459 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.35 6.74 9.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 128.328 2.651 . . . . 5.4800000000000004 114.977 -170.137 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 92.04 10.94 60.66 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 125.689 1.614 . . . . 2.6600000000000001 112.952 -166.395 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -76.03 67.56 2.39 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.301 1.84 . . . . 5.7999999999999998 110.877 170.11 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 41.4 mm -52.7 133.65 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.431 1.092 . . . . 2.3500000000000001 110.483 175.969 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.74 164.99 16.49 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.094 1.758 . . . . 1.74 110.678 -179.496 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -66.22 -43.21 87.34 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 122.171 0.986 . . . . 2.23 111.534 169.806 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.15 -25.56 67.09 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.815 2.446 . . . . 3.0600000000000001 113.391 177.251 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -62.75 -59.68 4.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 118.76 0.709 . . . . 3.6800000000000002 110.269 175.525 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -52.82 -49.03 66.48 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.612 -0.68 . . . . 2.0499999999999998 110.653 178.327 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 21.0 t-105 -61.84 -48.48 80.38 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.447 0.536 . . . . 0.60999999999999999 112.447 -177.185 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.5 t -70.72 -27.15 63.76 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.078 -0.963 . . . . 1.55 112.075 -179.279 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.507 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 53.2 mt -72.99 -38.98 66.43 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 116.895 -1.526 . . . . 0.64000000000000001 112.656 171.775 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 25.9 mm -52.96 -42.66 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 CA-C-N 121.683 2.038 . . . . 0.59999999999999998 111.579 178.775 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.65 -14.32 64.79 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.556 1.074 . . . . 0.65000000000000002 114.688 177.305 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -79.27 -20.33 69.86 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 118.493 1.147 . . . . 0.75 112.916 176.289 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 189' ' ' ILE . . . . . 0.407 HD12 ' H ' ' B' ' 189' ' ' ILE . 0.4 OUTLIER -101.36 -40.78 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 CA-C-N 118.317 1.058 . . . . 1.1000000000000001 110.046 167.019 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 14.0 m -79.17 86.74 4.94 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.606 1.562 . . . . 1.3899999999999999 109.0 -178.724 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -164.21 -72.91 0.03 OUTLIER Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.39 1.472 . . . . 0.84999999999999998 113.204 -174.491 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -62.4 -45.69 14.16 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.999 2.466 . . . . 1.01 111.913 178.902 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 21.0 pt -68.92 -17.7 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 113.889 1.07 . . . . 0.93000000000000005 113.889 174.42 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -55.11 -56.23 22.24 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.216 1.371 . . . . 0.97999999999999998 113.629 -178.849 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -60.81 -35.02 75.44 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.685 -1.259 . . . . 3.3199999999999998 112.439 175.701 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 5.4 tt -61.48 -47.16 86.95 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.189 0.996 . . . . 1.3999999999999999 110.249 178.969 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 45.9 mt -51.17 -59.83 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.386 1.074 . . . . 1.03 110.835 171.545 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -71.13 -18.28 62.52 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.423 0.897 . . . . 2.5299999999999998 113.423 -174.264 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.328 5.0 pt-20 -85.39 -28.12 25.35 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.868 0.758 . . . . 2.8199999999999998 112.462 173.262 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -80.02 -35.43 37.31 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.059 1.344 . . . . 2.8399999999999999 114.579 174.407 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -72.6 8.75 1.31 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 123.527 1.632 . . . . 2.3399999999999999 112.266 176.325 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -125.41 -67.64 0.88 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 126.661 1.985 . . . . 2.8799999999999999 110.089 174.42 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 . . . . . 0 N--CA 1.48 1.064 0 C-N-CA 128.839 2.855 . . . . 4.5199999999999996 115.349 171.53 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 114.489 1.292 . . . . 2.6000000000000001 114.489 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 p -73.2 150.93 41.69 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.212 0.605 . . . . 1.1699999999999999 110.362 -161.973 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -59.62 -34.19 72.45 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.59 1.086 . . . . 2.9300000000000002 113.507 -176.733 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.62 -56.86 13.9 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.161 -0.681 . . . . 1.3600000000000001 109.161 172.066 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -62.58 -61.36 2.48 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 124.13 0.972 . . . . 3.04 110.318 -172.132 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -20.93 66.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.035 0.534 . . . . 5.3300000000000001 110.761 -172.597 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.458 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -75.13 -23.64 57.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 120.195 -1.566 . . . . 0.78000000000000003 113.541 172.679 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.8 t -57.09 -32.76 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.674 1.579 . . . . 0.68000000000000005 110.784 168.306 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.7 mt -56.08 -57.74 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 CA-C-N 118.661 0.664 . . . . 0.84999999999999998 109.869 167.542 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.1 t -55.7 -39.72 56.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 125.301 1.44 . . . . 0.79000000000000004 112.377 -178.483 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 mp -67.13 -24.32 65.9 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.676 1.19 . . . . 0.94999999999999996 113.425 176.323 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.0 t -89.33 -45.9 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.824 0.738 . . . . 0.88 111.537 175.692 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -45.94 -55.76 6.35 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.215 1.406 . . . . 3.3799999999999999 111.843 -178.515 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -47.5 -43.29 24.47 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.968 1.707 . . . . 3.1000000000000001 114.515 178.705 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -81.83 -21.55 37.53 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.127 0.971 . . . . 2.1600000000000001 113.209 -174.742 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -85.77 -32.06 22.03 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.154 -0.966 . . . . 2.2000000000000002 112.454 165.941 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.8 tttp -50.39 -38.63 43.75 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.585 1.954 . . . . 4.2599999999999998 113.843 178.659 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -85.5 8.95 17.26 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.321 1.449 . . . . 2.3700000000000001 114.212 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.8 m . . . . . 0 N--CA 1.475 0.807 0 C-N-CA 125.541 1.536 . . . . 2.29 110.37 178.006 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.8 pt . . . . . 0 N--CA 1.477 0.896 0 N-CA-C 110.01 -0.367 . . . . 2.48 110.01 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.8 t -81.48 137.61 35.59 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.457 -1.402 . . . . 2.5499999999999998 108.285 157.026 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -58.47 -32.5 68.81 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.917 -1.114 . . . . 2.25 110.986 170.219 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m -66.26 -18.68 65.5 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.849 1.659 . . . . 2.0899999999999999 114.182 170.052 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 53.2 m -69.21 -41.94 76.4 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.742 1.61 . . . . 1.1000000000000001 111.386 173.057 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -50.46 -50.42 52.41 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.664 1.186 . . . . 2.0899999999999999 113.009 -171.459 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -59.7 -25.66 64.96 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.835 1.654 . . . . 3.9900000000000002 113.757 178.586 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -98.96 -44.44 6.32 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 124.991 1.316 . . . . 2.7599999999999998 111.851 -175.641 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 17.9 ptm -57.42 -32.43 66.86 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.66 -1.275 . . . . 2.8500000000000001 111.848 169.514 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.3 mt -61.14 -14.1 22.4 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.388 1.625 . . . . 1.0600000000000001 115.388 166.109 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -109.44 -5.35 15.82 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 120.322 1.419 . . . . 2.1800000000000002 114.175 169.082 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.76 -74.72 0.5 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.74 1.155 . . . . 1.51 109.824 166.445 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -59.1 -34.52 72.1 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.555 1.142 . . . . 3.3799999999999999 113.823 -177.284 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.18 9.47 34.12 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.243 1.572 . . . . 1.6299999999999999 115.243 -173.583 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -48.16 -34.58 10.19 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.518 1.673 . . . . 1.3400000000000001 115.518 -172.181 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.402 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 73.5 m-70 -62.01 -34.98 77.2 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.965 -1.085 . . . . 1.6799999999999999 112.931 -177.333 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.9 tpp -85.0 -3.04 58.63 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.949 1.7 . . . . 1.95 112.871 -178.467 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.2 mp -96.61 112.32 24.12 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.182 1.393 . . . . 2.7200000000000002 111.351 -178.813 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 t -75.56 62.96 1.47 Allowed 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.418 -0.801 . . . . 4.2699999999999996 109.376 152.565 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.6 t70 38.29 -109.61 0.08 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.234 2.214 . . . . 7.1500000000000004 111.802 -166.661 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.84 -14.44 36.92 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 126.481 1.913 . . . . 2.3300000000000001 114.213 -173.896 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -63.85 -30.86 78.92 Favored Glycine 0 CA--C 1.533 1.166 0 CA-C-N 120.732 1.606 . . . . 3.1600000000000001 111.175 168.949 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -78.46 -75.65 0.22 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.16 0.584 . . . . 3.6299999999999999 110.464 157.793 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.0 ttp-105 -51.91 -28.75 17.39 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 117.837 2.532 . . . . 5.3099999999999996 117.837 -161.816 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -53.69 -35.85 61.54 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 121.122 1.783 . . . . 3.6400000000000001 112.684 170.311 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.33 -26.37 68.4 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.796 1.406 . . . . 1.1799999999999999 114.796 172.888 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.33 -42.59 68.38 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.561 1.073 . . . . 0.88 111.366 171.224 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -68.31 -29.67 68.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.747 1.219 . . . . 1.97 112.991 -175.778 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -48.69 -40.05 26.8 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.013 0.911 . . . . 3.5099999999999998 113.042 165.266 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.9 mt -78.55 -36.65 44.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.729 -1.123 . . . . 1.0800000000000001 111.672 -176.596 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.9 mm -54.68 -53.69 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 122.99 0.516 . . . . 1.1299999999999999 110.386 175.41 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -65.45 -34.42 78.25 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.284 0.846 . . . . 2.0800000000000001 113.284 -179.508 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -62.59 -29.22 70.44 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.312 1.045 . . . . 2.6299999999999999 112.584 176.201 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -88.56 -37.23 15.86 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.246 1.018 . . . . 2.71 111.669 170.865 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.84 -24.43 67.74 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.914 -1.116 . . . . 3.3799999999999999 113.945 177.618 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.86 -11.99 21.9 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.927 1.455 . . . . 3.1099999999999999 114.927 169.823 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -160.31 -17.89 0.06 Allowed 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 118.609 2.818 . . . . 2.9100000000000001 118.609 -171.747 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -96.47 114.68 26.37 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 121.511 1.959 . . . . 4.3600000000000003 111.149 175.831 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -63.54 -18.27 63.67 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.943 2.497 . . . . 4.0499999999999998 115.631 -172.207 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 118.0 2.03 16.49 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.943 -0.921 . . . . 2.75 113.269 -160.736 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -66.18 145.49 55.73 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.726 1.263 . . . . 4.1799999999999997 110.057 137.731 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 13.6 mt -128.33 149.57 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 127.227 2.211 . . . . 2.6600000000000001 106.02 167.954 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.7 t -123.75 159.98 28.29 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 114.0 1.111 . . . . 1.47 114.0 -174.372 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -73.74 -30.56 62.89 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 120.49 -1.381 . . . . 2.3599999999999999 113.647 -173.177 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -70.3 -25.61 63.41 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.169 1.388 . . . . 3.9399999999999999 112.739 168.882 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.5 tt0 -58.01 -58.19 9.5 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.276 1.03 . . . . 3.3500000000000001 111.33 -175.523 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -56.14 -46.86 79.09 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.963 -1.086 . . . . 2.23 112.403 -176.287 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.8 t-105 -61.46 -45.94 92.16 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.856 -0.592 . . . . 0.64000000000000001 111.278 178.223 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -38.22 90.11 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.595 0.758 . . . . 1.5800000000000001 111.61 178.504 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.2 mt -60.75 -46.05 91.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 118.269 -0.872 . . . . 0.77000000000000002 111.754 174.782 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 31.0 mm -51.35 -40.56 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 CA-C-N 120.485 1.493 . . . . 0.69999999999999996 112.872 -178.726 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.86 -16.81 57.35 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.079 0.847 . . . . 0.68000000000000005 114.452 177.151 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.4 -19.61 76.19 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 121.124 -1.221 . . . . 0.89000000000000001 113.358 172.393 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.8 mp -103.02 -48.67 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 118.695 1.248 . . . . 0.91000000000000003 109.879 171.083 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.6 m -72.44 53.76 0.31 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.587 2.355 . . . . 1.3400000000000001 110.077 163.634 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -127.46 -71.46 0.17 Allowed Glycine 0 CA--C 1.528 0.886 0 C-N-CA 128.422 2.915 . . . . 0.76000000000000001 107.998 172.111 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.9 -52.3 0.7 Allowed 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.441 2.76 . . . . 0.96999999999999997 113.484 175.844 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -72.29 -18.95 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 119.632 1.105 . . . . 1.1100000000000001 113.716 -173.994 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -51.15 -59.63 3.98 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.191 1.397 . . . . 0.88 112.325 -178.522 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -56.09 -45.29 79.43 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.477 0.547 . . . . 2.6400000000000001 112.477 175.961 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -56.97 -42.65 80.54 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 125.094 1.358 . . . . 1.27 111.286 -174.704 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.2 mt -54.95 -55.92 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.776 0.83 . . . . 1.6399999999999999 110.756 176.374 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -63.43 -37.39 87.09 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.446 -0.784 . . . . 2.1299999999999999 112.189 -179.568 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -66.37 -32.57 74.04 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.004 0.921 . . . . 3.0499999999999998 110.932 177.117 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -69.97 -40.44 75.37 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 117.496 -1.24 . . . . 2.71 113.414 170.456 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -59.33 -41.5 89.29 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.2 1.364 . . . . 2.7400000000000002 111.432 177.578 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.715 0 O-C-N 121.456 -0.778 . . . . 2.98 111.01 179.194 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.402 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 15.2 m-85 . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 112.501 0.556 . . . . 2.48 112.501 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 3.1 p -74.3 152.08 39.71 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.434 0.294 . . . . 1.2 111.059 -160.06 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -60.1 -21.96 62.16 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.218 1.192 . . . . 2.3799999999999999 114.218 -177.61 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 tt -80.56 -48.04 13.31 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.767 0.827 . . . . 1.6599999999999999 110.183 171.614 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -67.36 -58.48 4.7 Favored 'General case' 0 C--N 1.333 -0.131 0 C-N-CA 123.404 0.682 . . . . 2.9199999999999999 111.036 -175.991 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -20.1 56.75 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.152 0.981 . . . . 4.8899999999999997 112.072 -176.689 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.458 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.3 -34.33 74.52 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.321 -1.487 . . . . 0.60999999999999999 113.425 170.183 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 58.6 t -58.02 -32.9 44.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.254 0.934 . . . . 0.62 110.905 175.703 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 44.0 mt -55.92 -57.66 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 109.079 -0.711 . . . . 1.0 109.079 168.735 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 72.3 t -60.74 -36.54 71.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 125.756 1.622 . . . . 0.79000000000000004 112.932 -176.251 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.65 -38.57 84.02 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.641 -0.662 . . . . 1.0 112.135 175.121 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 60.2 t -76.32 -39.05 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-N 118.503 0.592 . . . . 0.78000000000000003 110.955 178.464 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -51.93 -45.88 64.48 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.868 1.667 . . . . 2.7999999999999998 111.36 175.562 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -58.97 -33.77 71.04 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.362 1.465 . . . . 3.3300000000000001 114.405 175.917 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -80.82 -43.78 19.51 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.656 0.662 . . . . 2.0499999999999998 112.311 -179.541 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -72.3 -27.31 62.37 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.406 -0.809 . . . . 2.1600000000000001 112.654 176.452 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -42.2 -43.74 3.49 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.179 1.792 . . . . 3.3399999999999999 114.128 171.432 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 -97.77 18.67 15.18 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.132 1.373 . . . . 2.4500000000000002 113.732 -172.159 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 34.9 m . . . . . 0 N--CA 1.479 0.996 0 C-N-CA 126.152 1.781 . . . . 2.2200000000000002 110.278 178.224 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 43.3 pt . . . . . 0 N--CA 1.482 1.135 0 N-CA-C 110.325 -0.25 . . . . 2.5899999999999999 110.325 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 33.7 t -85.52 136.55 33.37 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.595 -1.316 . . . . 2.4399999999999999 108.703 157.393 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 17.5 ttpt -59.47 -30.72 68.73 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.97 -1.081 . . . . 2.3199999999999998 111.628 174.638 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 1.7 m -67.62 -18.59 65.02 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.918 1.687 . . . . 1.99 113.879 171.232 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.6 m -70.59 -40.78 73.05 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 120.29 1.405 . . . . 1.0900000000000001 112.316 175.168 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.427 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 64.7 t80 -51.21 -53.55 34.04 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.646 1.179 . . . . 2.1800000000000002 113.12 -173.409 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -54.75 -22.43 14.09 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.074 1.75 . . . . 4.21 114.076 178.254 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -106.46 -38.24 6.25 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.999 1.32 . . . . 3.2599999999999998 113.064 -176.268 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -47.31 -43.16 22.4 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.778 1.231 . . . . 1.46 110.847 161.613 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 25.5 mt -63.26 -12.1 26.48 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 116.174 1.916 . . . . 1.3100000000000001 116.174 171.578 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -113.98 -8.13 13.09 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.106 1.521 . . . . 2.3799999999999999 115.106 167.672 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -76.41 0.44 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.363 0.983 . . . . 1.46 110.015 167.225 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -58.92 -36.3 74.52 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.525 1.511 . . . . 3.5800000000000001 114.4 -178.856 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.25 9.5 43.26 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 115.359 1.614 . . . . 1.6899999999999999 115.359 -174.35 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -47.17 -33.62 5.43 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.197 1.925 . . . . 1.3899999999999999 116.197 -170.522 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -65.07 -35.38 80.98 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.942 1.246 . . . . 1.73 113.341 -175.5 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 18.3 tpp -78.99 -8.76 59.2 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.304 1.442 . . . . 1.9299999999999999 113.142 -177.09 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.5 mp -92.34 114.43 26.98 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 120.58 -1.325 . . . . 2.7200000000000002 112.522 -172.185 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 29.8 t -73.93 60.75 0.76 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 115.784 -0.644 . . . . 4.2599999999999998 109.533 154.059 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 35.3 t70 36.86 -107.64 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.832 2.053 . . . . 6.7699999999999996 112.007 -165.991 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.04 -17.92 26.91 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 126.805 2.042 . . . . 2.4700000000000002 113.853 -174.189 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -62.55 -29.33 73.23 Favored Glycine 0 N--CA 1.473 1.164 0 CA-C-N 120.908 1.685 . . . . 3.2400000000000002 111.259 169.614 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -81.18 -74.57 0.32 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.896 0.878 . . . . 3.3399999999999999 110.95 160.492 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 25.8 ttp-105 -53.69 -27.86 30.29 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 117.67 2.47 . . . . 5.3200000000000003 117.67 -164.954 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -54.12 -37.46 64.37 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 121.344 1.884 . . . . 3.6600000000000001 112.454 171.905 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.63 -26.54 63.83 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.747 1.388 . . . . 1.1799999999999999 114.747 172.329 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.44 -43.24 50.72 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.895 1.278 . . . . 0.90000000000000002 111.37 174.842 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.64 -28.35 67.65 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.678 1.191 . . . . 1.8899999999999999 112.354 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -50.24 -39.47 44.77 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 122.068 0.937 . . . . 3.29 112.923 165.858 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 9.5 mt -77.21 -35.49 55.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.755 -1.111 . . . . 1.03 111.819 -174.741 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 37.7 mm -56.09 -52.14 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 122.781 0.432 . . . . 1.0 110.208 176.765 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -65.42 -34.12 77.55 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.14 0.793 . . . . 2.04 113.14 -179.633 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -62.3 -29.25 70.3 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.05 0.94 . . . . 2.5899999999999999 112.455 176.419 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -90.04 -34.76 15.83 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.513 1.125 . . . . 2.9100000000000001 111.654 171.606 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.28 -22.4 66.94 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.517 -1.364 . . . . 3.4199999999999999 114.135 175.319 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.34 -11.59 43.49 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.031 1.493 . . . . 3.0099999999999998 115.031 168.733 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -162.05 -15.27 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.19 0 N-CA-C 119.097 2.999 . . . . 3.0 119.097 -170.648 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -101.23 116.2 32.26 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.986 2.175 . . . . 4.5 110.935 175.601 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -68.51 -11.5 59.94 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 128.406 2.682 . . . . 3.9199999999999999 116.732 -166.546 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 110.89 0.15 28.72 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-O 118.694 -1.059 . . . . 2.75 113.283 -160.396 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -67.15 144.76 55.85 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 119.199 1.499 . . . . 4.3300000000000001 109.612 136.916 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 13.3 mt -129.89 146.16 34.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 C-N-CA 126.666 1.986 . . . . 3.0 106.137 167.126 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.4 t -106.32 177.74 4.77 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.293 1.037 . . . . 1.52 113.658 -176.895 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -80.81 -48.94 11.73 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.029 -1.045 . . . . 2.0 111.954 171.53 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -64.35 -27.58 69.12 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.734 1.613 . . . . 3.71 112.451 176.726 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -54.4 -54.11 45.06 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.363 0.665 . . . . 3.3300000000000001 110.938 173.62 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -62.61 -47.16 84.99 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.801 -1.187 . . . . 2.4900000000000002 112.324 -175.913 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 49.0 t-105 -60.58 -46.99 88.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 119.182 -0.437 . . . . 0.59999999999999998 111.228 178.236 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.99 -31.94 69.88 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.725 -0.655 . . . . 1.6399999999999999 112.105 -178.469 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.427 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 28.2 mt -60.46 -47.86 84.27 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.129 0.877 . . . . 0.57999999999999996 111.459 171.164 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.9 mm -53.15 -37.71 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 120.188 1.358 . . . . 0.81000000000000005 112.592 179.27 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -59.42 -19.86 48.94 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 118.925 0.784 . . . . 0.67000000000000004 113.898 175.216 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.33 -19.96 79.17 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-N 118.545 1.173 . . . . 0.87 113.846 173.239 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -106.06 -35.43 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.484 1.642 . . . . 1.04 110.977 173.495 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 40.7 m -72.75 65.35 0.7 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.537 1.935 . . . . 1.4399999999999999 109.445 167.155 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -150.51 -78.87 0.02 OUTLIER Glycine 0 CA--C 1.529 0.929 0 C-N-CA 126.088 1.804 . . . . 0.90000000000000002 111.329 -174.711 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -63.26 -46.51 9.79 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.129 2.553 . . . . 1.1599999999999999 112.446 179.288 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 5.8 pt -75.93 -23.34 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 N-CA-C 113.447 0.906 . . . . 1.29 113.447 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -53.73 -56.67 15.36 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.475 1.11 . . . . 0.85999999999999999 112.173 -173.765 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -57.62 -46.5 84.02 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.88 0.696 . . . . 2.8799999999999999 112.88 174.61 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.4 tt -57.78 -40.35 79.62 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 125.351 1.461 . . . . 1.49 111.304 -173.232 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 20.1 mt -56.21 -57.81 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.269 1.028 . . . . 1.77 110.345 175.924 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -60.76 -36.83 79.93 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.522 -0.736 . . . . 2.1200000000000001 112.088 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -67.33 -33.49 75.36 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.7 0.8 . . . . 3.0099999999999998 110.766 177.688 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -68.72 -40.72 79.79 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.123 1.369 . . . . 2.7999999999999998 113.019 171.873 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -61.23 -37.34 82.68 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 120.256 1.389 . . . . 2.6699999999999999 111.644 178.396 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.44 -41.8 84.15 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.624 -0.672 . . . . 2.7000000000000002 110.889 178.021 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 . . . . . 0 CA--C 1.541 0.617 0 CA-C-N 114.545 -1.207 . . . . 5.79 112.616 177.082 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 110.096 -0.335 . . . . 2.27 110.096 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.8 p -106.6 162.04 14.1 Favored 'General case' 0 N--CA 1.485 1.32 0 O-C-N 121.284 -0.885 . . . . 1.02 111.089 167.762 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -70.27 -23.37 62.87 Favored 'General case' 0 C--O 1.22 -0.458 0 O-C-N 121.47 -0.769 . . . . 2.9100000000000001 112.98 172.876 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -40.79 97.76 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.903 1.683 . . . . 0.92000000000000004 108.788 172.374 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -67.98 -63.85 0.98 Allowed 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 125.151 1.38 . . . . 2.6000000000000001 111.641 178.016 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -50.81 -27.75 7.94 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.012 1.733 . . . . 5.6299999999999999 114.05 170.827 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.708 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -70.34 -45.08 66.87 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 119.938 -1.726 . . . . 0.71999999999999997 113.204 167.789 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 67.3 t -59.24 -32.81 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-N 121.046 1.748 . . . . 0.77000000000000002 110.86 170.816 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.6 mt -59.0 -60.14 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.362 -1.304 . . . . 0.78000000000000003 110.503 165.086 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.5 t -56.08 -33.9 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 126.218 1.807 . . . . 0.63 113.056 -176.439 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.75 -39.56 91.2 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.32 -0.863 . . . . 1.0700000000000001 111.605 171.068 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 71.1 t -73.23 -40.35 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.657 1.183 . . . . 0.80000000000000004 111.545 174.198 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -54.85 -46.01 74.61 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.184 1.356 . . . . 5.6699999999999999 109.977 171.426 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -76.41 -24.05 54.04 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.143 1.164 . . . . 2.04 114.143 -177.193 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -75.32 -45.75 37.63 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.144 -1.598 . . . . 2.5699999999999998 110.921 167.62 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -71.52 -21.17 61.95 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.718 1.007 . . . . 2.8199999999999998 113.718 -172.795 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -48.64 -20.08 0.42 Allowed 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 114.512 1.301 . . . . 3.8399999999999999 114.512 169.172 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -100.56 -6.23 25.66 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.935 1.694 . . . . 2.9199999999999999 115.336 -179.364 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.481 1.105 0 CA-C-N 119.804 1.184 . . . . 2.9700000000000002 111.93 -175.316 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 12.1 pt . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 112.063 0.394 . . . . 2.8100000000000001 112.063 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.5 m -121.71 135.66 54.95 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.2 -0.938 . . . . 2.6499999999999999 111.037 -179.728 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -62.8 -32.73 73.97 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.078 -1.014 . . . . 2.5800000000000001 111.947 -178.771 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 m -57.34 -19.42 22.58 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.418 1.887 . . . . 2.3799999999999999 115.109 169.966 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.7 m -82.81 -30.18 28.98 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.177 0.899 . . . . 1.52 112.905 178.119 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.464 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 36.6 t80 -57.22 -47.88 80.21 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.533 1.515 . . . . 2.0699999999999998 112.317 -176.831 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -57.8 -23.09 50.84 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.086 1.354 . . . . 2.3199999999999998 114.215 174.435 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -100.18 -37.18 9.04 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.264 1.425 . . . . 3.2400000000000002 112.259 -175.474 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 3.5 ttm -48.32 -44.76 34.4 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.355 -1.466 . . . . 1.28 110.283 157.539 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.447 HD11 ' CE1' ' A' ' 38' ' ' PHE . 26.3 mt -64.82 -33.33 75.74 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 114.827 1.417 . . . . 1.0700000000000001 114.827 175.656 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -87.68 -11.55 48.02 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 120.358 1.436 . . . . 2.3999999999999999 114.028 -178.769 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.89 -64.2 1.08 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 126.388 1.875 . . . . 2.6899999999999999 111.691 173.514 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -74.52 -22.56 58.98 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 118.099 -0.953 . . . . 3.79 113.489 -173.377 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 24.2 mt -113.63 31.82 6.24 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.73 1.212 . . . . 2.1299999999999999 112.707 165.771 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -55.69 -31.1 62.14 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.348 -1.47 . . . . 1.6000000000000001 114.247 -175.404 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -78.55 -49.45 13.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.666 0.786 . . . . 1.5800000000000001 109.893 -168.703 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.4 mtm -79.35 -18.68 51.97 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.939 1.088 . . . . 2.29 113.939 174.842 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mp -65.25 -48.99 71.35 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 120.208 1.367 . . . . 2.9700000000000002 110.355 161.45 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.6 m 73.81 -40.71 0.47 Allowed 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.684 1.994 . . . . 4.3499999999999996 114.623 168.427 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -157.47 161.49 38.88 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 123.845 1.783 . . . . 4.2000000000000002 112.614 -179.031 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -33.05 -44.77 0.12 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 130.605 3.562 . . . . 2.5899999999999999 114.445 163.194 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -67.46 -47.22 64.08 Favored Glycine 0 N--CA 1.468 0.777 0 C-N-CA 124.657 1.122 . . . . 2.1800000000000002 112.469 -174.943 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -65.22 -38.93 91.97 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 117.58 0.69 . . . . 2.73 111.334 173.26 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.7 ttt-85 -58.28 -24.35 59.2 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.981 -1.074 . . . . 4.6799999999999997 113.392 177.77 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -57.16 -35.65 69.8 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.793 -1.192 . . . . 3.4100000000000001 112.927 170.648 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.42 -14.66 63.16 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.524 1.305 . . . . 1.24 114.524 176.894 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.66 -54.14 4.91 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.698 1.199 . . . . 0.98999999999999999 111.872 165.288 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.14 -32.15 73.61 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.167 0.587 . . . . 2.02 112.402 -176.498 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -57.21 -30.14 64.3 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.223 -0.923 . . . . 2.6699999999999999 112.905 172.746 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.6 mt -75.41 -37.24 60.57 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.857 -0.527 . . . . 1.1000000000000001 111.517 177.254 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.9 mm -56.54 -50.54 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 123.378 0.671 . . . . 1.1599999999999999 110.495 -177.764 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -64.28 -41.78 96.73 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.364 1.066 . . . . 1.97 112.969 179.039 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -59.5 -32.5 70.35 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.107 1.363 . . . . 2.3199999999999998 112.6 174.847 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.42 -31.29 20.13 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.792 1.237 . . . . 2.29 110.961 175.601 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.18 -35.3 79.85 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.702 1.601 . . . . 3.8300000000000001 114.528 -177.55 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.39 -10.6 3.31 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 114.432 1.271 . . . . 2.9100000000000001 114.432 171.357 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -131.14 -10.91 3.73 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.98 1.844 . . . . 3.3100000000000001 115.98 -167.808 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.84 134.89 11.11 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 121.803 2.092 . . . . 3.6699999999999999 114.674 -160.049 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -74.41 12.65 0.72 Allowed 'General case' 0 N--CA 1.479 0.976 0 O-C-N 120.172 -1.58 . . . . 4.8700000000000001 112.817 167.974 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.84 49.8 16.13 Favored Glycine 0 C--N 1.339 0.706 0 C-N-CA 124.474 1.035 . . . . 4.5800000000000001 111.07 -172.5 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.1 mmt85 -65.88 85.25 0.08 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 105.65 -1.982 . . . . 6.0800000000000001 105.65 159.784 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 9.3 mm -69.85 86.91 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 108.384 -0.969 . . . . 2.8500000000000001 108.384 -173.021 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.4 m -66.61 159.26 27.9 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.141 0.976 . . . . 2.2799999999999998 110.315 171.776 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -51.76 -42.87 62.7 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 122.276 1.036 . . . . 2.6499999999999999 110.873 171.939 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -74.98 -20.22 59.76 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 131.288 3.835 . . . . 3.6200000000000001 114.872 173.725 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -68.27 -55.04 13.56 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 122.003 2.183 . . . . 3.79 107.243 167.439 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -57.92 -52.45 65.43 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.049 -1.032 . . . . 1.71 112.712 176.657 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -64.25 -41.24 97.05 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.266 -0.897 . . . . 0.84999999999999998 113.065 -176.697 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.59 -37.37 73.9 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.19 0.904 . . . . 1.8600000000000001 111.054 177.652 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.464 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 64.6 mt -66.03 -40.32 90.95 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 117.947 -1.025 . . . . 0.90000000000000002 112.289 177.325 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 36.7 mm -56.46 -34.27 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-N 121.417 1.917 . . . . 0.72999999999999998 112.303 177.502 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -73.81 -1.88 59.84 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.247 1.403 . . . . 1.1499999999999999 114.917 176.178 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.72 -28.21 19.58 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-N 118.715 1.257 . . . . 0.67000000000000004 114.211 173.086 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.504 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.5 OUTLIER -93.68 -40.23 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-N 118.417 1.109 . . . . 0.93999999999999995 110.104 172.724 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 11.5 m -75.65 124.58 27.48 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.357 1.463 . . . . 1.72 108.415 176.871 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 139.25 -70.66 0.46 Allowed Glycine 0 N--CA 1.472 1.047 0 CA-C-O 117.918 -1.49 . . . . 1.0800000000000001 113.21 -176.023 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -59.87 -45.58 23.88 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.021 2.481 . . . . 1.04 111.677 178.276 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -84.97 -5.46 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 113.403 0.89 . . . . 1.3 113.403 175.225 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.05 81.9 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.815 1.188 . . . . 1.0600000000000001 112.711 -174.94 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -65.91 -36.62 83.9 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.106 -0.996 . . . . 3.5800000000000001 113.564 174.131 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -60.5 -38.64 84.96 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 117.87 -1.062 . . . . 1.8300000000000001 110.385 177.061 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.7 mt -49.25 -65.52 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 123.63 0.772 . . . . 1.3799999999999999 111.133 170.247 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -61.72 -33.59 74.29 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.903 -0.498 . . . . 2.3700000000000001 111.994 -175.115 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.308 2.8 pt-20 -86.97 -9.91 54.46 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 119.029 -0.51 . . . . 3.23 112.244 -176.048 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -78.05 -36.11 48.79 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.025 1.73 . . . . 3.0299999999999998 113.16 163.525 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -71.08 8.11 1.04 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 124.026 1.869 . . . . 2.4500000000000002 112.208 174.326 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 . . . . . 0 C--N 1.324 -0.538 0 C-N-CA 127.007 2.123 . . . . 3.0 109.515 176.501 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.522 0.201 . . . . 2.3500000000000001 110.49 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.2 p -104.93 158.44 16.54 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.968 0.907 . . . . 1.05 110.662 169.954 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -68.54 -25.27 64.84 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 118.945 0.793 . . . . 3.1499999999999999 112.366 175.544 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.03 -40.9 99.12 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 120.48 1.491 . . . . 0.76000000000000001 108.895 172.784 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -67.58 -63.04 1.14 Allowed 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.788 1.235 . . . . 2.6200000000000001 111.781 177.948 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 36.7 tptt -49.9 -28.97 7.35 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 121.022 1.737 . . . . 6.4000000000000004 114.104 169.472 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.708 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.41 -46.46 66.81 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 119.69 -1.881 . . . . 0.80000000000000004 113.237 167.536 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 85.9 t -56.9 -33.95 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 CA-C-N 121.626 2.012 . . . . 0.88 110.868 170.37 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 17.7 mt -59.01 -61.08 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-O 117.684 -1.151 . . . . 0.88 110.91 166.111 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 10.6 t -55.75 -35.83 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 126.444 1.898 . . . . 0.75 112.519 -176.088 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.2 mp -63.35 -36.71 84.59 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.441 -0.787 . . . . 1.1000000000000001 111.323 173.088 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.8 t -80.3 -37.95 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 125.344 1.458 . . . . 1.02 111.768 176.083 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -53.4 -45.85 69.47 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.104 1.32 . . . . 5.5599999999999996 110.399 169.634 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -72.36 -18.24 61.77 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.088 1.144 . . . . 2.0099999999999998 114.088 -178.624 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -80.71 -48.13 13.0 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 120.338 -1.476 . . . . 2.1600000000000001 111.146 167.26 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -71.34 -20.76 62.13 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.262 0.838 . . . . 2.4900000000000002 113.262 -167.497 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -46.73 -19.71 0.1 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.49 1.516 . . . . 3.79 114.504 164.169 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -107.52 5.73 27.39 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.384 1.874 . . . . 2.7999999999999998 115.429 -178.513 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.48 1.026 0 CA-C-N 119.972 1.26 . . . . 2.3399999999999999 111.291 179.287 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 9.7 pt . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 113.058 0.762 . . . . 3.1099999999999999 113.058 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 42.8 t -135.56 132.99 37.88 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.83 1.652 . . . . 2.9300000000000002 109.384 175.303 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -62.12 -18.38 60.67 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.217 1.007 . . . . 2.23 112.999 177.352 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.4 m -70.69 -17.99 62.83 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.797 1.639 . . . . 2.3599999999999999 114.333 170.298 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 9.1 m -89.9 -19.51 24.48 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.957 1.095 . . . . 2.3300000000000001 113.957 177.556 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.459 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 59.5 t80 -53.89 -52.55 60.14 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 120.888 1.676 . . . . 2.2599999999999998 111.072 177.811 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 33.8 ptt180 -57.48 -24.65 57.05 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.722 1.609 . . . . 2.3700000000000001 114.468 174.283 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -100.95 -38.36 8.24 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.931 1.692 . . . . 3.5299999999999998 111.722 -168.813 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 6.3 tmm? -47.88 -43.93 29.04 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.393 -1.442 . . . . 1.1799999999999999 110.969 152.726 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 145' ' ' LEU . . . . . 0.448 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 93.9 mt -74.34 -24.75 59.24 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.769 1.396 . . . . 1.1699999999999999 114.769 178.095 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -83.64 -16.82 43.72 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.827 1.649 . . . . 2.71 113.518 173.579 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -100.84 -63.61 1.12 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.928 1.691 . . . . 2.7200000000000002 113.131 176.066 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -74.66 -17.08 60.74 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 119.434 1.015 . . . . 3.73 113.552 -173.252 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 46.0 mt -117.2 30.55 7.25 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.827 1.651 . . . . 2.0099999999999998 112.441 165.447 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -57.25 -28.72 63.19 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.231 -1.543 . . . . 1.6599999999999999 113.525 -176.705 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -76.95 -51.59 10.91 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.446 -0.784 . . . . 1.6200000000000001 109.374 -168.819 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 24.4 mtm -76.65 -17.32 59.22 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.943 1.09 . . . . 2.3599999999999999 113.943 174.391 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.3 mp -66.7 -51.14 59.43 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.172 1.351 . . . . 2.96 110.396 162.315 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 14.2 m 73.63 -48.92 0.68 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.754 2.022 . . . . 4.4000000000000004 113.733 171.436 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -145.01 162.75 36.16 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 123.884 1.802 . . . . 4.4299999999999997 113.409 175.69 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -32.79 -42.88 0.08 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 131.094 3.758 . . . . 2.8100000000000001 114.32 161.064 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -66.82 -34.1 86.19 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 124.399 1.0 . . . . 2.2599999999999998 113.336 -179.198 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -76.98 -41.83 41.38 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 117.818 0.809 . . . . 2.6899999999999999 111.068 172.708 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 10.2 ttt180 -51.15 -30.1 15.65 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 120.604 -1.31 . . . . 4.9400000000000004 114.017 174.156 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -50.86 -37.54 43.93 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.633 -1.292 . . . . 3.8999999999999999 112.5 173.014 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -71.78 -14.24 61.93 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 114.979 1.474 . . . . 1.3600000000000001 114.979 178.451 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.06 -52.73 6.06 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.374 0.988 . . . . 0.96999999999999997 111.214 163.954 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -30.81 70.9 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.508 0.723 . . . . 1.96 111.858 -172.501 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -54.06 -33.01 56.34 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.297 -0.877 . . . . 2.71 112.875 169.579 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 18.0 mt -77.21 -36.26 54.93 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 121.733 -0.604 . . . . 1.04 111.339 -177.721 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 40.8 mm -55.51 -55.84 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 124.079 0.952 . . . . 1.1799999999999999 109.486 177.864 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -62.3 -34.99 77.66 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.183 0.808 . . . . 2.0600000000000001 113.183 -178.19 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -38.61 91.5 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.045 1.338 . . . . 2.7000000000000002 113.044 172.975 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.43 -35.89 18.02 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.431 1.093 . . . . 2.3399999999999999 110.674 -175.345 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -55.95 -40.75 73.65 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.85 1.26 . . . . 3.23 114.33 -175.993 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.61 -11.57 5.1 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 114.833 1.419 . . . . 2.27 114.833 173.212 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -130.04 3.99 4.85 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.734 1.383 . . . . 3.0299999999999998 114.734 -168.91 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -152.14 102.52 2.8 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.216 -1.552 . . . . 3.3100000000000001 111.707 -167.882 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -78.8 69.59 5.0 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.707 2.003 . . . . 3.8100000000000001 112.952 -167.163 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 78.45 -11.43 24.97 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.946 1.736 . . . . 4.0700000000000003 114.588 175.066 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.51 162.84 3.51 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.231 1.812 . . . . 6.0300000000000002 111.297 176.631 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 17.8 mm -133.49 129.5 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.773 1.629 . . . . 3.3599999999999999 106.671 164.963 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.7 m -127.92 157.38 40.71 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.09 1.356 . . . . 3.3599999999999999 112.856 -170.033 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -68.35 -46.49 70.01 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.266 -0.897 . . . . 2.4900000000000002 113.176 -171.562 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -73.65 -35.18 65.23 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.59 2.356 . . . . 3.7999999999999998 111.739 178.087 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -55.55 -58.55 7.32 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.361 1.064 . . . . 3.0600000000000001 110.272 167.258 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -49.6 -51.03 40.26 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.569 -0.707 . . . . 2.2200000000000002 111.565 177.112 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 40.0 t-105 -66.88 -46.42 75.0 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.621 -0.674 . . . . 0.93999999999999995 112.775 -177.767 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -69.04 -35.23 76.36 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.177 0.991 . . . . 1.8400000000000001 111.27 -176.267 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.459 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 87.1 mt -64.05 -37.87 89.0 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 118.152 -0.928 . . . . 0.80000000000000004 112.194 173.594 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 41.6 mm -57.08 -35.75 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 121.425 1.921 . . . . 0.72999999999999998 111.953 174.991 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -72.17 1.12 35.4 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 124.974 1.273 . . . . 1.1299999999999999 114.48 174.46 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -96.81 -30.27 7.65 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.289 1.424 . . . . 0.71999999999999997 114.654 173.871 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 189' ' ' ILE . . . . . 0.459 HD12 ' H ' ' B' ' 189' ' ' ILE . 0.6 OUTLIER -87.51 -44.23 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 118.925 1.363 . . . . 0.93000000000000005 109.777 170.289 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.72 145.0 45.5 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.977 1.311 . . . . 2.1099999999999999 108.861 175.497 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . 122.55 -72.61 0.39 Allowed Glycine 0 CA--C 1.531 1.039 0 CA-C-O 117.791 -1.561 . . . . 1.21 112.074 -176.395 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -62.19 -45.02 16.85 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.621 2.214 . . . . 1.01 111.524 179.935 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.5 pp -82.8 -5.83 9.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 113.397 0.888 . . . . 1.27 113.397 174.257 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.16 -35.63 79.36 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.697 1.135 . . . . 1.1599999999999999 112.99 -175.137 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -65.19 -36.46 84.26 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 113.46 0.911 . . . . 4.1100000000000003 113.46 175.763 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.2 tt -61.8 -39.07 90.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.914 -1.041 . . . . 2.25 110.408 177.65 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 32.6 mt -49.21 -65.54 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-O 121.632 0.729 . . . . 1.5800000000000001 111.231 171.56 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 64.9 t60 -63.13 -33.31 75.18 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.827 -0.545 . . . . 2.6400000000000001 111.467 -174.541 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.297 2.9 pt-20 -85.88 -10.04 55.98 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.523 0.564 . . . . 3.3500000000000001 112.523 -176.355 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -77.67 -36.37 51.41 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 126.197 1.799 . . . . 3.1899999999999999 113.278 164.408 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.09 7.6 1.19 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 126.673 1.989 . . . . 2.5899999999999999 112.064 174.215 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -128.92 -66.94 0.8 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 127.005 2.122 . . . . 3.1800000000000002 109.319 176.209 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 . . . . . 0 N--CA 1.478 0.948 0 C-N-CA 130.572 3.549 . . . . 5.46 115.379 177.862 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 112.902 0.705 . . . . 2.73 112.902 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 56.3 p -76.11 167.43 21.87 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.767 0.827 . . . . 1.29 111.759 -165.588 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -55.5 -49.82 71.56 Favored 'General case' 0 C--O 1.217 -0.651 0 CA-C-O 117.833 -1.08 . . . . 3.0 109.877 168.536 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.01 -48.74 61.37 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.44 1.018 . . . . 1.01 110.538 178.494 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -68.39 -58.74 3.89 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 118.455 -0.784 . . . . 3.4199999999999999 111.252 -178.362 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -52.74 -27.49 17.93 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 120.194 1.361 . . . . 6.0599999999999996 112.751 173.333 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.846 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -75.29 -41.76 56.32 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 120.586 -1.321 . . . . 0.59999999999999998 112.702 172.949 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -56.08 -47.05 80.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 CA-C-N 120.503 1.502 . . . . 0.58999999999999997 109.877 165.844 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.1 mt -53.08 -47.48 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.438 1.095 . . . . 0.87 111.007 171.564 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.6 t -68.72 -33.73 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 120.099 1.318 . . . . 0.69999999999999996 113.055 178.329 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.84 -35.64 77.19 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.266 -1.521 . . . . 0.94999999999999996 110.836 171.707 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 t -69.3 -39.44 79.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 125.517 1.527 . . . . 0.60999999999999999 110.999 174.138 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -62.2 -51.25 68.54 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.956 0.902 . . . . 3.1699999999999999 110.552 169.92 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.519 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 2.8 t30 -61.1 -18.37 57.59 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.104 1.15 . . . . 2.2000000000000002 114.104 -179.5 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -80.82 -68.47 0.68 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.402 0.681 . . . . 1.96 111.974 162.949 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -64.23 -25.96 68.3 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.873 1.064 . . . . 1.77 113.873 -163.659 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.519 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 7.4 ptmt -51.54 -26.34 8.39 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 120.054 1.297 . . . . 2.2000000000000002 113.056 172.282 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -98.53 5.19 48.11 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.373 1.469 . . . . 2.1099999999999999 114.907 -175.763 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 18.0 m . . . . . 0 N--CA 1.48 1.057 0 C-N-CA 124.374 1.069 . . . . 2.25 110.217 172.131 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 18.5 pt . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 113.702 1.001 . . . . 3.4900000000000002 113.702 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.4 m -76.28 139.82 41.27 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.198 -0.939 . . . . 2.5800000000000001 110.109 162.909 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -50.71 -28.63 9.44 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.318 1.447 . . . . 2.9300000000000002 114.405 -178.033 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.1 p -60.17 -21.93 62.28 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.952 1.464 . . . . 1.98 114.952 172.937 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 62.1 m -71.85 -49.62 36.7 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 118.539 -0.743 . . . . 1.6599999999999999 112.377 176.082 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -49.52 -52.48 29.34 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.611 1.165 . . . . 2.1400000000000001 112.107 -178.027 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -57.54 -12.43 2.72 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.007 1.114 . . . . 2.4500000000000002 114.007 178.708 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -116.9 -23.38 8.08 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 114.841 1.423 . . . . 4.8899999999999997 114.841 174.284 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -53.37 -39.23 64.04 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 120.197 1.362 . . . . 1.4399999999999999 110.47 158.723 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 mt -59.72 -22.89 62.66 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 114.317 1.229 . . . . 1.3300000000000001 114.317 169.426 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -98.26 -16.27 19.48 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.88 1.272 . . . . 3.3500000000000001 113.056 -179.231 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -97.66 -70.76 0.71 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.817 0.847 . . . . 1.96 110.721 169.324 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -62.19 -34.38 76.33 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.815 1.189 . . . . 3.6499999999999999 113.347 -177.109 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.8 19.38 20.56 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 114.33 1.233 . . . . 1.8100000000000001 114.33 -178.939 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -51.46 -34.26 34.58 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 115.057 1.503 . . . . 1.45 115.057 -171.823 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.533 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 9.0 m-70 -57.68 -27.64 63.08 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.834 2.054 . . . . 1.6599999999999999 113.988 -175.879 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 28.2 tpp -107.93 1.35 22.57 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.578 1.551 . . . . 2.1600000000000001 113.433 -169.21 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.1 mp -70.38 168.23 16.49 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.96 1.304 . . . . 2.8799999999999999 112.004 175.11 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -164.34 102.28 0.84 Allowed 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.02 -1.675 . . . . 3.8999999999999999 108.96 -168.535 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.6 t70 53.84 -166.83 0.08 Allowed 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 122.285 1.04 . . . . 4.5 110.648 -160.587 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.6 p -71.91 -27.65 62.97 Favored 'General case' 0 CA--C 1.518 -0.269 0 O-C-N 120.381 -1.449 . . . . 2.8900000000000001 112.653 154.226 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.02 -42.12 53.85 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 124.617 1.104 . . . . 1.8600000000000001 112.817 -175.289 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -55.25 -55.69 28.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.464 1.106 . . . . 3.2200000000000002 111.62 169.167 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -55.65 -47.72 76.2 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.522 1.055 . . . . 5.0 112.391 178.34 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -63.39 -19.12 64.39 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 120.758 -1.214 . . . . 3.3300000000000001 113.66 -175.114 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.14 -38.87 74.14 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.17 0.896 . . . . 1.77 112.023 166.522 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.15 99.58 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.594 0.758 . . . . 0.93999999999999995 112.093 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.73 -30.72 70.15 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.742 1.217 . . . . 2.79 113.792 175.317 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.2 mtmt -61.96 -34.82 76.82 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.851 -1.156 . . . . 3.8999999999999999 111.762 170.714 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.0 mt -70.93 -40.04 72.32 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.466 0.706 . . . . 0.90000000000000002 111.954 175.368 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.8 mm -52.16 -53.28 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.55 0.74 . . . . 0.93999999999999995 110.612 177.933 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -71.35 -38.32 71.63 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 124.65 1.219 . . . . 2.21 112.679 -176.753 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.4 t30 -54.83 -35.88 64.42 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.533 0.682 . . . . 2.6000000000000001 111.629 168.402 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.4 tp -86.23 -19.82 29.42 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 120.826 -1.171 . . . . 2.3999999999999999 113.319 -178.287 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -62.18 -22.7 66.11 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.281 0.845 . . . . 3.04 113.281 173.508 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.18 -6.24 41.39 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 114.506 1.299 . . . . 2.6699999999999999 114.506 168.285 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -139.99 14.63 2.46 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 125.152 1.381 . . . . 2.6499999999999999 114.416 -168.313 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -128.35 88.56 2.77 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.471 -1.393 . . . . 6.1200000000000001 113.13 -163.226 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -67.84 32.35 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 128.049 2.54 . . . . 5.8399999999999999 114.623 178.643 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.49 -8.44 9.99 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 126.085 1.802 . . . . 2.5 115.6 175.576 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.0 mmt-85 -78.84 -170.59 2.22 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.898 1.349 . . . . 6.5899999999999999 111.085 168.359 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.8 mm -137.7 135.75 45.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 104.872 -2.269 . . . . 2.46 104.872 164.597 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.2 m -96.94 167.12 11.27 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.927 0.891 . . . . 1.9199999999999999 110.403 165.62 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -66.08 -58.75 4.78 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 120.655 -1.278 . . . . 2.0800000000000001 111.74 -178.883 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -69.3 -14.62 63.04 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.682 1.593 . . . . 2.6400000000000001 112.848 -173.586 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -53.69 -54.12 42.33 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.59 1.556 . . . . 3.2200000000000002 111.028 171.147 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -65.09 -42.37 94.1 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.086 -1.634 . . . . 3.0699999999999998 112.819 175.316 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.6 t-105 -60.79 -43.67 97.8 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.756 -0.59 . . . . 0.60999999999999999 111.305 -179.021 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.5 t -73.57 -26.98 61.08 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 117.306 -1.331 . . . . 1.74 111.939 176.91 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 22.2 mt -65.69 -43.0 90.57 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 120.39 1.45 . . . . 0.69999999999999996 112.582 169.568 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 38.0 mm -52.48 -36.47 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-N 120.801 1.637 . . . . 0.65000000000000002 112.018 176.066 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.24 -29.51 68.85 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-O 119.07 -0.85 . . . . 0.68999999999999995 113.573 175.185 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.09 -26.84 65.49 Favored Glycine 0 CA--C 1.534 1.25 0 CA-C-N 119.182 1.491 . . . . 0.56999999999999995 114.427 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -92.85 -35.6 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 CA-C-N 119.351 1.576 . . . . 0.82999999999999996 111.162 169.737 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.4 m -72.08 -37.46 69.59 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.194 1.398 . . . . 2.77 112.652 -177.598 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.84 -47.09 66.56 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 125.412 1.482 . . . . 1.1100000000000001 114.877 -177.543 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.74 -42.5 6.62 Favored 'Trans proline' 0 C--N 1.352 0.757 0 CA-C-N 120.976 2.388 . . . . 1.3300000000000001 112.898 174.307 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.5 pt -84.58 -31.3 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 115.193 1.553 . . . . 1.1699999999999999 115.193 -171.28 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.25 71.12 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 120.13 1.332 . . . . 1.24 113.579 -168.43 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -62.59 -23.38 67.0 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.403 0.89 . . . . 6.21 113.403 175.578 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.61 -30.75 24.7 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.919 1.288 . . . . 2.04 111.073 174.033 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.5 mt -51.68 -55.53 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.328 0.967 . . . . 1.1100000000000001 111.004 174.27 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -52.69 -41.43 63.88 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.664 1.12 . . . . 3.9100000000000001 113.495 178.1 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -72.64 -8.36 54.91 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.014 0.925 . . . . 4.7400000000000002 112.488 -179.13 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -97.71 -35.01 10.7 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.594 1.958 . . . . 2.9700000000000002 112.941 165.195 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -62.37 -5.33 2.37 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 120.358 1.435 . . . . 2.4199999999999999 112.586 163.97 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 . . . . . 0 C--N 1.331 -0.232 0 C-N-CA 125.894 1.678 . . . . 2.3999999999999999 111.039 171.927 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 113.514 0.931 . . . . 2.3399999999999999 113.514 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 71.7 p -83.64 155.0 23.41 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.194 0.998 . . . . 1.27 111.191 -177.984 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -53.69 -33.17 54.57 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.712 1.005 . . . . 2.46 113.712 178.894 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.82 -47.41 69.13 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.005 0.522 . . . . 1.6799999999999999 111.083 177.427 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -72.02 -52.7 15.71 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.53 -0.544 . . . . 3.0099999999999998 109.53 -177.211 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.6 tmtt? -54.0 -29.62 44.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.193 0.997 . . . . 5.1100000000000003 111.899 174.465 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.846 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -70.01 -32.79 71.14 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 119.697 -1.877 . . . . 0.57999999999999996 113.687 171.489 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 48.8 t -55.01 -43.5 69.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 120.613 1.551 . . . . 1.05 109.673 174.195 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 48.2 mt -51.24 -55.49 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.197 0.599 . . . . 1.1799999999999999 110.32 171.924 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.53 -40.13 88.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 123.908 0.883 . . . . 0.60999999999999999 113.084 -177.11 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.3 -31.12 70.34 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.077 -1.014 . . . . 1.3600000000000001 111.541 176.752 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 41.5 t -73.56 -42.68 55.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.928 1.691 . . . . 0.78000000000000003 111.241 172.544 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 120' ' ' GLU . . . . . 0.444 ' CD ' ' HZ2' ' B' ' 124' ' ' LYS . 14.5 tm-20 -57.07 -50.48 72.64 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.606 1.162 . . . . 3.5499999999999998 111.66 173.939 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 121' ' ' ASN . . . . . 0.506 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 3.0 t30 -65.9 -10.77 41.61 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 114.162 1.171 . . . . 2.5099999999999998 114.162 -173.838 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -87.82 -63.91 1.23 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.386 1.474 . . . . 1.97 112.146 164.418 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -61.23 -29.94 70.14 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.693 0.997 . . . . 1.73 113.693 -165.683 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 124' ' ' LYS . . . . . 0.506 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 8.4 ptmt -50.67 -26.9 6.0 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 119.43 1.013 . . . . 1.95 113.508 173.697 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -93.35 5.57 51.11 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.23 1.812 . . . . 2.0600000000000001 114.726 -179.517 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 13.2 m . . . . . 0 N--CA 1.482 1.134 0 CA-C-N 119.97 1.259 . . . . 2.1699999999999999 110.971 173.977 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 14.4 pt . . . . . 0 N--CA 1.483 1.177 0 N-CA-C 114.14 1.163 . . . . 3.6600000000000001 114.14 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 73.5 m -74.63 139.7 43.79 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.378 -0.826 . . . . 2.6000000000000001 110.934 163.831 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -51.79 -24.78 6.44 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.59 1.556 . . . . 2.9199999999999999 114.736 -174.85 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 62.1 p -58.19 -23.65 56.32 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.735 1.383 . . . . 2.0899999999999999 114.735 171.649 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 61.1 m -74.35 -46.15 42.54 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.256 0.935 . . . . 1.6899999999999999 113.002 -179.407 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -53.23 -52.47 58.83 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.784 1.175 . . . . 2.0699999999999998 112.263 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -57.37 -10.65 1.45 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.714 1.005 . . . . 2.52 113.714 177.535 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -117.83 -27.6 6.17 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 120.182 1.355 . . . . 4.3099999999999996 114.387 177.584 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.7 tmm? -53.01 -35.83 59.83 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 119.704 1.138 . . . . 1.3899999999999999 111.375 161.732 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.29 -26.59 68.49 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.053 1.131 . . . . 1.46 114.053 170.307 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -92.14 -24.17 19.18 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 121.208 -0.932 . . . . 3.0 112.951 179.494 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.72 -67.37 0.83 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.17 0.895 . . . . 1.49 111.573 172.261 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -69.06 -29.17 67.24 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.378 1.251 . . . . 3.5299999999999998 114.378 -175.551 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.59 19.36 19.32 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.064 1.346 . . . . 1.71 113.762 -179.693 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -45.07 -38.31 4.89 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 117.647 2.462 . . . . 1.6499999999999999 117.647 -165.467 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 151' ' ' HIS . . . . . 0.487 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 0.0 OUTLIER -61.92 -28.57 69.62 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.118 2.167 . . . . 2.29 113.342 -178.407 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 40.6 tpp -77.94 -4.75 48.46 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.119 1.768 . . . . 1.9099999999999999 113.776 -174.11 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.79 177.21 7.07 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.136 1.375 . . . . 3.0600000000000001 112.95 -175.385 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 6.4 m -176.76 110.47 0.08 Allowed 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.567 2.347 . . . . 3.79 107.956 -176.668 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 155' ' ' ASP . . . . . 0.474 ' CB ' ' H ' ' B' ' 157' ' ' GLY . 21.1 t0 48.39 -175.57 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.299 0 CA-C-O 123.844 1.783 . . . . 4.96 109.992 -147.597 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 65.4 p -56.9 -14.88 3.9 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 120.097 -1.627 . . . . 3.7400000000000002 112.836 142.144 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 157' ' ' GLY . . . . . 0.474 ' H ' ' CB ' ' B' ' 155' ' ' ASP . . . -51.92 -38.43 46.35 Favored Glycine 0 N--CA 1.476 1.324 0 C-N-CA 126.906 2.193 . . . . 2.0899999999999999 113.547 -177.179 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -62.8 -58.85 5.98 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.89 1.276 . . . . 3.23 111.547 169.283 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -50.85 -43.79 59.37 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.698 1.599 . . . . 5.04 114.561 174.597 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 160' ' ' LYS . . . . . 0.454 ' HE2' ' HA2' ' B' ' 157' ' ' GLY . 34.1 mtmt -60.22 -19.01 52.56 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.681 1.992 . . . . 4.6200000000000001 115.281 178.745 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -66.33 -41.42 89.64 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.392 1.077 . . . . 1.71 112.041 167.777 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -61.25 -40.56 94.5 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.106 0.962 . . . . 0.90000000000000002 111.159 176.503 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -56.88 -39.71 74.87 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.73 1.212 . . . . 2.21 113.054 173.775 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -59.53 -34.25 72.4 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.332 -0.855 . . . . 3.9399999999999999 111.962 174.995 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 8.8 mt -69.8 -42.99 73.01 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 118.656 -0.688 . . . . 0.84999999999999998 112.03 174.07 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 35.3 mm -50.04 -53.86 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.889 0.768 . . . . 0.87 110.391 177.47 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -71.1 -38.22 72.38 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.059 1.344 . . . . 2.23 112.961 -176.313 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -54.02 -33.86 58.37 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.559 0.695 . . . . 2.6099999999999999 111.862 167.462 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 9.2 tp -93.59 -14.21 26.78 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 120.63 -1.294 . . . . 2.2599999999999998 113.964 -179.439 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -65.02 -16.59 63.62 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.573 0.749 . . . . 3.1000000000000001 112.978 171.815 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.23 -6.92 58.66 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.464 1.283 . . . . 2.48 114.464 165.086 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -142.97 27.56 1.62 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.182 1.393 . . . . 2.6699999999999999 114.294 -164.93 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -143.56 93.81 2.52 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 120.049 -1.657 . . . . 5.8799999999999999 111.621 -170.406 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -68.68 31.23 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 128.258 2.623 . . . . 5.7599999999999998 114.009 179.041 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.63 -11.93 6.59 Favored Glycine 0 CA--C 1.534 1.223 0 O-C-N 119.802 -1.811 . . . . 2.4900000000000002 114.999 178.905 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 35.2 mmt-85 -83.75 144.81 29.09 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.539 1.67 . . . . 6.7800000000000002 109.745 163.247 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 7.4 mm -93.79 135.29 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 106.97 -1.493 . . . . 2.77 106.97 163.653 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 18.5 m -98.18 159.07 15.17 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.256 1.422 . . . . 2.0499999999999998 110.941 166.685 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -62.97 -54.38 39.28 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.33 -1.482 . . . . 1.8300000000000001 112.311 -174.651 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -68.63 -14.02 62.74 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.64 1.976 . . . . 2.9700000000000002 113.301 -176.215 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -56.69 -54.06 50.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.159 1.784 . . . . 3.2200000000000002 111.168 174.137 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -57.19 -44.7 83.85 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 120.624 -1.297 . . . . 2.25 112.311 173.068 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -62.66 -43.25 99.28 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 121.985 -0.447 . . . . 0.59999999999999998 111.845 -178.028 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.9 t -75.3 -26.07 58.42 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 117.409 -1.281 . . . . 1.6499999999999999 112.496 175.927 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 54.0 mt -68.8 -41.12 79.14 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.677 1.58 . . . . 0.54000000000000004 112.395 171.948 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 21.9 mm -51.58 -36.72 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 CA-C-N 120.509 1.504 . . . . 0.62 112.417 177.612 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -57.28 -32.3 63.56 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 118.505 0.593 . . . . 0.65000000000000002 113.688 173.77 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -73.13 -19.24 79.56 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-N 118.793 1.296 . . . . 0.63 114.903 -179.785 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -98.21 -35.62 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 CA-C-N 119.019 1.409 . . . . 0.79000000000000004 111.147 167.839 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 68.6 m -75.1 -41.88 57.74 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.913 1.685 . . . . 2.7799999999999998 113.177 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -54.48 -42.58 76.01 Favored Glycine 0 CA--C 1.537 1.461 0 CA-C-O 118.086 -1.397 . . . . 1.1200000000000001 115.74 -174.672 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.09 -44.29 7.53 Favored 'Trans proline' 0 C--N 1.354 0.832 0 CA-C-N 121.0 2.4 . . . . 1.1399999999999999 112.444 174.374 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 35.0 pt -90.38 -24.7 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 115.607 1.706 . . . . 1.1299999999999999 115.607 -168.271 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -56.35 -36.16 68.46 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.767 1.227 . . . . 1.03 113.834 -171.072 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.0 ptpp? -57.62 -31.67 66.47 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.735 1.214 . . . . 5.6299999999999999 113.107 173.175 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.66 -30.11 25.12 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.454 1.502 . . . . 2.0899999999999999 110.947 179.115 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 65.0 mt -52.36 -52.81 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.183 0.993 . . . . 0.92000000000000004 110.508 172.207 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -46.79 -50.26 18.57 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 118.761 0.709 . . . . 3.5800000000000001 112.786 173.132 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -68.32 -12.99 61.94 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.813 1.245 . . . . 4.5499999999999998 113.657 -177.018 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -98.57 -30.34 12.55 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.461 1.504 . . . . 2.4100000000000001 113.58 170.683 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -68.18 -17.44 64.33 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 120.552 1.524 . . . . 2.3199999999999998 111.555 165.901 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -93.87 -54.87 3.44 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.18 -0.95 . . . . 2.0 111.787 174.084 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 . . . . . 0 N--CA 1.477 0.895 0 C-N-CA 129.115 2.966 . . . . 6.1100000000000003 116.043 176.583 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 . . . . . 0 N--CA 1.474 0.766 0 N-CA-C 108.586 -0.894 . . . . 2.1499999999999999 108.586 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 31.5 p -76.23 154.68 35.06 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.566 0.747 . . . . 0.97999999999999998 110.15 174.194 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -62.33 -31.76 72.42 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-O 118.818 -0.61 . . . . 2.46 111.897 178.14 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.68 -42.52 88.69 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 120.065 1.302 . . . . 0.79000000000000004 110.224 176.508 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -62.91 1.25 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.822 1.249 . . . . 2.8399999999999999 110.443 179.295 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -52.39 -33.87 45.44 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 114.404 1.261 . . . . 5.9000000000000004 114.404 172.971 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.88 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -67.24 -49.01 66.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 119.938 1.245 . . . . 0.48999999999999999 111.808 173.008 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 52.8 t -57.22 -35.08 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 120.017 1.28 . . . . 0.82999999999999996 110.439 173.641 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.6 mt -59.65 -47.64 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 O-C-N 121.483 -0.761 . . . . 1.0800000000000001 112.305 168.209 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.3 t -64.61 -34.65 71.17 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 CA-C-N 120.279 1.399 . . . . 0.78000000000000003 113.414 175.006 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -63.23 -41.81 99.15 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 120.636 -1.29 . . . . 0.93000000000000005 111.04 171.643 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.2 t -62.56 -40.19 87.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 123.774 0.83 . . . . 0.57999999999999996 110.881 173.689 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -66.04 -36.64 83.8 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.644 1.111 . . . . 3.1299999999999999 113.129 173.609 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.428 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 36.1 t30 -62.11 -23.07 66.32 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.756 1.162 . . . . 2.0099999999999998 113.556 -177.883 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -81.91 -50.19 9.46 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.037 1.335 . . . . 1.95 112.797 171.213 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -75.74 -16.44 60.14 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.667 1.358 . . . . 2.27 114.667 -174.019 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 18' ' ' ASN . 5.4 ptmt -66.87 -25.66 66.51 Favored 'General case' 0 CA--C 1.553 1.059 0 O-C-N 120.218 -1.552 . . . . 2.6899999999999999 112.116 161.075 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -97.89 -36.25 10.23 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 115.277 1.584 . . . . 3.1000000000000001 115.277 -178.018 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.486 1.331 0 CA-C-N 120.509 1.504 . . . . 3.9300000000000002 112.238 172.23 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.0 tt . . . . . 0 CA--C 1.541 0.629 0 N-CA-C 109.296 -0.631 . . . . 3.4399999999999999 109.296 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.2 m -143.04 168.6 19.34 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.507 -1.371 . . . . 2.6200000000000001 109.245 159.08 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -59.26 -34.95 72.86 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.274 -1.516 . . . . 2.5600000000000001 112.048 -173.237 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 p -57.21 -21.28 32.42 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.358 1.863 . . . . 1.8400000000000001 114.57 171.823 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 m -74.65 -39.8 61.84 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.19 -0.944 . . . . 1.71 112.395 171.275 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.421 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 71.7 t80 -58.27 -49.72 76.12 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.742 1.155 . . . . 2.1200000000000001 113.066 -175.36 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -53.18 -23.02 7.43 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.001 0.92 . . . . 2.8399999999999999 112.874 172.918 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -99.68 -45.82 5.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.931 1.693 . . . . 3.54 113.244 -170.271 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 16.7 ptm -52.53 -37.16 56.99 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.979 0.809 . . . . 3.3999999999999999 110.444 161.154 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.8 mt -58.72 -64.17 1.03 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.954 0.902 . . . . 1.4299999999999999 111.865 167.306 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -70.0 -12.17 61.42 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.585 1.538 . . . . 3.0499999999999998 115.12 -173.458 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.1 -49.21 6.32 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.506 1.048 . . . . 1.75 112.419 170.616 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -80.97 -36.48 30.78 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 120.06 1.3 . . . . 2.7200000000000002 112.529 -175.091 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.8 mt -103.81 27.32 7.65 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.957 1.303 . . . . 2.1099999999999999 112.666 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -58.5 -16.77 16.76 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 115.766 1.765 . . . . 1.54 115.766 -169.407 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.12 -36.15 15.0 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 119.517 1.053 . . . . 1.79 113.089 174.858 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.8 ttm -71.31 -22.27 61.95 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.909 1.284 . . . . 3.04 112.292 176.316 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.9 mp -61.9 90.35 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 123.528 1.632 . . . . 2.4900000000000002 111.046 171.114 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.6 m -74.39 75.77 1.9 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 113.535 -1.666 . . . . 4.5499999999999998 109.701 173.818 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.9 t70 71.77 169.89 0.32 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 128.312 2.645 . . . . 4.04 112.999 -176.064 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m -30.77 -45.86 0.07 Allowed 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 127.376 2.27 . . . . 2.3399999999999999 111.989 150.062 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.56 -50.17 54.43 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.433 1.492 . . . . 1.6899999999999999 113.654 177.223 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -62.65 -41.67 99.18 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.794 1.297 . . . . 3.5 112.001 172.208 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 44.2 ttt-85 -57.01 -40.49 76.74 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.735 0.698 . . . . 5.2599999999999998 112.521 173.729 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.29 -19.06 64.25 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 120.443 1.474 . . . . 3.5899999999999999 113.609 176.164 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.494 ' HA ' ' HG2' ' A' ' 61' ' ' LYS . . . -79.09 -17.61 54.84 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.127 1.158 . . . . 1.05 114.127 170.999 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.29 -53.11 9.31 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.481 1.112 . . . . 0.78000000000000003 110.525 160.559 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -57.01 -35.77 69.63 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.086 0.954 . . . . 2.2999999999999998 112.923 -176.451 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.494 ' HG2' ' HA ' ' A' ' 58' ' ' ALA . 2.9 ptmm? -57.59 -23.83 52.98 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 120.377 -1.452 . . . . 3.9399999999999999 114.763 171.654 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.2 mt -82.84 -37.05 24.92 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.465 -0.772 . . . . 1.5600000000000001 112.308 174.676 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.2 mm -52.53 -51.56 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.766 1.226 . . . . 0.97999999999999998 110.823 -178.326 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -55.14 -48.93 73.0 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 122.176 0.988 . . . . 3.0600000000000001 112.359 177.426 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 -66.01 -21.19 66.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.744 1.218 . . . . 3.1099999999999999 113.316 -178.691 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.47 -34.9 14.63 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.849 0.75 . . . . 2.1299999999999999 112.533 178.428 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -61.88 -25.36 67.5 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.3 -0.875 . . . . 3.23 112.511 164.695 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.67 -14.01 62.3 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 114.484 1.29 . . . . 2.0600000000000001 114.484 167.251 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -123.91 -19.47 5.68 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 116.119 1.896 . . . . 2.5899999999999999 116.119 -173.411 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.93 127.02 22.49 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.08 1.763 . . . . 3.6400000000000001 112.435 -171.488 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -85.91 -7.66 58.54 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.804 1.409 . . . . 4.6600000000000001 114.804 -169.353 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 130.8 -13.65 5.55 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 124.762 1.172 . . . . 2.52 113.628 -163.116 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.5 mmt-85 -76.61 147.03 37.86 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.244 1.522 . . . . 4.9100000000000001 109.467 153.273 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 37.4 mm -133.22 146.2 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 127.458 2.303 . . . . 2.3100000000000001 107.317 -178.307 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 10.6 m -109.44 151.52 26.58 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 118.977 0.808 . . . . 1.7 110.289 173.809 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -55.72 -40.46 72.46 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-O 122.658 1.218 . . . . 2.0600000000000001 111.137 172.918 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.8 -32.2 65.45 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 129.772 3.229 . . . . 3.0499999999999998 112.782 178.688 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -54.76 9.76 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.395 1.478 . . . . 3.25 110.0 -170.4 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -52.77 -43.46 65.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.092 0.557 . . . . 1.9299999999999999 112.028 174.169 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.7 t-105 -63.26 -48.14 79.44 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.709 -0.62 . . . . 0.87 111.375 177.532 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 88.5 m -58.37 -37.45 75.24 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.501 1.921 . . . . 2.2799999999999998 111.694 176.453 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.421 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 75.2 mt -62.14 -50.5 71.64 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 118.25 -0.881 . . . . 1.02 111.955 174.114 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.0 mm -52.62 -41.84 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 CA-C-N 120.215 1.37 . . . . 0.94999999999999996 113.441 -173.591 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.28 -19.46 59.66 Favored Glycine 0 N--CA 1.475 1.282 0 C-N-CA 123.637 0.637 . . . . 0.97999999999999998 113.499 177.993 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.0 -11.63 85.4 Favored Glycine 0 CA--C 1.534 1.252 0 CA-C-O 117.85 -1.528 . . . . 1.1399999999999999 114.993 173.979 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.3 -45.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 119.796 1.798 . . . . 1.3899999999999999 111.036 175.939 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 40.6 m -76.28 87.19 3.09 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 105.997 -1.853 . . . . 1.4299999999999999 105.997 172.688 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -160.4 -77.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.916 0 CA-C-O 118.038 -1.423 . . . . 0.97999999999999998 112.549 -167.762 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -61.57 -33.37 87.27 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 122.856 2.371 . . . . 1.1399999999999999 112.311 175.263 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.3 pt -75.85 -16.9 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 114.047 1.128 . . . . 1.1899999999999999 114.047 173.885 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.12 -65.05 0.63 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.997 1.271 . . . . 1.76 112.958 -169.47 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp -55.2 -40.75 71.13 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.349 -0.845 . . . . 3.3399999999999999 113.185 178.0 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.69 -38.27 74.89 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.648 0.779 . . . . 1.3899999999999999 111.216 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 51.2 mt -54.93 -62.43 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 118.973 0.806 . . . . 1.3799999999999999 111.111 171.117 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -57.11 -27.98 62.26 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.299 0.852 . . . . 1.7 113.299 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -81.36 -25.89 35.98 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.048 -1.033 . . . . 2.8999999999999999 112.261 177.605 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -74.96 -33.49 61.92 Favored 'General case' 0 C--O 1.227 -0.086 0 N-CA-C 113.776 1.028 . . . . 2.1800000000000002 113.776 178.783 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -70.47 6.69 1.29 Allowed 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 123.305 1.526 . . . . 2.3399999999999999 112.031 172.151 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 N--CA 1.466 0.365 0 C-N-CA 126.416 1.887 . . . . 2.3199999999999998 110.306 170.599 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 . . . . . 0 CA--C 1.55 0.976 0 N-CA-C 114.238 1.199 . . . . 2.3100000000000001 114.238 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.4 p -85.27 159.79 19.99 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.575 -0.703 . . . . 1.0700000000000001 109.311 160.42 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -59.61 -45.06 93.05 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.599 -0.715 . . . . 2.79 111.657 174.505 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.59 -43.04 75.63 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.581 1.082 . . . . 1.03 111.211 -174.46 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -56.75 7.6 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.993 0.517 . . . . 2.77 110.239 -177.381 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -50.2 -37.61 36.05 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.755 1.222 . . . . 5.2400000000000002 112.268 172.103 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.88 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.35 -44.67 74.76 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 120.37 -1.456 . . . . 0.51000000000000001 113.51 172.588 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 79.6 t -61.72 -34.53 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 CA-C-N 121.009 1.731 . . . . 0.77000000000000002 111.017 172.399 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 44.4 mt -56.03 -52.48 49.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.681 1.128 . . . . 0.76000000000000001 110.913 165.154 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 9.3 t -58.03 -41.37 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 119.407 1.003 . . . . 0.56999999999999995 112.657 178.569 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.37 -39.36 94.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.02 0.928 . . . . 0.98999999999999999 112.298 175.007 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 99.2 t -70.93 -44.86 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-O 118.455 -0.783 . . . . 0.56999999999999995 110.895 177.873 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -61.24 -39.2 89.44 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.552 1.069 . . . . 4.2000000000000002 112.042 178.625 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 121' ' ' ASN . . . . . 0.515 HD21 ' HG3' ' B' ' 148' ' ' GLU . 6.9 t30 -67.51 -14.85 63.3 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.523 1.305 . . . . 2.3500000000000001 114.523 -177.469 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -102.11 -40.18 6.94 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.55 1.54 . . . . 2.4199999999999999 113.155 174.881 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -68.69 -26.08 65.11 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 120.862 -1.149 . . . . 2.0800000000000001 112.827 175.874 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 42.2 pttt -59.23 -34.78 72.61 Favored 'General case' 0 CA--C 1.551 0.994 0 O-C-N 119.444 -2.035 . . . . 2.4399999999999999 112.248 164.298 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -81.86 -33.46 30.6 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 116.993 -1.479 . . . . 2.5600000000000001 114.876 178.95 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 9.6 p . . . . . 0 N--CA 1.483 1.191 0 CA-C-N 120.573 1.533 . . . . 3.8799999999999999 113.162 176.576 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 5.3 tt . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 109.334 -0.617 . . . . 3.27 109.334 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 74.2 m -142.55 163.53 32.59 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.049 1.74 . . . . 2.6699999999999999 108.722 155.992 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 38.4 mmtm -56.15 -32.6 64.44 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.523 -1.36 . . . . 2.8700000000000001 112.699 -174.219 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 9.1 p -56.7 -23.0 39.14 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.032 1.733 . . . . 1.9199999999999999 113.854 174.497 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 6.0 m -76.56 -26.61 55.29 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.882 -1.137 . . . . 1.4099999999999999 113.159 173.518 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -65.17 -53.51 43.82 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.73 1.605 . . . . 1.9199999999999999 111.656 -179.212 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 6.3 ptt180 -52.14 -25.26 8.51 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.581 1.152 . . . . 2.5499999999999998 112.622 176.128 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.27 -45.08 7.31 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.269 1.827 . . . . 3.48 112.077 -173.115 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.3 tmm? -49.95 -44.08 50.41 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.13 0.972 . . . . 1.6000000000000001 110.232 162.283 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.9 mt -55.01 -63.62 1.1 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.666 1.587 . . . . 1.49 111.967 166.945 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -68.56 -15.16 63.44 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 115.338 1.607 . . . . 2.96 115.338 -174.931 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.92 -48.12 7.43 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.462 1.028 . . . . 1.6899999999999999 112.331 172.362 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.515 ' HG3' HD21 ' B' ' 121' ' ' ASN . 50.6 mm-40 -87.36 -33.88 19.0 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.68 1.127 . . . . 2.79 113.043 -172.861 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.5 mt -101.62 27.38 6.42 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.899 1.28 . . . . 2.2000000000000002 112.317 176.22 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -60.76 -12.59 11.1 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 116.166 1.913 . . . . 1.4399999999999999 116.166 -169.662 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -92.1 -59.77 2.02 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.606 1.162 . . . . 1.4299999999999999 111.587 -175.281 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 27.7 ttp -61.44 -13.58 21.56 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 114.917 1.451 . . . . 1.79 114.917 169.315 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.9 tp -58.39 91.44 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.726 1.61 . . . . 2.4300000000000002 110.185 176.306 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 63.7 m -82.92 70.22 9.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.489 1.116 . . . . 4.5700000000000003 110.879 -167.571 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 25.9 t70 74.62 167.22 0.29 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 128.316 2.646 . . . . 4.1500000000000004 112.695 -175.159 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -27.6 -47.34 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.4 0 C-N-CA 127.792 2.437 . . . . 2.6099999999999999 112.697 151.549 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.06 -52.42 52.94 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-N 120.232 1.378 . . . . 1.8999999999999999 113.756 -178.977 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.19 -38.8 80.74 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.913 0.885 . . . . 3.1000000000000001 111.325 173.818 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.2 ttt-85 -62.06 -45.87 91.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.719 0.808 . . . . 4.5999999999999996 113.099 172.444 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -21.72 66.05 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 120.024 -1.672 . . . . 3.7599999999999998 113.182 -177.709 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -61.3 -28.79 69.45 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 117.325 -1.322 . . . . 1.3600000000000001 113.476 167.783 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.27 73.18 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.199 1.0 . . . . 1.1200000000000001 111.484 167.089 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -62.88 -32.78 74.1 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.656 0.783 . . . . 2.1200000000000001 111.944 -175.057 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt -47.17 -42.25 19.34 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 122.402 1.096 . . . . 2.5600000000000001 113.663 166.845 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 165' ' ' LEU . . . . . 0.441 HD11 ' HA3' ' B' ' 188' ' ' GLY . 5.5 mt -78.67 -42.2 29.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 113.973 -1.467 . . . . 1.1399999999999999 110.551 -174.41 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.9 mm -46.48 -56.85 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.302 1.441 . . . . 1.3 111.67 175.08 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -58.76 -40.73 84.74 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.592 1.187 . . . . 3.0800000000000001 112.47 -177.145 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -77.24 -18.46 57.62 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.131 1.372 . . . . 3.4700000000000002 112.455 -175.776 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.57 -36.24 15.43 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.781 0.833 . . . . 2.4199999999999999 112.329 173.288 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -58.88 -35.99 73.91 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.3 0.955 . . . . 3.77 111.946 166.761 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -60.1 -15.97 27.95 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.846 1.424 . . . . 2.27 114.846 169.906 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -120.5 -14.53 8.66 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 115.573 1.694 . . . . 2.6899999999999999 115.573 -176.254 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -138.89 108.13 6.09 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.777 1.626 . . . . 3.8500000000000001 112.407 -166.73 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -76.77 56.15 1.14 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 128.357 2.663 . . . . 4.29 112.484 -169.501 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 67.87 -14.14 0.61 Allowed Glycine 0 N--CA 1.479 1.563 0 O-C-N 119.854 -1.779 . . . . 2.4900000000000002 114.145 -171.388 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.9 mmt-85 -73.1 141.89 47.54 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.83 1.652 . . . . 5.0499999999999998 107.726 164.797 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 40.6 mm -126.32 141.81 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.078 1.351 . . . . 2.3199999999999998 108.812 -168.879 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 70.8 m -99.74 155.13 17.79 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 117.891 0.314 . . . . 1.8100000000000001 111.68 173.839 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -63.32 -50.47 69.9 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.943 -1.098 . . . . 2.4100000000000001 110.509 172.585 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -70.19 -6.45 34.56 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.668 1.187 . . . . 4.46 113.203 -178.066 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -59.3 -57.78 11.53 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.196 0.998 . . . . 3.1499999999999999 109.937 171.551 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -52.11 -48.79 64.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.545 0.738 . . . . 2.1699999999999999 112.035 176.378 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 21.0 t-105 -59.0 -49.82 76.45 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 119.244 -0.407 . . . . 0.83999999999999997 111.729 178.979 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.5 m -55.32 -43.61 75.06 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.75 1.62 . . . . 1.76 111.865 174.611 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 48.9 mt -69.36 -38.37 78.06 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 118.177 -0.915 . . . . 0.75 113.271 179.745 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 30.2 mm -56.79 -41.34 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 120.542 1.519 . . . . 0.63 111.662 178.26 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.74 -18.8 57.43 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-O 119.365 -0.686 . . . . 0.70999999999999996 114.174 -179.258 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 188' ' ' GLY . . . . . 0.441 ' HA3' HD11 ' B' ' 165' ' ' LEU . . . -80.8 -11.7 83.6 Favored Glycine 0 CA--C 1.535 1.334 0 CA-C-N 118.866 1.333 . . . . 0.68000000000000005 114.076 175.133 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.7 mp -108.54 -45.04 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.657 1.183 . . . . 0.87 110.325 171.946 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 23.6 m -80.57 77.51 7.37 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 125.17 1.388 . . . . 1.3400000000000001 107.982 176.292 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -158.44 -74.39 0.02 OUTLIER Glycine 0 CA--C 1.53 1.03 0 C-N-CA 125.502 1.525 . . . . 0.81999999999999995 112.019 -172.084 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -63.11 -34.81 68.03 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.004 2.469 . . . . 1.0800000000000001 113.418 177.851 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.9 pt -83.67 -6.92 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 114.035 1.124 . . . . 0.91000000000000003 114.035 174.722 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -50.07 -55.26 15.58 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.093 1.357 . . . . 1.5700000000000001 113.919 -172.758 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 mtpp -66.51 -39.63 88.77 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-O 116.987 -1.483 . . . . 5.3700000000000001 112.86 174.336 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.5 tt -50.29 -41.81 51.39 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 120.783 1.629 . . . . 1.75 111.675 177.896 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 85.1 mt -52.15 -54.99 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.351 1.06 . . . . 1.1000000000000001 112.432 169.028 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 57.8 t60 -73.33 -20.15 60.86 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.454 0.909 . . . . 2.23 113.454 -178.067 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.07 -44.29 69.41 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.923 0.889 . . . . 3.7400000000000002 109.487 168.09 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -60.64 -44.07 96.81 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.755 1.222 . . . . 2.3300000000000001 113.387 -176.277 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -70.69 1.46 5.3 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 122.529 1.157 . . . . 2.5600000000000001 112.825 -179.235 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -116.21 -53.5 2.54 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 120.725 -1.234 . . . . 2.6499999999999999 109.755 175.38 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.683 0 CA-C-N 114.598 -1.183 . . . . 4.1200000000000001 114.167 178.604 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 . . . . . 0 N--CA 1.472 0.657 0 CA-C-O 118.893 -0.575 . . . . 2.25 109.605 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.6 p -62.37 151.82 35.79 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.511 1.05 . . . . 0.96999999999999997 109.521 174.73 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -58.87 -49.61 77.13 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.876 0.735 . . . . 2.4900000000000002 109.169 177.717 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -43.92 -49.47 8.42 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.381 1.873 . . . . 1.0600000000000001 111.499 176.331 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -56.53 4.93 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.875 -0.516 . . . . 3.0299999999999998 111.807 -171.089 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.41 ' HA ' ' HB ' ' A' ' 13' ' ' ILE . 28.8 mmtt -59.15 -22.16 60.49 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.856 -1.153 . . . . 6.9199999999999999 113.455 170.163 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.907 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.06 -46.35 68.06 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 120.566 -1.334 . . . . 0.47999999999999998 112.181 168.105 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 96.5 t -59.58 -39.85 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 121.081 1.764 . . . . 0.89000000000000001 110.318 170.596 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.41 ' HB ' ' HA ' ' A' ' 10' ' ' LYS . 1.1 mt -55.47 -47.07 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 118.558 -0.734 . . . . 1.49 111.344 169.358 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.55 -37.64 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.137 1.375 . . . . 0.57999999999999996 112.753 175.978 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.43 -37.29 86.73 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.8 1.182 . . . . 0.93000000000000005 111.009 172.67 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 74.2 t -72.04 -40.9 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.833 0.853 . . . . 0.68000000000000005 110.697 174.661 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -55.51 -60.1 3.89 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.72 1.146 . . . . 3.04 110.709 172.325 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.514 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -63.85 -30.6 71.67 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.151 0.797 . . . . 2.9100000000000001 113.151 -170.101 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -67.98 -60.64 2.35 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.589 0.755 . . . . 2.0699999999999998 110.951 169.815 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -60.97 -26.12 67.33 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 118.146 -0.93 . . . . 2.1000000000000001 112.388 -176.158 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.514 ' HE2' ' HA ' ' A' ' 18' ' ' ASN . 10.7 ttmm -43.88 -42.17 5.59 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.805 2.042 . . . . 2.2400000000000002 112.81 167.596 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -82.69 -19.0 38.92 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.014 1.116 . . . . 2.96 114.014 178.315 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.7 t . . . . . 0 N--CA 1.481 1.106 0 C-N-CA 126.57 1.948 . . . . 2.48 110.387 -179.101 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.8 tt . . . . . 0 N--CA 1.472 0.64 0 N-CA-C 107.578 -1.267 . . . . 2.3999999999999999 107.578 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 t -147.84 -175.63 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 122.036 0.922 . . . . 4.0899999999999999 110.84 167.897 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -29.36 24.4 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.651 2.38 . . . . 2.0 114.498 -176.188 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.5 p -61.18 -26.27 67.6 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.157 1.383 . . . . 2.25 114.349 172.515 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.4 m -91.3 -40.9 11.23 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.316 1.228 . . . . 1.28 114.316 -175.932 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.418 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 42.5 t80 -54.82 -52.22 63.38 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.217 0.917 . . . . 2.1000000000000001 113.226 -167.06 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -54.37 -30.74 52.84 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.594 1.558 . . . . 2.9700000000000002 113.862 173.529 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -87.76 -50.83 6.21 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.574 1.149 . . . . 3.1099999999999999 109.782 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -47.49 -45.16 26.03 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.627 1.171 . . . . 1.5900000000000001 111.915 167.437 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 mt -54.85 -31.2 59.23 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.497 1.295 . . . . 1.1899999999999999 114.497 177.383 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.431 ' HB2' ' HE ' ' A' ' 56' ' ' ARG . 0.9 OUTLIER -87.97 -4.11 58.84 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 120.168 1.349 . . . . 2.2599999999999998 113.651 178.133 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.14 -43.68 7.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.004 1.321 . . . . 1.5900000000000001 111.373 168.243 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.465 ' OE2' ' HE3' ' A' ' 21' ' ' LYS . 7.4 mm-40 -97.71 -25.79 14.97 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.487 0.921 . . . . 2.9399999999999999 113.487 -166.231 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.63 34.71 5.08 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.211 1.404 . . . . 1.8899999999999999 110.621 -176.984 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -83.66 -5.95 59.32 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 117.243 2.312 . . . . 1.4199999999999999 117.243 -149.052 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -94.16 -50.27 5.36 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 120.223 1.374 . . . . 1.8100000000000001 109.93 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.9 tpp -46.46 -40.57 12.54 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.58 1.952 . . . . 1.96 112.527 164.751 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -84.59 91.29 7.86 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-O 122.834 1.302 . . . . 3.2999999999999998 110.159 177.297 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.9 t -91.04 -90.69 0.15 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.445 -1.252 . . . . 3.9900000000000002 109.926 -176.137 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -72.65 156.51 38.9 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.604 1.161 . . . . 3.8999999999999999 113.682 -178.452 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.7 m -63.87 -30.0 71.13 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.322 1.449 . . . . 2.6400000000000001 111.667 171.494 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.11 -37.7 92.03 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.296 1.427 . . . . 2.1699999999999999 112.525 168.066 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.34 -36.19 74.08 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.044 0.922 . . . . 3.5699999999999998 111.601 171.241 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.431 ' HE ' ' HB2' ' A' ' 43' ' ' GLN . 48.1 mtt85 -65.73 -24.26 66.93 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.509 0.929 . . . . 7.0499999999999998 113.509 176.169 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt -59.07 -17.21 23.82 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.868 -1.145 . . . . 4.21 113.725 166.121 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.47 -19.2 53.61 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.267 1.58 . . . . 1.3600000000000001 115.267 169.2 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.17 -55.29 4.84 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.739 1.216 . . . . 0.93999999999999995 110.422 163.565 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -64.08 -28.89 70.09 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 113.996 1.109 . . . . 2.77 113.996 -176.962 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.3 ptmm? -53.02 -33.58 52.39 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 120.074 1.306 . . . . 3.6000000000000001 112.596 167.688 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.5 mt -77.16 -41.43 41.74 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 122.138 -0.351 . . . . 0.92000000000000004 111.459 -179.839 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.3 mm -53.3 -56.12 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 C-N-CA 124.102 0.961 . . . . 1.1599999999999999 110.191 -179.827 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -57.44 -40.43 78.42 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.7 0.8 . . . . 1.8799999999999999 112.906 -179.018 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -64.34 -38.92 92.75 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 112.935 0.717 . . . . 4.0099999999999998 112.935 175.804 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.42 -38.92 16.87 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.412 0.685 . . . . 2.3399999999999999 111.962 -173.074 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.5 -22.52 66.18 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.829 0.851 . . . . 2.9199999999999999 112.826 177.137 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.37 -17.31 61.83 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.314 1.227 . . . . 2.8399999999999999 114.314 168.503 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -128.63 -8.93 5.08 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 115.158 1.54 . . . . 3.3500000000000001 115.158 -166.545 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -137.87 107.68 6.28 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.489 1.495 . . . . 4.25 111.929 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.0 p-10 -78.6 77.23 5.09 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.482 1.513 . . . . 4.0899999999999999 112.423 -174.714 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.86 10.7 77.52 Favored Glycine 0 N--CA 1.476 1.332 0 C-N-CA 124.117 0.865 . . . . 2.5499999999999998 114.587 175.197 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -64.87 153.64 39.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.557 1.543 . . . . 5.79 111.921 179.132 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -140.65 86.57 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 124.819 1.247 . . . . 4.2800000000000002 107.883 175.573 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.7 t -89.66 149.63 22.71 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 125.296 1.438 . . . . 1.5900000000000001 112.085 169.6 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -58.27 -41.51 84.48 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.756 -0.59 . . . . 2.7799999999999998 111.907 169.536 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -79.04 -23.2 44.43 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.084 0.772 . . . . 4.0999999999999996 113.084 -174.269 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -54.83 -59.04 5.26 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.262 -1.014 . . . . 3.4199999999999999 108.262 167.08 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -55.45 -43.78 75.75 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.234 -0.916 . . . . 3.02 113.006 179.57 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -65.76 -49.26 69.02 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.304 -0.873 . . . . 1.0600000000000001 112.957 -178.861 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 4.6 t -67.97 -25.65 65.54 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.114 0.87 . . . . 2.0299999999999998 112.498 178.379 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 89.5 mt -65.51 -49.61 68.32 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.277 -0.868 . . . . 0.67000000000000004 111.362 171.541 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 34.4 mm -54.85 -40.34 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 CA-C-N 120.561 1.528 . . . . 0.58999999999999997 113.538 -177.553 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.69 -28.24 71.23 Favored Glycine 0 CA--C 1.529 0.939 0 CA-C-O 119.477 -0.624 . . . . 0.65000000000000002 112.751 175.048 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.05 -14.66 74.36 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-O 117.63 -1.65 . . . . 0.83999999999999997 116.535 -174.683 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.4 mp -87.33 -31.36 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-N 119.637 1.719 . . . . 1.0800000000000001 110.795 163.193 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.1 m -71.55 168.92 16.56 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.195 1.798 . . . . 3.3399999999999999 108.712 176.342 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.69 -73.07 0.3 Allowed Glycine 0 CA--C 1.531 1.078 0 CA-C-O 117.821 -1.544 . . . . 1.3899999999999999 113.03 179.763 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -63.72 -43.64 16.05 Favored 'Trans proline' 0 C--N 1.351 0.666 0 CA-C-N 120.539 2.169 . . . . 1.4299999999999999 110.138 174.584 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.1 pt -67.43 -22.55 28.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 113.62 0.97 . . . . 1.3999999999999999 113.62 170.875 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.437 ' HA ' HD12 ' A' ' 94' ' ' ILE . . . -57.73 -55.7 31.53 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.976 1.262 . . . . 1.48 112.7 -171.79 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -29.3 70.23 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.831 -1.168 . . . . 3.8999999999999999 112.389 176.712 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.44 -41.45 72.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.343 1.457 . . . . 1.3600000000000001 110.572 -177.195 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.437 HD12 ' HA ' ' A' ' 91' ' ' ALA . 62.9 mt -48.98 -60.17 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 1.1899999999999999 109.585 165.256 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -55.9 -44.66 78.45 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-O 118.38 -0.819 . . . . 1.98 111.7 -177.978 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -55.36 -43.08 74.74 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.137 1.335 . . . . 4.1299999999999999 112.805 173.483 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 24.2 mm100 -79.26 -30.54 43.11 Favored 'General case' 0 CA--C 1.527 0.079 0 N-CA-C 113.95 1.092 . . . . 2.7000000000000002 113.95 -172.553 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -71.89 -32.92 67.91 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.873 1.215 . . . . 2.4300000000000002 111.15 170.317 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.482 1.13 0 O-C-N 121.132 -0.98 . . . . 2.6200000000000001 110.674 173.778 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 . . . . . 0 CA--C 1.537 0.474 0 CA-C-O 118.722 -0.656 . . . . 2.3599999999999999 109.505 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 26.9 p -61.8 147.65 45.7 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.234 0.925 . . . . 1.0600000000000001 109.703 171.641 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.44 -48.09 72.11 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.772 -0.633 . . . . 2.8799999999999999 110.348 173.612 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -47.92 -49.91 28.58 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.797 1.639 . . . . 0.72999999999999998 111.976 177.183 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.42 -54.23 8.8 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.422 -0.799 . . . . 2.98 111.091 -171.727 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 28.0 mmtt -56.36 -24.79 46.47 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.883 -1.135 . . . . 7.4500000000000002 113.48 169.064 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.907 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.86 -45.27 75.05 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.652 -1.28 . . . . 0.53000000000000003 112.62 168.027 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 93.7 t -57.66 -38.08 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 CA-C-N 120.834 1.652 . . . . 0.77000000000000002 110.468 169.117 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 2.3 mt -59.71 -49.49 83.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 121.481 -0.762 . . . . 1.4099999999999999 112.23 170.031 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.9 t -60.81 -38.8 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.777 1.631 . . . . 0.56999999999999995 112.256 178.472 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.79 -40.47 97.42 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.401 1.0 . . . . 0.98999999999999999 111.048 172.438 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 66.8 t -66.67 -41.35 88.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-O 117.467 -1.254 . . . . 0.68999999999999995 110.957 177.156 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -67.56 -39.41 84.93 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 121.185 1.811 . . . . 4.4400000000000004 113.982 169.399 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -61.55 -24.39 66.6 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.35 -1.469 . . . . 3.4900000000000002 113.162 177.216 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -81.01 -66.19 0.92 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.736 1.214 . . . . 1.8799999999999999 112.559 164.345 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -60.29 -31.39 70.21 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 118.195 -0.907 . . . . 2.1099999999999999 112.774 -167.862 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -52.24 -31.72 33.63 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.278 1.399 . . . . 2.3399999999999999 113.4 175.034 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -82.66 -16.56 47.8 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.803 -1.185 . . . . 2.23 113.605 177.213 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 25.6 t . . . . . 0 N--CA 1.475 0.801 0 C-N-CA 127.105 2.162 . . . . 2.5600000000000001 108.976 -176.981 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 10.2 tt . . . . . 0 N--CA 1.467 0.38 0 N-CA-C 107.316 -1.365 . . . . 2.29 107.316 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 9.1 t -148.43 -175.19 4.82 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 122.759 1.266 . . . . 4.0899999999999999 111.157 171.229 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.17 -35.69 27.26 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.981 2.912 . . . . 2.0099999999999998 114.349 -177.824 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 26.8 p -58.83 -26.47 64.19 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.089 1.356 . . . . 2.0299999999999998 114.409 173.821 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 19.3 m -91.53 -40.33 11.42 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.394 1.078 . . . . 1.3400000000000001 113.756 -178.848 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 53.4 t80 -55.45 -51.59 66.41 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.789 1.177 . . . . 2.1600000000000001 113.473 -166.476 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.35 -32.29 48.47 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.202 1.401 . . . . 2.8300000000000001 114.024 171.28 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -84.06 -52.49 6.26 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.021 1.328 . . . . 3.02 109.459 -173.183 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 13.9 tmm? -44.96 -45.08 10.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.138 1.775 . . . . 1.52 112.395 165.501 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.2 mt -58.86 -27.91 65.59 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.614 1.166 . . . . 1.21 114.112 179.622 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -92.53 3.84 54.73 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.894 1.225 . . . . 2.1600000000000001 113.862 173.191 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -44.44 5.84 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.044 0.938 . . . . 1.49 111.614 165.605 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.01 -18.59 19.32 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 113.735 1.013 . . . . 2.8799999999999999 113.735 -170.935 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.85 26.77 8.03 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.311 1.845 . . . . 1.8300000000000001 111.574 -179.365 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -71.93 1.93 6.38 Favored 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 117.832 2.531 . . . . 1.4399999999999999 117.832 -157.94 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -99.64 -57.82 2.06 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.701 1.201 . . . . 1.8799999999999999 110.007 178.025 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 152' ' ' MET . . . . . 0.441 ' SD ' HD12 ' B' ' 193' ' ' ILE . 8.1 ttp -65.36 -27.65 68.73 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.28 1.032 . . . . 2.0499999999999998 113.058 168.223 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 6.1 mp -98.53 82.04 2.8 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.799 1.182 . . . . 4.1399999999999997 110.871 157.445 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 6.3 t -104.52 -64.06 1.15 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.892 2.077 . . . . 4.7699999999999996 110.785 178.345 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -72.57 140.93 48.38 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.15 0.98 . . . . 4.25 112.433 176.58 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 77.0 m -71.91 -26.09 62.17 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.572 1.949 . . . . 3.1099999999999999 112.72 175.98 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -61.61 -45.69 95.8 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-N 119.222 0.919 . . . . 2.0600000000000001 111.064 165.927 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.14 -37.41 82.74 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.796 0.839 . . . . 3.5499999999999998 111.739 169.598 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 -64.81 -25.56 67.96 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.779 1.172 . . . . 7.3600000000000003 113.642 177.881 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.7 mtmt -58.63 -17.78 25.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.141 1.337 . . . . 4.3200000000000003 113.465 167.739 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.6 -19.13 56.07 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 115.315 1.598 . . . . 1.54 115.315 168.511 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.82 -55.71 4.79 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.207 1.003 . . . . 1.0800000000000001 110.382 163.136 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -64.6 -28.96 69.98 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.734 1.013 . . . . 2.98 113.734 -175.425 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 5.5 ptmm? -52.53 -32.97 43.26 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 119.654 1.115 . . . . 3.8700000000000001 112.412 168.722 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 48.8 mt -76.96 -42.44 39.08 Favored 'General case' 0 C--O 1.224 -0.265 0 O-C-N 121.704 -0.622 . . . . 0.96999999999999997 111.675 -179.653 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 35.6 mm -52.01 -53.68 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 125.099 1.36 . . . . 1.3400000000000001 110.485 -179.179 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -59.53 -42.51 92.48 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.214 0.82 . . . . 1.96 113.214 -179.949 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -64.62 -30.0 71.02 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.293 0.637 . . . . 3.9900000000000002 112.709 175.682 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -85.8 -47.24 9.91 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.17 0.988 . . . . 2.6800000000000002 112.026 -176.8 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -63.78 -23.3 67.31 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.197 0.908 . . . . 3.0800000000000001 112.692 178.358 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -67.71 -15.01 63.43 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.63 1.344 . . . . 2.8500000000000001 114.63 170.656 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -136.53 -20.43 1.36 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.619 1.711 . . . . 3.4500000000000002 115.619 -169.009 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -122.46 99.75 6.58 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.716 -1.24 . . . . 4.9100000000000001 111.666 -167.758 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -77.6 76.95 4.13 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.818 1.247 . . . . 3.9199999999999999 113.687 -169.996 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 72.2 11.51 75.38 Favored Glycine 0 N--CA 1.477 1.37 0 O-C-N 120.943 -1.098 . . . . 2.6299999999999999 114.345 176.75 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -65.93 152.16 45.13 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.772 1.629 . . . . 5.6200000000000001 111.935 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 2.5 mp -140.23 78.64 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.779 1.232 . . . . 4.1799999999999997 108.353 174.605 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 27.7 t -82.61 151.67 26.24 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.5 1.12 . . . . 1.5800000000000001 112.171 169.261 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -57.84 -42.11 83.74 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.621 -0.674 . . . . 2.7599999999999998 111.545 170.04 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.95 -22.71 39.38 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.031 0.752 . . . . 3.8199999999999998 113.031 -173.061 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -56.59 -53.11 61.42 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.714 -0.847 . . . . 3.7200000000000002 108.714 166.276 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -58.16 -46.87 84.96 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.274 -0.891 . . . . 2.9900000000000002 112.484 176.505 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 49.7 t-105 -65.4 -47.78 75.11 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 120.924 -1.11 . . . . 0.96999999999999997 113.369 -176.373 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.6 t -63.44 -32.86 74.41 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.481 1.037 . . . . 1.9399999999999999 111.914 176.321 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.414 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 67.6 mt -61.54 -49.47 76.55 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.263 -0.898 . . . . 0.81999999999999995 112.249 173.711 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.2 mm -57.14 -40.12 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 CA-C-N 120.418 1.463 . . . . 0.78000000000000003 113.023 -176.712 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.02 -29.74 75.3 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 119.206 -0.774 . . . . 0.81999999999999995 112.735 174.803 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.84 -16.16 75.81 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.404 1.478 . . . . 0.83999999999999997 116.297 -173.807 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.1 mp -86.68 -31.41 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 CA-C-N 119.249 1.524 . . . . 0.98999999999999999 110.82 164.297 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.5 m -74.01 171.13 14.03 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.988 1.715 . . . . 3.0499999999999998 108.546 178.209 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . 115.43 -73.86 0.25 Allowed Glycine 0 N--CA 1.473 1.153 0 CA-C-O 117.752 -1.582 . . . . 1.2 113.399 179.532 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.27 -41.0 22.98 Favored 'Trans proline' 0 C--N 1.351 0.687 0 CA-C-N 121.276 2.538 . . . . 1.3 110.348 175.616 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 193' ' ' ILE . . . . . 0.441 HD12 ' SD ' ' B' ' 152' ' ' MET . 12.4 pt -69.26 -21.2 24.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 113.577 0.955 . . . . 1.3300000000000001 113.577 170.727 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 194' ' ' ALA . . . . . 0.454 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -60.26 -45.73 92.27 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.185 1.357 . . . . 1.27 112.628 -178.448 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -65.68 -35.52 81.01 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 120.68 -1.262 . . . . 3.5099999999999998 112.89 170.521 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.4 mt -64.35 -41.79 96.57 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.696 -1.145 . . . . 1.8600000000000001 111.172 179.317 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 197' ' ' ILE . . . . . 0.454 HD12 ' HA ' ' B' ' 194' ' ' ALA . 75.1 mt -49.57 -58.1 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 119.625 1.102 . . . . 1.28 110.1 164.569 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -58.44 -36.23 73.33 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 118.433 -0.794 . . . . 1.98 112.611 -172.372 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -68.57 -49.78 56.8 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.669 1.988 . . . . 4.0099999999999998 112.693 171.84 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -70.47 -32.17 69.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.368 1.067 . . . . 2.5899999999999999 113.466 -172.124 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -66.55 -35.71 80.9 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 119.951 1.251 . . . . 2.5 111.207 170.952 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -65.95 -42.38 90.07 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 120.643 -1.285 . . . . 2.25 110.588 178.146 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 . . . . . 0 CA--C 1.541 0.602 0 C-N-CA 126.417 1.887 . . . . 4.3600000000000003 112.754 177.735 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 108.376 -0.972 . . . . 2.1200000000000001 108.376 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.47 153.25 35.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.458 -1.401 . . . . 1.04 110.425 178.385 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -63.96 -34.13 77.28 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 119.648 1.113 . . . . 2.0600000000000001 111.437 174.443 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.01 -45.81 87.29 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 120.108 1.322 . . . . 1.1000000000000001 109.375 177.049 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -66.13 -55.74 14.91 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.94 1.296 . . . . 3.02 112.057 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -58.64 -29.72 66.76 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 120.868 -1.145 . . . . 5.3799999999999999 112.099 172.284 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.789 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.38 -41.37 76.57 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 119.649 -1.907 . . . . 0.67000000000000004 112.488 169.078 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.437 ' HA ' ' HG ' ' A' ' 15' ' ' LEU . 85.9 t -56.66 -37.54 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 CA-C-N 119.733 1.151 . . . . 0.71999999999999997 110.773 167.887 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.1 mt -55.92 -56.75 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 CA-C-N 120.924 1.693 . . . . 1.05 111.852 166.073 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.1 t -52.85 -43.75 46.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 119.382 0.992 . . . . 1.0 112.218 -177.773 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.437 ' HG ' ' HA ' ' A' ' 12' ' ' VAL . 1.8 pp -71.44 -18.94 62.29 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.161 1.171 . . . . 4.2699999999999996 114.161 177.956 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.2 t -81.95 -43.52 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.291 0.95 . . . . 0.93999999999999995 110.261 179.177 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -56.68 -41.45 77.33 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.227 0.467 . . . . 3.3799999999999999 110.593 171.988 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -66.75 -23.8 66.13 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 115.397 1.629 . . . . 2.6299999999999999 115.397 -178.243 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -79.61 -52.91 7.39 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.567 -0.708 . . . . 1.9399999999999999 111.852 170.97 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.423 ' HA ' HG22 ' A' ' 23' ' ' VAL . 37.4 m-85 -68.22 -30.75 69.9 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 117.995 -1.002 . . . . 1.79 113.668 -172.065 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.39 -26.31 66.56 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.492 1.293 . . . . 3.7400000000000002 114.492 172.638 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -93.1 -31.14 14.93 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.76 1.022 . . . . 2.3100000000000001 113.76 177.847 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.423 HG22 ' HA ' ' A' ' 20' ' ' TYR . 18.9 m . . . . . 0 N--CA 1.474 0.756 0 O-C-N 121.605 -0.684 . . . . 2.8199999999999998 110.736 174.68 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 7.2 pt . . . . . 0 N--CA 1.475 0.824 0 CA-C-O 122.459 1.123 . . . . 3.0 112.872 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.3 t -78.93 150.52 32.08 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.169 -0.923 . . . . 3.1000000000000001 110.576 154.762 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -43.55 -32.3 0.9 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.745 1.618 . . . . 2.2400000000000002 113.075 171.659 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 82.4 p -67.92 -18.09 64.67 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 115.68 1.733 . . . . 1.76 115.68 -178.952 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.7 m -65.61 -43.49 89.46 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 121.114 1.779 . . . . 1.24 112.128 177.986 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.489 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 10.8 t80 -50.4 -53.02 32.45 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.29 1.036 . . . . 2.02 112.866 -178.327 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -61.52 -17.93 56.91 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.318 0.858 . . . . 2.4500000000000002 113.318 179.481 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -95.66 -42.3 8.46 Favored 'General case' 0 C--O 1.225 -0.184 0 C-N-CA 124.699 1.2 . . . . 3.4399999999999999 112.329 178.438 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -44.39 -53.39 6.89 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.26 1.024 . . . . 1.71 109.544 162.363 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.489 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 11.8 mt -52.84 -15.88 0.86 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.12 2.168 . . . . 1.3100000000000001 116.568 174.071 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.21 1.09 10.78 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.667 1.576 . . . . 2.4300000000000002 114.187 174.746 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.92 -43.99 6.51 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.985 0.914 . . . . 1.8799999999999999 111.766 164.643 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -88.03 -40.36 13.91 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.977 1.711 . . . . 3.2400000000000002 112.496 -179.08 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.84 25.19 10.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.592 1.557 . . . . 2.21 112.253 -175.68 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -67.5 -23.84 65.51 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 120.917 -1.114 . . . . 1.74 113.708 -174.23 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -86.13 -20.55 28.49 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.245 0.93 . . . . 1.8400000000000001 112.128 -169.026 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.7 mtm -98.23 -8.24 27.72 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 114.954 1.464 . . . . 2.6200000000000001 114.954 168.275 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tp -77.72 71.47 4.2 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 120.445 1.475 . . . . 2.4399999999999999 111.821 -176.43 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.0 m -70.69 3.56 3.08 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 117.416 2.376 . . . . 4.2000000000000002 117.416 -166.587 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -177.32 158.39 1.44 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 127.333 2.253 . . . . 5.5899999999999999 110.502 -179.418 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 53.8 m -58.24 -30.47 66.56 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.783 2.033 . . . . 2.9399999999999999 112.405 171.939 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.8 -33.41 68.0 Favored Glycine 0 N--CA 1.472 1.085 0 CA-C-N 120.48 1.491 . . . . 2.3199999999999998 113.605 175.938 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -64.63 -45.69 85.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.327 0.651 . . . . 3.3700000000000001 110.938 171.684 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.1 mmm-85 -61.94 -43.87 97.95 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 120.662 -1.274 . . . . 5.25 113.638 169.082 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -53.35 -34.96 59.61 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 121.554 1.979 . . . . 3.4300000000000002 111.916 173.879 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.44 -17.55 60.77 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 115.013 1.486 . . . . 1.3200000000000001 115.013 174.858 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -80.22 -48.7 12.7 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.374 0.988 . . . . 0.93000000000000005 110.822 163.794 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -63.06 -39.6 95.2 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.352 1.061 . . . . 2.5899999999999999 111.943 -174.826 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.4 ptmm? -52.43 -29.12 22.88 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 113.841 1.052 . . . . 3.7400000000000002 113.841 172.588 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.1 mt -78.85 -36.45 42.32 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 124.045 0.938 . . . . 0.96999999999999997 111.986 -177.704 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.0 mm -57.69 -51.07 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.608 1.163 . . . . 1.1200000000000001 109.835 -178.199 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -70.55 -31.62 68.73 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.882 1.273 . . . . 1.8999999999999999 112.959 -179.708 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -65.47 -35.39 80.76 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.626 0.77 . . . . 3.0699999999999998 112.158 167.568 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.7 tp -75.11 -20.48 59.42 Favored 'General case' 0 C--O 1.221 -0.421 0 O-C-N 120.9 -1.125 . . . . 2.9199999999999999 111.562 174.216 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -70.43 -5.14 26.31 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 115.585 1.698 . . . . 2.7200000000000002 115.585 170.275 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.77 -2.83 31.65 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 113.444 0.905 . . . . 3.2599999999999998 113.444 157.321 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -143.02 179.61 6.94 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 127.264 2.225 . . . . 3.21 110.815 -169.662 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 26.9 t60 101.03 71.64 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 128.231 2.613 . . . . 5.8200000000000003 112.31 159.149 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.86 46.7 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 130.325 3.45 . . . . 6.4400000000000004 114.692 -169.534 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.28 -14.75 2.21 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 126.262 1.886 . . . . 3.3399999999999999 114.275 -176.074 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.2 mmt85 -90.37 -167.53 1.86 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.662 1.985 . . . . 7.0 112.059 -177.538 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.7 mm -139.65 132.06 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 127.637 2.375 . . . . 3.3500000000000001 106.542 175.434 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 71.0 m -113.26 146.83 38.7 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.833 0.853 . . . . 1.99 110.727 162.584 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -60.65 -38.02 83.48 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.348 0.87 . . . . 2.1299999999999999 113.348 -174.935 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -71.97 -8.83 56.77 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.317 1.047 . . . . 4.4800000000000004 112.883 -176.443 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.82 -56.33 18.42 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.119 0.872 . . . . 3.9900000000000002 111.095 175.526 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -58.58 -33.2 69.69 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.207 -1.558 . . . . 2.3100000000000001 112.212 176.007 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 23.5 t-105 -67.72 -59.49 3.28 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.951 0.723 . . . . 1.0800000000000001 112.951 178.108 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.9 t -60.28 -23.9 64.52 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.023 1.329 . . . . 1.72 112.147 178.181 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 65.0 mt -73.97 -46.67 42.46 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 117.807 -1.092 . . . . 0.63 113.44 169.355 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 8.2 mm -55.05 -40.8 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 CA-C-N 121.732 2.06 . . . . 0.89000000000000001 112.423 -178.298 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.74 -21.79 63.46 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-N 118.251 0.478 . . . . 0.59999999999999998 113.39 177.135 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.8 -19.45 76.79 Favored Glycine 0 CA--C 1.532 1.143 0 O-C-N 121.236 -1.155 . . . . 0.67000000000000004 114.068 177.963 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -110.2 -34.19 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.904 1.281 . . . . 1.05 111.502 170.495 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.5 m -77.4 85.18 3.8 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.285 1.434 . . . . 1.3700000000000001 108.226 177.667 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -170.33 -68.4 0.04 OUTLIER Glycine 0 CA--C 1.532 1.134 0 C-N-CA 126.077 1.799 . . . . 0.97999999999999998 111.846 -172.753 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -59.28 -67.83 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.654 2.903 . . . . 1.23 110.877 168.563 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.8 pt -65.84 -20.78 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 117.717 -1.135 . . . . 1.3899999999999999 113.614 177.677 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.54 71.19 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.632 1.56 . . . . 0.93000000000000005 112.32 173.677 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -63.67 -41.23 98.21 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.848 -1.157 . . . . 4.0899999999999999 112.585 173.9 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.81 -35.17 75.81 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.219 1.008 . . . . 1.3400000000000001 112.722 178.945 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.2 mt -55.45 -52.71 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 120.854 -1.154 . . . . 1.01 110.161 171.173 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -67.27 -35.71 80.08 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.683 0.623 . . . . 1.8100000000000001 112.683 -176.237 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.263 4.6 pt-20 -75.41 -19.67 59.37 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 119.582 1.083 . . . . 3.0499999999999998 112.514 174.748 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -79.49 -43.64 22.79 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 117.56 -1.209 . . . . 2.3399999999999999 114.212 172.72 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -61.65 -17.85 57.09 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 119.785 1.175 . . . . 2.3700000000000001 111.762 177.286 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 . . . . . 0 CA--C 1.54 0.566 0 C-N-CA 125.325 1.45 . . . . 2.2599999999999998 110.058 176.175 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 . . . . . 0 N--CA 1.477 0.886 0 N-CA-C 109.59 -0.522 . . . . 2.3799999999999999 109.59 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 22.3 p -70.48 152.55 43.9 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 119.81 1.186 . . . . 1.04 111.339 -172.931 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -59.31 -36.08 74.98 Favored 'General case' 0 C--O 1.221 -0.443 0 O-C-N 121.526 -0.734 . . . . 2.1299999999999999 111.851 -177.42 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -44.72 89.19 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.497 1.044 . . . . 1.3600000000000001 111.149 175.261 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -65.68 -56.46 12.0 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.077 0.951 . . . . 2.8399999999999999 111.004 -179.569 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.0 tmtt? -58.33 -27.72 64.41 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 120.941 -1.099 . . . . 4.6399999999999997 112.611 172.137 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.789 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.98 -42.14 76.96 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 119.344 -2.097 . . . . 0.58999999999999997 113.08 167.842 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 22.1 t -59.81 -31.08 46.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 CA-C-N 120.299 1.409 . . . . 0.71999999999999997 111.663 168.746 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 69.9 mt -58.57 -60.68 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 O-C-N 120.354 -1.467 . . . . 1.01 111.217 163.097 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 32.9 t -52.94 -44.28 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 124.41 1.084 . . . . 1.02 112.652 -175.601 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 2.6 pp -70.65 -25.11 62.85 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.32 -0.863 . . . . 4.1799999999999997 112.777 -179.007 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 42.4 t -78.0 -31.66 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 124.199 1.0 . . . . 0.93000000000000005 110.57 178.045 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -54.14 -49.86 68.25 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.719 0.808 . . . . 2.8399999999999999 110.284 164.801 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -63.82 -19.26 64.88 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 115.165 1.543 . . . . 2.2799999999999998 115.165 -178.804 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -80.97 -62.11 1.76 Allowed 'General case' 0 C--O 1.237 0.434 0 O-C-N 121.308 -0.87 . . . . 2.2799999999999998 112.266 173.471 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -69.61 -21.22 63.59 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 113.598 0.962 . . . . 1.77 113.598 -171.393 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.42 -20.8 66.53 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.429 1.27 . . . . 3.0699999999999998 114.429 168.497 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 14.3 m-30 -106.3 -36.68 6.78 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.707 1.203 . . . . 2.1600000000000001 114.055 177.785 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.478 0.969 0 CA-C-N 119.168 0.894 . . . . 3.0499999999999998 111.449 172.309 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 7.8 pt . . . . . 0 N--CA 1.473 0.707 0 CA-C-O 122.248 1.023 . . . . 3.0499999999999998 112.041 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 36.0 t -82.48 154.11 25.28 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.189 -0.914 . . . . 3.02 109.907 157.601 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -49.49 -34.42 16.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.211 1.004 . . . . 2.2200000000000002 112.027 170.679 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 99.7 p -61.73 -15.75 43.4 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.194 1.183 . . . . 1.6200000000000001 114.194 177.669 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 69.7 m -65.89 -37.2 85.5 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.931 1.242 . . . . 1.28 112.208 169.442 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.42 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 17.8 t80 -58.42 -49.23 78.03 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.184 1.357 . . . . 2.6099999999999999 113.295 -173.793 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 16.2 ptt85 -57.54 -12.44 2.73 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.286 1.034 . . . . 3.2999999999999998 113.215 174.243 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -109.82 -42.79 4.16 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 125.93 1.692 . . . . 3.3100000000000001 114.303 179.374 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -40.95 -49.88 3.26 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.885 1.674 . . . . 2.0299999999999998 110.217 163.135 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.6 mt -61.63 -24.64 66.85 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 114.633 1.346 . . . . 1.2 114.633 177.849 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -103.83 2.78 33.13 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.411 1.46 . . . . 2.54 114.124 175.91 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.09 -44.17 4.44 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.448 1.099 . . . . 1.5700000000000001 113.22 167.246 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -96.9 -15.58 21.12 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.803 1.241 . . . . 3.6400000000000001 114.222 -178.777 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.91 26.17 8.28 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.286 1.834 . . . . 1.8200000000000001 112.271 176.265 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -68.76 -16.12 63.71 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 116.046 1.869 . . . . 1.3200000000000001 116.046 -167.868 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -93.54 -38.23 11.49 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 119.644 1.111 . . . . 1.74 110.509 -175.141 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 36.5 mtm -77.64 -10.19 59.38 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 113.914 1.079 . . . . 2.6299999999999999 113.914 167.808 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.49 44.04 0.07 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.692 1.997 . . . . 2.3799999999999999 111.946 167.413 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.78 29.72 0.26 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.84 1.656 . . . . 4.5599999999999996 113.598 -167.801 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -174.41 163.89 3.75 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.308 2.643 . . . . 6.6200000000000001 108.886 -161.991 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 47.2 m -107.43 -17.94 13.99 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 125.384 1.474 . . . . 2.75 112.816 178.054 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -65.77 -41.69 95.57 Favored Glycine 0 CA--C 1.528 0.878 0 CA-C-N 119.234 0.924 . . . . 2.2400000000000002 112.036 175.44 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -57.53 -43.25 84.18 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 117.816 0.808 . . . . 3.3300000000000001 112.643 174.066 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.39 -50.27 72.08 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 124.133 0.973 . . . . 4.9500000000000002 112.957 171.395 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -61.57 -33.01 73.14 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.835 0.743 . . . . 3.1200000000000001 112.02 177.838 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 161' ' ' ALA . . . . . 0.508 ' HA ' ' HG2' ' B' ' 164' ' ' LYS . . . -68.07 -15.74 63.72 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.395 1.257 . . . . 1.1699999999999999 114.395 173.722 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.44 -44.97 23.38 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.957 0.799 . . . . 0.92000000000000004 110.955 164.301 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -61.91 -40.23 94.74 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.978 0.911 . . . . 2.7200000000000002 112.375 -175.722 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 164' ' ' LYS . . . . . 0.508 ' HG2' ' HA ' ' B' ' 161' ' ' ALA . 2.9 ptmm? -52.95 -26.31 14.71 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.133 1.16 . . . . 4.0 114.133 170.053 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 44.5 mt -83.08 -29.96 28.37 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 118.08 -0.962 . . . . 1.55 112.797 176.886 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 41.0 mm -58.33 -55.01 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 118.922 0.783 . . . . 1.21 108.933 177.868 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -61.53 -34.14 75.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.777 1.029 . . . . 2.5800000000000001 113.777 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -70.24 -33.7 71.96 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.598 1.159 . . . . 3.1099999999999999 111.979 175.147 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 24.3 tp -78.5 -21.96 48.16 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 123.87 0.868 . . . . 2.7599999999999998 111.205 172.275 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.52 -8.85 50.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.939 1.696 . . . . 2.96 115.455 174.48 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -73.31 -3.45 27.11 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 113.84 1.052 . . . . 3.2000000000000002 113.84 158.874 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -142.87 179.72 6.85 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 127.187 2.195 . . . . 3.1099999999999999 111.402 -169.447 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 27.1 t60 100.71 80.42 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 128.461 2.704 . . . . 5.5199999999999996 112.027 160.364 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -72.57 42.57 0.1 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 129.036 2.935 . . . . 6.5 114.404 -167.773 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 75.93 -17.73 3.58 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 126.127 1.822 . . . . 3.29 114.671 -179.499 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -87.57 -155.89 0.32 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.8 1.64 . . . . 7.0599999999999996 111.727 177.91 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.4 mm -145.98 136.09 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 128.213 2.605 . . . . 3.29 106.134 178.406 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.5 m -113.88 153.14 29.71 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.606 0.762 . . . . 2.04 111.257 159.894 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -65.17 -42.43 93.68 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 112.743 0.646 . . . . 1.8700000000000001 112.743 -176.268 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -68.97 -14.27 62.94 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.877 1.271 . . . . 4.3300000000000001 113.087 -173.986 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -56.59 -57.98 10.02 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.8 0.84 . . . . 4.1100000000000003 109.822 174.157 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -54.12 -39.71 66.67 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.026 -1.047 . . . . 2.5099999999999998 112.611 178.354 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -70.68 -53.9 13.93 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.749 0.648 . . . . 1.3899999999999999 112.749 -179.259 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -62.75 -20.42 64.93 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.701 1.2 . . . . 1.6000000000000001 113.117 -178.24 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.42 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 95.9 mt -76.38 -41.11 49.08 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.83 -1.169 . . . . 0.60999999999999999 113.933 168.143 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 13.8 mm -58.39 -46.26 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 CA-C-N 120.935 1.698 . . . . 0.75 112.278 -173.976 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.65 -21.72 60.9 Favored Glycine 0 CA--C 1.533 1.2 0 CA-C-N 118.441 0.564 . . . . 0.67000000000000004 113.4 177.33 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.05 -8.78 65.45 Favored Glycine 0 CA--C 1.535 1.287 0 O-C-N 121.078 -1.248 . . . . 0.89000000000000001 114.183 175.845 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.2 mp -120.39 -37.76 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 126.035 1.734 . . . . 1.3200000000000001 111.544 166.222 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 8.0 m -78.87 78.76 5.3 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.223 1.809 . . . . 1.3999999999999999 108.088 177.974 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -169.06 -65.78 0.03 OUTLIER Glycine 0 CA--C 1.524 0.627 0 CA-C-O 118.282 -1.288 . . . . 0.91000000000000003 111.127 -174.644 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -57.74 -62.89 0.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.906 2.404 . . . . 0.93999999999999995 110.817 166.05 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.1 pp -74.96 -14.66 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.903 1.229 . . . . 1.0600000000000001 113.142 -177.535 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.28 -36.41 84.02 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.599 0.592 . . . . 1.0 112.599 176.514 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -62.93 -41.4 99.47 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 120.624 -1.298 . . . . 4.1600000000000001 111.454 171.417 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.97 -37.09 73.56 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.261 1.424 . . . . 1.5900000000000001 113.019 174.14 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 84.9 mt -54.35 -54.15 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 O-C-N 121.094 -1.004 . . . . 0.92000000000000004 110.755 169.032 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -67.71 -34.62 77.24 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.478 0.918 . . . . 1.71 113.478 -175.495 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -74.14 -20.24 60.3 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 118.521 -0.752 . . . . 3.6600000000000001 112.268 173.758 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -78.61 -40.85 33.28 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 114.996 1.48 . . . . 2.21 114.996 172.924 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -62.98 -13.65 37.79 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 120.72 1.6 . . . . 2.3599999999999999 112.144 174.133 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.08 -71.5 0.71 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.308 1.443 . . . . 2.4399999999999999 109.616 175.974 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 . . . . . 0 N--CA 1.484 1.229 1 C-N-CA 134.251 5.02 . . . . 4.4699999999999998 116.092 172.814 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 109.808 -0.441 . . . . 2.3199999999999998 109.808 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -88.16 146.01 25.62 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.893 -0.78 . . . . 1.0700000000000001 108.893 159.01 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -67.26 -23.9 65.74 Favored 'General case' 0 C--O 1.212 -0.899 0 CA-C-O 117.325 -1.322 . . . . 2.9300000000000002 112.172 177.978 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -49.82 72.96 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 121.828 2.104 . . . . 1.02 109.5 173.487 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -66.52 -55.13 16.95 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 119.294 -0.384 . . . . 2.8599999999999999 111.752 -176.45 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.2 tptt -63.33 -25.51 68.34 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.868 -1.145 . . . . 6.5599999999999996 113.823 175.121 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.754 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -67.7 -43.94 78.9 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.082 -1.637 . . . . 0.54000000000000004 112.571 166.072 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 19.0 t -56.89 -39.93 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.317 1.417 . . . . 0.68000000000000005 110.262 170.212 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.6 mt -58.61 -52.39 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-O 118.052 -0.975 . . . . 1.1100000000000001 111.281 169.623 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.3 t -57.39 -36.34 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 125.248 1.419 . . . . 0.56999999999999995 112.585 178.868 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.25 -41.01 74.07 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 121.268 -0.895 . . . . 0.95999999999999996 111.877 174.128 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.16 -44.82 95.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.077 0.551 . . . . 0.65000000000000002 111.041 176.076 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -62.72 -41.6 99.23 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 119.074 -0.488 . . . . 3.54 110.719 173.707 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.477 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 10.4 t30 -62.4 -23.91 67.1 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.408 1.262 . . . . 2.1499999999999999 114.408 -174.585 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -78.02 -59.13 2.91 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.206 1.002 . . . . 1.8799999999999999 111.063 169.666 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -62.31 -31.88 72.55 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.543 0.942 . . . . 2.1200000000000001 113.543 -174.967 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.477 ' HD3' ' HA ' ' A' ' 18' ' ' ASN . 9.2 ptmt -56.4 -22.14 29.62 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 120.241 1.382 . . . . 2.6699999999999999 114.148 176.746 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -88.72 -12.69 41.57 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.137 1.162 . . . . 2.73 114.137 175.98 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 28.8 m . . . . . 0 N--CA 1.482 1.166 0 CA-C-N 120.094 1.316 . . . . 2.5699999999999998 111.78 -179.004 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 31.6 pt . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 110.147 -0.316 . . . . 2.8999999999999999 110.147 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.5 m -88.07 159.14 18.38 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.055 -1.028 . . . . 2.6699999999999999 111.347 171.611 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -43.2 -35.07 1.27 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.365 1.866 . . . . 2.3999999999999999 115.574 -179.451 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.5 m -56.42 -29.98 62.23 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.897 1.443 . . . . 2.04 114.897 174.153 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.1 m -81.33 -18.88 44.16 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.754 1.02 . . . . 1.24 113.754 -173.362 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 63.8 t80 -64.85 -51.7 60.62 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.421 1.01 . . . . 2.1000000000000001 110.932 174.164 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.4 ptt180 -65.23 -31.77 73.09 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.319 0.647 . . . . 2.1699999999999999 112.458 179.673 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -70.45 -52.28 23.27 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.494 1.118 . . . . 3.8999999999999999 110.057 174.741 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -50.25 -43.23 52.98 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 121.179 -0.951 . . . . 1.3 111.88 172.072 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.403 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 12.6 mt -62.28 -15.31 46.7 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 115.921 1.823 . . . . 1.04 115.921 174.617 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -106.66 -7.75 17.21 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.314 1.416 . . . . 2.6200000000000001 114.144 169.705 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -56.26 4.33 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.647 1.112 . . . . 3.1200000000000001 110.97 160.809 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -85.64 -48.42 8.89 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.26 0.624 . . . . 2.6299999999999999 111.624 -167.868 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 tt -106.14 50.24 0.78 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.14 1.376 . . . . 2.0299999999999998 110.841 -168.993 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -94.5 -20.96 19.2 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 117.267 2.321 . . . . 1.3500000000000001 117.267 -170.758 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.15 -26.8 39.18 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 121.786 2.085 . . . . 1.6599999999999999 112.962 -177.071 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.1 tpp -65.94 24.84 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 128.965 2.906 . . . . 1.6799999999999999 115.66 175.949 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.2 mp -109.62 128.3 55.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 128.108 2.563 . . . . 3.3999999999999999 110.874 -173.611 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.7 m -106.22 -17.68 14.23 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.741 1.216 . . . . 4.1799999999999997 112.789 172.765 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -177.15 166.58 2.39 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 129.24 3.016 . . . . 4.2999999999999998 108.289 -173.389 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -27.59 -50.32 0.06 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 128.787 2.835 . . . . 2.2799999999999998 112.754 156.415 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.31 -38.48 49.76 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.725 1.631 . . . . 1.5600000000000001 114.484 -176.943 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -60.78 -33.01 72.32 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.317 1.058 . . . . 3.8799999999999999 112.003 178.55 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.72 -39.7 18.2 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.754 1.222 . . . . 8.1400000000000006 112.876 171.016 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.3 mmmt -61.38 -30.41 70.52 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.902 1.228 . . . . 3.2799999999999998 112.814 179.862 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -48.78 -47.49 41.85 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.954 0.902 . . . . 1.21 112.789 165.73 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.41 -41.66 98.72 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.077 1.351 . . . . 0.72999999999999998 112.241 174.692 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -61.41 -36.68 80.99 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.348 0.659 . . . . 2.27 112.566 178.077 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.9 mtmt -52.3 -37.77 56.65 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.437 1.017 . . . . 3.4199999999999999 112.499 174.378 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.5 mt -72.27 -31.53 65.85 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.551 1.54 . . . . 0.84999999999999998 112.992 -179.024 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.46 -36.26 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 118.555 0.616 . . . . 0.92000000000000004 111.125 175.476 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -64.76 -50.25 67.56 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.29 1.436 . . . . 2.5699999999999998 111.047 173.596 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -56.05 -29.95 61.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.99 0.916 . . . . 3.4199999999999999 112.301 178.147 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.5 mt -89.25 -18.2 27.51 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 114.763 1.394 . . . . 2.77 114.763 177.189 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.36 -22.18 66.87 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.382 0.992 . . . . 3.8500000000000001 112.665 169.999 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.9 -18.74 46.17 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.363 1.616 . . . . 2.6499999999999999 115.363 168.892 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -129.95 -19.1 3.29 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 116.179 1.918 . . . . 2.8399999999999999 116.179 -166.008 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -144.28 154.44 43.07 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.6 1.091 . . . . 4.8799999999999999 113.267 -155.037 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.7 t0 99.38 158.38 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 129.848 3.259 . . . . 8.3800000000000008 108.903 -176.404 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 74.1 -54.68 2.26 Favored Glycine 0 CA--C 1.533 1.186 0 O-C-N 120.561 -1.337 . . . . 3.5800000000000001 110.999 -160.417 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -105.32 142.82 34.42 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.429 1.492 . . . . 6.0899999999999999 110.541 158.311 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.6 mm -104.67 149.05 8.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 N-CA-C 107.769 -1.197 . . . . 2.46 107.769 163.229 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.4 t -125.41 145.55 50.01 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.28 1.032 . . . . 1.54 108.563 174.064 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -72.63 -51.72 18.4 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 122.418 1.104 . . . . 2.02 111.475 -170.51 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -42.66 -38.01 1.9 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 129.866 3.266 . . . . 3.2400000000000002 114.416 170.799 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -67.53 -37.82 83.32 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.658 0.984 . . . . 4.9299999999999997 113.658 -177.288 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -60.83 -47.92 84.15 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 120.54 1.518 . . . . 1.8 111.248 172.437 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -63.44 -39.59 94.89 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 119.102 -0.475 . . . . 0.54000000000000004 110.817 -179.509 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 95.2 m -57.22 -52.74 64.12 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.425 1.49 . . . . 1.95 110.296 171.15 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 27.8 mt -52.5 -44.33 65.61 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 118.247 -0.882 . . . . 0.83999999999999997 113.293 178.378 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 30.3 mm -55.49 -37.0 43.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 120.072 1.305 . . . . 0.58999999999999997 111.955 -175.585 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.09 -15.68 58.8 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.031 0.824 . . . . 0.59999999999999998 114.447 176.773 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.73 -16.2 77.88 Favored Glycine 0 CA--C 1.534 1.236 0 CA-C-N 118.699 1.25 . . . . 0.85999999999999999 113.682 172.006 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 mp -103.42 -53.31 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-N 118.638 1.219 . . . . 0.98999999999999999 109.368 167.669 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.1 m -73.92 61.75 0.81 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 128.002 2.521 . . . . 1.3799999999999999 109.326 171.25 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -139.14 -78.3 0.06 OUTLIER Glycine 0 CA--C 1.527 0.812 0 C-N-CA 125.87 1.7 . . . . 0.89000000000000001 110.017 174.066 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -58.8 -49.19 12.16 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.122 2.548 . . . . 0.98999999999999999 111.669 179.034 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -75.95 -10.98 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 114.105 1.15 . . . . 1.02 114.105 176.32 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.59 -38.12 74.01 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.213 -0.929 . . . . 1.1599999999999999 112.641 -176.155 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -59.94 -39.73 86.54 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 120.432 1.469 . . . . 2.6600000000000001 111.165 165.309 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.78 -38.13 74.92 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 124.301 1.041 . . . . 1.28 111.374 -178.667 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.5 mt -50.17 -57.77 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.623 1.101 . . . . 1.02 111.076 169.963 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 79.1 t60 -75.68 -5.15 44.17 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 114.148 1.166 . . . . 1.76 114.148 -176.852 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.265 1.9 pt-20 -107.52 -11.43 15.49 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 119.841 -1.787 . . . . 3.2000000000000002 114.014 167.461 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -83.63 -45.45 13.45 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.877 1.671 . . . . 2.5800000000000001 110.13 171.144 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -73.71 11.49 0.83 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 123.879 1.799 . . . . 2.8799999999999999 111.524 176.185 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 . . . . . 0 C--N 1.327 -0.405 0 C-N-CA 126.862 2.065 . . . . 2.0099999999999998 110.411 165.878 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 . . . . . 0 N--CA 1.486 1.366 0 N-CA-C 108.806 -0.813 . . . . 2.54 108.806 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.3 p -99.63 150.37 22.33 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.068 0.849 . . . . 1.0 109.477 162.343 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -69.57 -22.6 63.52 Favored 'General case' 0 C--O 1.212 -0.88 0 CA-C-O 117.545 -1.217 . . . . 2.96 112.643 178.232 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -53.79 53.38 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 121.954 2.161 . . . . 1.0 109.084 171.915 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -53.45 52.4 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 122.763 0.425 . . . . 2.5600000000000001 110.897 -177.367 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -65.35 -27.37 68.53 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 120.969 -1.082 . . . . 7.4000000000000004 113.858 177.045 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.754 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -66.19 -39.89 90.01 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.042 -1.661 . . . . 0.52000000000000002 113.156 165.217 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 34.8 t -57.54 -39.79 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 120.718 1.599 . . . . 0.63 110.126 169.354 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 2.9 mt -58.38 -54.05 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-O 118.332 -0.842 . . . . 1.25 112.254 169.041 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 20.4 t -56.47 -44.04 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 125.903 1.681 . . . . 0.68000000000000005 112.922 179.467 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.2 mp -64.46 -44.73 90.16 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.492 1.117 . . . . 1.0800000000000001 110.967 178.244 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 55.8 t -65.73 -40.97 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 118.692 -0.67 . . . . 0.69999999999999996 111.157 179.409 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.64 -42.76 84.07 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.773 0.715 . . . . 3.3799999999999999 111.608 168.292 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.35 -23.98 67.09 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.016 1.487 . . . . 2.1499999999999999 115.016 -175.344 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -79.36 -59.4 2.77 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.4 0.68 . . . . 2.1200000000000001 111.065 168.71 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -61.98 -31.71 72.1 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.563 0.949 . . . . 2.1200000000000001 113.563 -173.69 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -55.68 -21.25 17.33 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.318 1.447 . . . . 2.4700000000000002 114.159 176.708 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -89.06 -15.38 34.16 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.096 1.147 . . . . 2.5499999999999998 114.096 175.796 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.48 1.057 0 CA-C-N 119.723 1.147 . . . . 2.6099999999999999 111.919 -178.12 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 30.8 pt . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 109.468 -0.567 . . . . 2.98 109.468 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 47.0 m -92.85 163.63 13.64 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.939 -1.101 . . . . 2.6800000000000002 111.704 172.161 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -39.28 -41.05 0.84 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.691 1.996 . . . . 2.6499999999999999 115.338 178.393 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.1 m -57.92 -29.56 65.21 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.349 1.24 . . . . 1.99 114.349 179.154 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 36.8 m -79.58 -21.13 45.43 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.777 1.029 . . . . 1.3300000000000001 113.777 -173.866 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.434 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 56.0 t80 -64.7 -52.42 57.26 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.187 0.903 . . . . 1.8 110.829 174.517 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -65.87 -31.72 72.83 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 122.974 0.51 . . . . 2.4399999999999999 112.296 179.487 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -69.05 -51.22 41.18 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.888 0.875 . . . . 3.9700000000000002 110.409 174.163 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -51.8 -42.82 62.77 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.552 1.141 . . . . 1.1399999999999999 112.434 173.107 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 15.2 mt -60.12 -13.59 12.77 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.87 1.668 . . . . 1.0600000000000001 115.492 173.415 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.26 -2.85 15.56 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.367 1.439 . . . . 2.6499999999999999 114.061 170.488 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.52 -56.38 3.77 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.381 0.991 . . . . 3.1499999999999999 110.756 159.653 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -88.38 -43.41 11.52 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 122.011 -0.43 . . . . 2.6299999999999999 111.358 -166.578 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 tt -111.33 46.95 1.05 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.067 1.747 . . . . 2.0600000000000001 110.643 -169.795 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -93.7 -14.21 26.6 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 116.303 1.964 . . . . 1.3799999999999999 116.303 -170.872 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.57 -19.06 26.81 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 121.082 1.765 . . . . 1.46 112.311 -178.67 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.7 tpp -72.48 24.38 0.05 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 127.405 2.282 . . . . 1.6899999999999999 114.158 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 9.6 mp -110.51 128.42 55.62 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.681 2.392 . . . . 3.3300000000000001 110.761 -169.809 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 4.2 m -103.33 -21.58 13.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.665 1.186 . . . . 4.2800000000000002 112.327 171.737 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -173.66 167.94 4.45 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.126 2.971 . . . . 4.5700000000000003 107.978 -173.98 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -27.7 -49.64 0.05 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 128.491 2.716 . . . . 2.4700000000000002 112.546 156.265 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.59 -38.83 36.5 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 126.017 1.77 . . . . 1.6200000000000001 114.825 -177.63 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -62.1 -35.42 78.63 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.517 1.158 . . . . 3.8700000000000001 111.855 179.567 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 159' ' ' ARG . . . . . 0.42 ' HA ' HH11 ' B' ' 159' ' ' ARG . 0.0 OUTLIER -84.01 -36.43 23.14 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.623 1.169 . . . . 8.5700000000000003 112.544 172.37 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -61.06 -30.35 70.28 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.725 1.148 . . . . 3.3900000000000001 113.171 175.566 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -52.7 -44.07 66.07 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.193 0.997 . . . . 1.1000000000000001 112.816 167.577 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -65.01 -42.84 94.1 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.161 1.384 . . . . 0.67000000000000004 111.446 173.323 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -61.29 -35.95 78.73 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.582 0.956 . . . . 2.0499999999999998 113.582 178.314 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -51.95 -37.98 54.87 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.411 1.005 . . . . 3.3300000000000001 112.192 172.786 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 17.9 mt -72.03 -39.21 69.29 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 125.28 1.432 . . . . 0.68000000000000005 113.015 -178.14 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 30.7 mm -52.27 -34.68 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 125.101 1.361 . . . . 0.90000000000000002 111.98 175.825 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -61.94 -52.24 64.85 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.715 1.206 . . . . 2.71 111.617 173.953 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -63.2 -32.44 73.84 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.608 1.163 . . . . 3.5699999999999998 112.478 177.649 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.09 -26.0 64.71 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.661 1.984 . . . . 3.1899999999999999 111.947 172.43 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.06 -25.35 64.41 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.866 1.061 . . . . 3.6899999999999999 113.866 172.242 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.65 -24.1 39.22 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.076 1.139 . . . . 2.6099999999999999 114.076 174.23 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -121.92 -19.36 6.72 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 116.248 1.944 . . . . 2.7200000000000002 116.248 -167.138 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -138.49 158.41 44.31 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.08 1.309 . . . . 4.7699999999999996 114.147 -157.276 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.5 t0 98.35 157.9 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 129.698 3.199 . . . . 8.2699999999999996 108.633 -179.231 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.65 -58.23 2.1 Favored Glycine 0 CA--C 1.532 1.113 0 O-C-N 120.635 -1.291 . . . . 3.6099999999999999 110.716 -159.493 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 -101.06 139.14 37.16 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.639 1.176 . . . . 6.0999999999999996 110.662 157.886 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 42.0 mm -102.17 144.74 12.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 107.623 -1.251 . . . . 2.7000000000000002 107.623 164.599 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.1 t -117.53 144.07 45.46 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.321 -0.992 . . . . 1.5700000000000001 108.321 172.192 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -74.31 -52.84 11.05 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 122.891 1.329 . . . . 2.1099999999999999 111.163 -171.867 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -42.89 -35.34 1.17 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 129.979 3.312 . . . . 3.1899999999999999 114.927 168.056 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -67.31 -38.5 85.05 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.904 0.705 . . . . 4.6600000000000001 112.904 -178.968 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -58.81 -48.34 81.63 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.122 -1.612 . . . . 1.9099999999999999 111.168 172.202 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 27.7 t-105 -63.38 -41.29 98.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.85 0.46 . . . . 0.56999999999999995 110.898 -178.706 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 90.1 m -56.06 -52.44 64.27 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.391 1.477 . . . . 1.97 110.354 172.102 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.434 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 25.8 mt -56.6 -43.37 80.07 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 113.684 0.994 . . . . 0.70999999999999996 113.684 179.635 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 28.5 mm -53.33 -38.85 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-N 120.22 1.373 . . . . 0.57999999999999996 111.685 -178.254 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.61 -16.89 59.43 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.17 0.891 . . . . 0.56000000000000005 114.295 177.89 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.72 -13.88 80.71 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 118.682 1.241 . . . . 0.89000000000000001 113.713 172.685 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -102.57 -54.85 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-N 118.758 1.279 . . . . 0.98999999999999999 109.007 165.16 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 24.7 m -73.71 64.52 0.93 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 127.316 2.246 . . . . 1.54 108.935 171.582 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -143.64 -79.78 0.05 OUTLIER Glycine 0 CA--C 1.524 0.6 0 C-N-CA 125.601 1.572 . . . . 0.94999999999999996 109.892 177.396 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -60.33 -46.72 16.9 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.027 2.485 . . . . 1.1399999999999999 111.894 178.57 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.9 pt -77.42 -10.29 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 N-CA-C 114.023 1.12 . . . . 1.0 114.023 176.764 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 194' ' ' ALA . . . . . 0.405 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -68.45 -39.21 81.54 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 120.791 -1.193 . . . . 1.0700000000000001 113.022 -176.804 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -59.4 -46.15 89.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.911 -1.118 . . . . 2.79 111.289 167.291 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 9.3 tt -53.07 -41.81 65.24 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 124.013 0.925 . . . . 1.8 111.487 179.199 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 197' ' ' ILE . . . . . 0.405 HD12 ' HA ' ' B' ' 194' ' ' ALA . 88.9 mt -49.76 -59.39 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-N 119.521 1.055 . . . . 1.0700000000000001 111.544 171.2 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -70.94 -15.92 62.62 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.809 -1.182 . . . . 1.71 113.429 -178.361 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -78.97 -12.67 60.04 Favored 'General case' 0 CA--C 1.551 0.984 0 O-C-N 120.468 -1.395 . . . . 3.6899999999999999 112.187 167.534 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -111.72 -31.75 6.87 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.954 1.702 . . . . 3.6000000000000001 114.439 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -63.77 -6.65 6.02 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 121.241 1.837 . . . . 2.6200000000000001 111.922 164.37 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -108.12 -80.16 0.57 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.356 1.462 . . . . 2.0299999999999998 111.272 168.206 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 . . . . . 0 N--CA 1.477 0.895 0 C-N-CA 130.783 3.633 . . . . 3.8399999999999999 115.433 -178.028 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.142 0 N-CA-C 117.13 2.271 . . . . 3.0299999999999998 117.13 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.3 p 53.19 -172.4 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.33 2.652 . . . . 2.0600000000000001 111.21 -162.465 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -94.04 -40.63 9.98 Favored 'General case' 0 C--O 1.222 -0.388 0 O-C-N 120.902 -1.124 . . . . 2.77 110.865 158.044 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.12 -38.83 74.02 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.763 0.825 . . . . 0.93000000000000005 111.02 -171.087 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -69.53 -62.92 1.19 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 118.631 -0.7 . . . . 2.5299999999999998 111.105 -178.66 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -54.43 -29.76 50.38 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 120.429 1.468 . . . . 6.1399999999999997 113.743 172.495 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.83 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -70.36 -43.78 69.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 120.186 1.357 . . . . 0.52000000000000002 111.254 173.341 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.0 t -57.24 -42.61 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 121.008 1.731 . . . . 0.81000000000000005 110.429 168.089 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.7 mt -55.32 -46.87 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-N 119.712 1.142 . . . . 1.0900000000000001 111.55 171.344 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.0 t -64.41 -41.34 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 120.234 1.379 . . . . 0.63 112.57 178.541 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.7 mp -64.21 -35.84 82.13 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.384 0.673 . . . . 0.96999999999999997 111.308 175.01 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.1 t -73.66 -35.72 44.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.707 1.603 . . . . 0.90000000000000002 112.176 175.018 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -61.04 -58.02 10.17 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.309 1.044 . . . . 3.73 109.987 176.435 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -55.77 -14.96 2.62 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.17 1.544 . . . . 2.29 115.17 179.764 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -80.03 -66.07 0.92 Allowed 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.367 -1.458 . . . . 2.0899999999999999 111.613 162.592 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -62.41 -26.95 68.76 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.174 1.176 . . . . 2.54 114.174 -172.724 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.567 ' HE3' ' CE1' ' A' ' 22' ' ' TYR . 5.7 ttpp -50.47 -19.94 1.0 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.802 2.041 . . . . 5.1500000000000004 115.108 174.793 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.567 ' CE1' ' HE3' ' A' ' 21' ' ' LYS . 91.5 m-85 -103.7 -11.73 17.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.103 1.361 . . . . 2.77 114.103 177.15 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.471 0.616 0 CA-C-N 118.927 0.785 . . . . 3.0699999999999998 110.877 176.036 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.8 tt . . . . . 0 N--CA 1.471 0.608 0 CA-C-O 123.207 1.48 . . . . 2.71 108.961 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -64.44 165.64 9.52 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 114.803 -1.089 . . . . 2.73 109.06 169.42 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.488 ' HB3' HG23 ' A' ' 63' ' ' ILE . 3.6 mppt? -45.37 -33.75 2.68 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.941 1.089 . . . . 2.5099999999999998 113.941 173.486 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 6.9 m -58.44 -33.76 70.07 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.893 1.442 . . . . 2.0299999999999998 114.893 174.707 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.0 m -85.62 -37.64 19.29 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.087 0.858 . . . . 1.3100000000000001 111.72 -177.859 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.487 ' CE2' HD11 ' A' ' 42' ' ' LEU . 79.7 t80 -58.57 -49.52 77.12 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.295 -0.878 . . . . 2.4399999999999999 111.818 179.177 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -59.78 -29.65 68.35 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.107 1.151 . . . . 3.1499999999999999 114.107 177.771 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -86.29 -51.1 6.46 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.746 1.618 . . . . 3.3900000000000001 110.312 -176.242 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 15.4 tmm? -51.25 -37.27 46.16 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.751 1.22 . . . . 1.5 112.439 170.411 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.487 HD11 ' CE2' ' A' ' 38' ' ' PHE . 16.8 mt -70.29 -4.44 22.0 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 116.282 1.956 . . . . 1.55 116.282 174.618 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -103.7 -4.29 23.92 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.489 1.495 . . . . 2.23 114.009 163.11 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -54.11 3.53 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.19 0.996 . . . . 1.8799999999999999 113.027 168.776 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -84.91 -22.45 29.28 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.199 1.555 . . . . 3.1400000000000001 115.199 -166.205 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.403 HD23 ' HG3' ' B' ' 112' ' ' GLU . 1.9 mt -126.73 50.55 1.93 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.889 2.076 . . . . 1.8899999999999999 108.504 -177.488 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -91.13 -23.14 20.37 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.519 1.303 . . . . 1.5900000000000001 114.519 -166.323 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.423 ' NE2' ' HA ' ' B' ' 108' ' ' TYR . 22.7 m-70 -90.91 -33.93 15.41 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.285 1.034 . . . . 1.45 112.464 -170.785 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.7 ptp -66.91 -4.51 9.61 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.343 1.457 . . . . 3.21 114.275 173.756 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.3 tp -76.11 117.57 17.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 125.961 1.704 . . . . 3.0099999999999998 111.837 -161.163 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.1 m -75.61 56.62 0.91 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.89 -1.131 . . . . 5.1399999999999997 111.348 161.19 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.565 ' CG ' ' H ' ' A' ' 53' ' ' THR . 33.4 t70 52.32 -150.52 0.32 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 127.806 2.443 . . . . 4.6600000000000001 113.913 175.467 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.565 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 52.7 p -54.82 -32.46 60.47 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 127.953 2.501 . . . . 2.5299999999999998 112.092 170.192 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.91 -50.89 52.9 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 124.431 1.015 . . . . 1.6699999999999999 111.583 174.949 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.23 -36.95 82.75 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 117.492 0.646 . . . . 3.5299999999999998 112.603 173.481 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.475 HH22 ' HB3' ' A' ' 42' ' ' LEU . 2.0 mmp_? -56.01 -34.15 65.54 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.417 -1.427 . . . . 5.5 113.089 -178.369 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -64.37 -22.25 66.89 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.858 1.429 . . . . 4.0300000000000002 114.858 173.165 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.83 -17.93 59.65 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.589 1.156 . . . . 1.1100000000000001 114.081 169.143 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -79.41 -51.04 9.91 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.257 0.935 . . . . 0.75 110.804 163.971 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -70.49 -23.31 62.65 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.757 1.021 . . . . 2.3199999999999998 113.757 -174.918 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -56.43 -30.06 62.37 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.524 1.511 . . . . 3.1800000000000002 112.464 167.091 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.475 ' HB3' HD22 ' A' ' 82' ' ' LEU . 15.7 mt -81.01 -32.65 34.12 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.663 0.785 . . . . 1.1299999999999999 112.109 -179.039 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.488 HG23 ' HB3' ' A' ' 35' ' ' LYS . 27.0 mm -60.36 -49.68 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.115 1.366 . . . . 1.02 111.489 174.858 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -64.05 -38.01 89.5 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.347 0.659 . . . . 2.2200000000000002 112.074 175.794 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -61.97 -30.95 71.27 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.95 0.9 . . . . 3.3300000000000001 112.876 175.221 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.7 mt -88.51 -19.4 26.47 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 114.847 1.425 . . . . 2.4900000000000002 114.847 169.992 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -20.26 64.13 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.884 1.674 . . . . 3.6400000000000001 112.122 170.481 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.37 -17.68 51.23 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.556 1.687 . . . . 2.1800000000000002 115.556 166.61 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -118.22 -21.83 7.99 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.673 1.578 . . . . 2.8799999999999999 114.476 -174.272 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.05 160.61 42.98 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.503 1.047 . . . . 4.3499999999999996 112.115 -162.674 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -98.27 -116.05 0.14 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.432 1.893 . . . . 6.1200000000000001 111.829 -175.108 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -90.24 -3.33 72.73 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 125.425 1.488 . . . . 4.6299999999999999 113.471 159.07 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.4 mmt-85 -84.48 165.44 18.1 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.314 1.557 . . . . 8.3599999999999994 112.304 164.538 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.3 pp -149.56 156.06 7.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 130.264 3.426 . . . . 3.46 107.787 174.109 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.4 t -97.77 175.32 6.21 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.588 1.155 . . . . 1.71 112.27 167.047 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -66.51 -54.61 21.97 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.366 1.066 . . . . 2.52 112.643 178.295 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.52 -30.42 70.62 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 126.232 1.813 . . . . 2.98 111.655 -175.936 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -64.3 -54.38 34.09 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 117.79 -1.1 . . . . 3.9399999999999999 111.014 175.415 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -50.9 -48.14 60.53 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 120.642 1.564 . . . . 2.4399999999999999 111.955 177.854 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.8 t-105 -60.94 -43.13 99.08 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 119.292 -0.385 . . . . 0.68999999999999995 111.54 179.659 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 87.2 m -60.87 -39.5 89.4 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.398 1.479 . . . . 1.8200000000000001 111.966 173.17 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.475 HD22 ' HB3' ' A' ' 62' ' ' LEU . 94.1 mt -60.68 -55.39 33.81 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-O 118.121 -0.942 . . . . 0.82999999999999996 110.35 177.013 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.4 mm -47.52 -42.36 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 CA-C-N 119.583 1.083 . . . . 0.82999999999999996 112.919 -176.82 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.15 -30.06 69.77 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-O 118.943 -0.92 . . . . 0.71999999999999997 113.292 177.479 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.14 -21.64 64.81 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 118.259 -1.301 . . . . 0.57999999999999996 115.423 -177.366 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.0 mp -86.14 -39.67 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 CA-C-N 119.231 1.515 . . . . 1.3200000000000001 110.587 168.537 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 33.8 m -69.73 -39.91 76.53 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.979 1.711 . . . . 3.2599999999999998 111.549 -174.671 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -27.49 -67.02 0.07 OUTLIER Glycine 0 CA--C 1.535 1.332 0 C-N-CA 128.241 2.829 . . . . 1.0900000000000001 116.391 -175.396 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.8 -33.56 2.18 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.147 2.565 . . . . 0.96999999999999997 113.41 -173.626 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.4 pt -82.72 -20.97 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 118.981 0.81 . . . . 1.3999999999999999 113.177 -175.987 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -52.68 -50.29 63.58 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.072 2.149 . . . . 0.93999999999999995 113.107 -178.175 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -48.11 -53.7 15.73 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.744 0.783 . . . . 3.6000000000000001 110.981 172.888 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.95 -38.35 76.1 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 118.211 -0.9 . . . . 2.1000000000000001 111.549 -172.925 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 25.7 mt -47.6 -62.87 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.458 1.103 . . . . 1.9099999999999999 111.4 165.996 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -59.8 -42.37 93.28 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.959 0.8 . . . . 1.8600000000000001 111.245 -177.164 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.394 3.3 pt-20 -77.32 -9.01 58.57 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 121.226 -0.921 . . . . 2.8700000000000001 112.534 -178.505 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -88.17 -26.59 22.34 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 116.589 2.07 . . . . 2.3399999999999999 116.589 165.096 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -68.74 0.25 4.51 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 120.62 1.554 . . . . 2.9399999999999999 111.576 169.866 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 . . . . . 0 CA--C 1.532 0.285 0 C-N-CA 127.682 2.393 . . . . 3.2599999999999998 110.84 -176.213 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.423 ' HA ' ' NE2' ' A' ' 48' ' ' HIS . 0.3 OUTLIER . . . . . 0 CA--C 1.556 1.206 0 N-CA-C 115.446 1.647 . . . . 3.04 115.446 . . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 14.2 p 47.41 -161.0 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 127.974 2.509 . . . . 2.3900000000000001 111.081 -153.93 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -102.28 -33.99 9.39 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 120.082 1.31 . . . . 2.6200000000000001 111.487 149.071 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.11 -42.17 72.61 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.337 0.655 . . . . 0.87 109.763 -169.727 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 112' ' ' GLU . . . . . 0.403 ' HG3' HD23 ' A' ' 46' ' ' LEU . 17.1 tt0 -64.43 -64.11 0.96 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.499 -1.238 . . . . 2.5499999999999998 111.485 176.464 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -51.84 -31.79 29.18 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 121.762 2.074 . . . . 6.75 114.095 177.155 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.83 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -74.55 -41.34 60.75 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.789 1.177 . . . . 0.71999999999999997 112.501 174.983 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 39.5 t -60.0 -42.91 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-N 120.55 1.523 . . . . 1.0700000000000001 110.107 166.71 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 6.3 mt -54.36 -48.79 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-O 117.812 -1.089 . . . . 1.28 109.919 171.061 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.6 t -60.59 -43.06 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 120.643 1.565 . . . . 0.81000000000000005 112.859 177.677 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 3.6 mp -60.44 -41.99 95.19 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.958 0.799 . . . . 1.1599999999999999 111.997 173.939 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 40.2 t -69.39 -41.23 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 125.477 1.511 . . . . 1.1100000000000001 111.985 177.659 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.91 -57.07 14.18 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 124.401 1.081 . . . . 4.1100000000000003 108.326 179.235 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -52.43 -24.75 8.41 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.461 1.282 . . . . 2.29 114.461 -178.775 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -74.08 -62.96 1.33 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.453 1.024 . . . . 2.25 112.079 168.672 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -62.49 -25.77 68.18 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.298 0.851 . . . . 2.6200000000000001 113.298 -176.294 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -43.56 -30.27 0.57 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.345 2.658 . . . . 3.0099999999999998 115.338 172.062 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -96.21 -13.3 23.58 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.999 1.111 . . . . 2.6699999999999999 113.999 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . 0.256 4.4 m . . . . . 0 CA--C 1.543 0.695 0 CA-C-O 121.893 0.854 . . . . 3.0299999999999998 111.898 -174.179 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 4.4 tt . . . . . 0 N--CA 1.471 0.583 0 CA-C-O 122.922 1.344 . . . . 2.5299999999999998 110.12 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 10.5 m -61.79 160.63 11.55 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.188 -0.914 . . . . 2.8100000000000001 109.406 165.192 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 138' ' ' LYS . . . . . 0.548 ' HB3' HG23 ' B' ' 166' ' ' ILE . 2.4 mppt? -43.71 -31.83 0.88 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 115.461 1.652 . . . . 2.48 115.461 177.103 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.7 m -55.07 -34.88 63.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.628 1.571 . . . . 1.9399999999999999 115.067 173.836 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.5 m -78.55 -41.54 31.8 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.726 1.148 . . . . 1.3100000000000001 111.947 -179.936 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.489 ' CE2' HD11 ' B' ' 145' ' ' LEU . 79.9 t80 -57.74 -45.84 85.28 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 120.997 -1.064 . . . . 2.21 112.401 -177.191 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -63.24 -27.84 69.63 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.929 1.085 . . . . 3.3700000000000001 113.929 177.675 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -87.19 -49.67 7.13 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 124.445 1.098 . . . . 3.3799999999999999 109.629 -177.681 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 14.4 tmm? -50.21 -37.65 36.38 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.741 2.017 . . . . 1.3799999999999999 113.127 171.63 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 145' ' ' LEU . . . . . 0.489 HD11 ' CE2' ' B' ' 141' ' ' PHE . 17.5 mt -68.7 -0.6 5.48 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 116.799 2.148 . . . . 1.72 116.799 174.037 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -114.94 11.2 16.5 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.087 1.143 . . . . 2.0499999999999998 114.087 161.221 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.44 -56.8 2.21 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.816 1.246 . . . . 1.8400000000000001 112.993 166.806 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -75.97 -27.21 57.42 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.009 -1.057 . . . . 2.6299999999999999 113.704 -173.014 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 2.2 mt -128.3 56.1 1.64 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 127.023 2.129 . . . . 1.8500000000000001 107.929 -172.307 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -102.58 -15.76 16.29 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.481 1.512 . . . . 1.3300000000000001 115.022 -166.398 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -94.96 -34.9 12.2 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 120.96 -1.087 . . . . 1.3999999999999999 110.957 179.394 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 9.6 ptp -68.0 -3.06 8.85 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.533 0.938 . . . . 3.1299999999999999 113.533 166.129 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 28.5 tp -71.72 105.5 3.75 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.124 -0.985 . . . . 2.8500000000000001 111.049 -170.116 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 5.4 m -79.78 54.25 1.8 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.157 0.98 . . . . 4.75 111.323 169.556 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 155' ' ' ASP . . . . . 0.583 ' CG ' ' H ' ' B' ' 156' ' ' THR . 27.4 t70 53.23 -153.75 0.25 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 128.551 2.74 . . . . 4.7800000000000002 115.018 171.786 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 156' ' ' THR . . . . . 0.583 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 41.4 p -54.9 -36.36 65.09 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 128.671 2.789 . . . . 2.8300000000000001 112.176 175.61 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.8 -46.73 89.65 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 123.811 0.719 . . . . 1.8500000000000001 111.604 175.75 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -72.26 -34.36 68.18 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.042 0.937 . . . . 3.4399999999999999 113.188 174.059 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 159' ' ' ARG . . . . . 0.458 HH22 ' HB3' ' B' ' 145' ' ' LEU . 2.1 mmp_? -58.49 -35.02 71.57 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.252 -1.53 . . . . 5.54 112.596 177.182 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -63.34 -25.65 68.4 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.23 1.567 . . . . 4.2699999999999996 115.23 171.5 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -76.37 -18.38 58.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.134 1.161 . . . . 1.05 114.134 170.787 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.33 -52.75 7.7 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.179 0.9 . . . . 0.83999999999999997 110.708 163.043 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -68.39 -25.05 64.86 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.335 0.865 . . . . 2.0899999999999999 113.335 -174.091 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -57.87 -30.39 65.78 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.327 -1.483 . . . . 2.9300000000000002 112.615 168.747 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 165' ' ' LEU . . . . . 0.453 ' HB3' HD22 ' B' ' 185' ' ' LEU . 15.9 mt -80.79 -29.87 36.03 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.314 0.646 . . . . 1.1000000000000001 112.104 -177.879 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 166' ' ' ILE . . . . . 0.548 HG23 ' HB3' ' B' ' 138' ' ' LYS . 36.2 mm -61.13 -51.06 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.172 1.389 . . . . 1.0 111.049 174.77 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -66.01 -35.81 81.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.76 0.824 . . . . 2.1600000000000001 112.604 176.348 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -62.4 -35.91 80.67 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.81 0.844 . . . . 3.2400000000000002 112.03 173.763 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.6 tp -86.71 -21.39 26.65 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.593 0.96 . . . . 3.1699999999999999 113.593 178.211 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -63.05 -23.65 67.55 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.894 0.877 . . . . 3.6699999999999999 112.376 173.458 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.13 -11.24 60.75 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.761 1.393 . . . . 2.3300000000000001 114.761 169.623 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -125.46 -23.39 4.11 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.274 1.213 . . . . 2.8599999999999999 114.274 -172.417 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.26 158.16 43.5 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.433 -0.792 . . . . 4.2000000000000002 112.743 -160.229 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -103.19 -118.13 0.2 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 127.392 2.277 . . . . 6.0199999999999996 111.737 -172.392 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -87.41 -4.88 80.03 Favored Glycine 0 CA--C 1.534 1.279 0 CA-C-O 118.265 -1.297 . . . . 4.5599999999999996 113.703 159.869 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.6 mmt-85 -83.17 164.82 19.95 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 119.783 1.791 . . . . 8.4700000000000006 112.282 162.62 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 1.6 pp -146.67 153.89 12.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 129.628 3.171 . . . . 3.7200000000000002 107.099 173.02 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 8.4 t -97.98 176.51 5.75 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.974 0.909 . . . . 1.6200000000000001 111.43 166.246 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -74.35 -52.29 12.63 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.428 0.899 . . . . 2.4100000000000001 113.428 -176.39 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -58.6 -29.28 66.33 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.453 1.901 . . . . 3.1699999999999999 111.548 -179.485 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -64.5 -55.93 17.42 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-O 118.027 -0.987 . . . . 4.0 110.811 175.345 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -50.24 -49.01 54.29 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.422 1.464 . . . . 2.4100000000000001 112.497 178.949 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -62.52 -40.66 97.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.926 0.49 . . . . 0.68999999999999995 111.708 179.958 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 97.9 m -64.09 -37.6 88.03 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.434 1.494 . . . . 1.8999999999999999 111.706 173.298 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 185' ' ' LEU . . . . . 0.453 HD22 ' HB3' ' B' ' 165' ' ' LEU . 87.5 mt -60.13 -51.22 70.52 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.21 0.914 . . . . 0.77000000000000002 110.523 175.624 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 47.4 mm -46.3 -42.26 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-N 119.631 1.105 . . . . 0.68999999999999995 113.078 -177.589 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.14 -31.65 79.65 Favored Glycine 0 CA--C 1.533 1.212 0 CA-C-O 119.193 -0.781 . . . . 0.81999999999999995 113.467 178.732 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.38 -24.75 69.93 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-N 118.826 1.313 . . . . 0.68999999999999995 114.528 -177.011 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -87.8 -37.51 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 CA-C-N 118.682 1.241 . . . . 1.48 111.471 169.03 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 22.8 m -80.81 -40.0 25.7 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.482 1.113 . . . . 3.3100000000000001 112.612 -169.325 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -45.08 -48.18 9.92 Favored Glycine 0 CA--C 1.538 1.526 0 CA-C-O 117.416 -1.769 . . . . 0.93999999999999995 116.249 -172.926 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.52 -32.88 7.4 Favored 'Trans proline' 0 C--N 1.353 0.809 0 CA-C-N 121.05 2.425 . . . . 1.0900000000000001 113.05 -179.738 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 41.2 pt -85.14 -20.44 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 113.218 0.822 . . . . 1.25 113.218 179.979 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -51.89 -45.78 64.29 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 127.399 2.28 . . . . 0.87 111.967 -178.033 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -55.27 -49.18 72.73 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.11 0.564 . . . . 3.7599999999999998 111.222 175.399 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.09 -35.49 61.78 Favored 'General case' 0 C--O 1.222 -0.373 0 O-C-N 121.228 -0.92 . . . . 2.1000000000000001 111.675 -175.469 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 27.2 mt -48.75 -62.43 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.82 1.248 . . . . 1.75 110.421 166.457 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -60.25 -45.04 94.63 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.931 -0.481 . . . . 1.8999999999999999 111.041 -176.242 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.383 3.1 pt-20 -78.39 -8.06 58.04 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.406 0.521 . . . . 2.7799999999999998 112.406 -174.401 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -78.88 -27.8 44.04 Favored 'General case' 0 C--N 1.346 0.452 0 C-N-CA 126.551 1.941 . . . . 2.3300000000000001 115.324 162.905 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -74.19 5.52 4.36 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 121.055 1.752 . . . . 2.4300000000000002 111.159 172.57 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -127.94 -67.85 0.8 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.435 2.294 . . . . 2.4399999999999999 110.144 -176.991 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 . . . . . 0 N--CA 1.478 0.928 0 C-N-CA 129.806 3.242 . . . . 4.4199999999999999 115.803 167.441 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 . . . . . 0 CA--C 1.556 1.184 0 N-CA-C 113.45 0.908 . . . . 2.4300000000000002 113.45 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.4 p -70.81 159.37 34.7 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 125.275 1.43 . . . . 1.2 111.928 -174.692 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -61.76 -39.5 91.82 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 120.469 1.486 . . . . 2.3700000000000001 112.904 -178.425 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.19 -47.25 81.73 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.671 0.748 . . . . 0.77000000000000002 110.469 175.082 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.66 -52.4 31.6 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.835 0.854 . . . . 2.8999999999999999 111.726 -177.044 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -56.73 -32.09 65.19 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 119.842 -1.786 . . . . 5.0300000000000002 113.765 169.731 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.868 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.63 -39.88 91.96 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 120.745 -1.222 . . . . 0.5 111.634 172.693 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 95.4 t -59.0 -33.67 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-N 119.401 1.001 . . . . 0.64000000000000001 111.074 166.063 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.7 mt -58.54 -59.08 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 CA-C-N 120.469 1.486 . . . . 0.93999999999999995 111.558 164.139 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 23.1 t -55.02 -38.6 46.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.149 1.38 . . . . 0.64000000000000001 112.926 -176.945 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -65.7 -27.61 68.46 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.465 -1.397 . . . . 0.92000000000000004 112.563 174.36 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.0 t -94.87 -19.72 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.137 1.375 . . . . 1.03 111.343 -179.552 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -59.8 -54.24 48.52 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 120.342 1.428 . . . . 4.0099999999999998 110.083 153.573 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.434 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 25.8 t30 -54.18 -34.29 60.15 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 118.921 0.782 . . . . 2.2400000000000002 112.948 -178.344 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -80.32 -48.51 12.88 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.243 0.831 . . . . 2.1899999999999999 113.243 174.144 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -73.5 -22.29 60.18 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 114.23 1.196 . . . . 2.6200000000000001 114.23 -173.039 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.434 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 9.3 ptmt -48.86 -34.98 13.64 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 120.872 1.669 . . . . 2.77 113.064 176.134 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -74.4 -40.27 62.14 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 114.03 1.122 . . . . 2.52 114.03 178.529 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.476 0.832 0 CA-C-N 118.921 0.782 . . . . 3.0299999999999998 112.244 177.025 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.7 pt . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 115.123 1.527 . . . . 2.1299999999999999 115.123 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 97.6 p -101.02 140.75 34.89 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 120.692 -1.255 . . . . 3.5299999999999998 108.375 152.879 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.413 ' HE2' HD12 ' A' ' 66' ' ' LEU . 14.8 mttt -71.44 -18.95 62.29 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.19 -0.944 . . . . 2.75 112.582 -171.846 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.9 m -48.43 -30.34 4.97 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.264 1.026 . . . . 2.29 113.621 159.323 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 t -65.28 -35.16 80.17 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 117.477 -1.249 . . . . 2.6000000000000001 111.761 176.443 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -59.3 -48.89 79.94 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 120.929 1.695 . . . . 1.8 111.844 174.881 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.0 ptt85 -62.97 -29.74 71.04 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.346 0.976 . . . . 4.3899999999999997 111.463 176.606 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -83.96 -39.84 19.25 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 114.008 1.114 . . . . 3.1099999999999999 114.008 -175.874 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.7 tmm? -51.67 -47.8 63.68 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 126.331 1.853 . . . . 1.7 110.67 162.379 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -55.47 -50.82 68.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.487 0.585 . . . . 1.05 112.393 169.227 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -79.14 -9.17 59.48 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 115.758 1.762 . . . . 3.0299999999999998 115.758 -175.786 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -98.16 -51.68 3.93 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.256 1.423 . . . . 1.4399999999999999 114.078 167.724 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -89.67 -43.21 10.89 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.093 0.957 . . . . 2.8999999999999999 111.966 -168.9 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.58 38.55 2.13 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.049 1.34 . . . . 1.8999999999999999 110.742 -168.526 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -96.55 -17.78 20.24 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 116.085 1.883 . . . . 2.3599999999999999 116.085 -149.257 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 -92.17 -38.9 11.87 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.446 1.498 . . . . 1.9399999999999999 113.142 -162.939 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 68.4 mtm -77.0 -18.9 57.89 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.021 -1.049 . . . . 2.75 113.367 170.479 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.1 tt -56.52 -31.24 63.93 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.128 0.971 . . . . 5.7999999999999998 112.68 -155.401 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.1 m 83.5 109.66 0.06 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.349 2.26 . . . . 5.1500000000000004 111.494 169.477 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 t70 66.42 -163.14 0.24 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.904 1.682 . . . . 4.4400000000000004 113.669 168.169 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.4 m -87.14 -31.56 20.34 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.274 1.429 . . . . 2.2400000000000002 109.913 157.03 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.2 -42.21 72.22 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.793 1.187 . . . . 1.98 114.154 -174.773 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -76.38 -20.62 56.98 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.902 1.351 . . . . 4.7300000000000004 112.955 177.983 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.6 mtt85 -69.72 -37.92 76.72 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.0 -1.688 . . . . 7.0599999999999996 112.43 164.279 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 mmmt -59.07 -40.35 84.94 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.417 1.008 . . . . 4.2699999999999996 111.373 170.411 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.48 ' HA ' ' HE3' ' A' ' 61' ' ' LYS . . . -59.14 -40.44 85.48 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 117.833 -1.08 . . . . 1.6699999999999999 113.739 173.143 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.412 ' HB2' HG12 ' A' ' 86' ' ' ILE . . . -58.04 -46.88 84.64 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.663 1.185 . . . . 1.01 112.368 167.32 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -62.79 -34.06 76.49 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.036 0.934 . . . . 2.4300000000000002 112.891 -175.681 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.48 ' HE3' ' HA ' ' A' ' 58' ' ' ALA . 8.0 mtmp? -47.69 -44.0 27.1 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 122.979 1.371 . . . . 2.9900000000000002 113.102 169.488 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.1 mt -69.36 -43.05 74.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 113.615 -1.629 . . . . 1.01 110.491 -174.708 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.1 mm -53.8 -54.57 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.669 1.588 . . . . 1.27 110.56 178.806 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -64.13 -37.75 88.58 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 123.699 0.799 . . . . 2.8300000000000001 112.377 -178.001 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -44.34 82.46 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 121.512 0.672 . . . . 3.77 112.232 168.355 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.413 HD12 ' HE2' ' A' ' 35' ' ' LYS . 0.2 OUTLIER -72.21 -34.06 68.08 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.012 0.925 . . . . 2.3900000000000001 110.922 -174.429 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -77.78 -30.92 51.64 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.829 1.048 . . . . 3.5699999999999998 113.829 171.26 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.27 -31.63 58.38 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.852 1.056 . . . . 2.8500000000000001 113.852 176.833 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.51 57.94 1.19 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.484 1.113 . . . . 4.3099999999999996 113.084 -173.49 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.77 5.05 0.06 Allowed 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 116.594 2.072 . . . . 4.4100000000000001 116.594 167.301 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.0 t70 59.65 -150.36 0.43 Allowed 'General case' 0 CA--C 1.557 1.216 0 CA-C-N 120.004 1.274 . . . . 4.0 110.102 -175.959 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -93.91 11.63 70.6 Favored Glycine 0 CA--C 1.533 1.183 0 O-C-N 119.962 -1.711 . . . . 2.48 112.603 158.231 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.2 mmt-85 -80.28 70.71 6.98 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.524 1.662 . . . . 4.6200000000000001 111.452 -176.931 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.8 mt -63.33 139.47 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 124.766 1.226 . . . . 2.1699999999999999 109.814 174.614 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.5 m -117.23 158.74 23.79 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.321 1.048 . . . . 1.6399999999999999 109.817 168.351 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -46.23 -47.73 17.91 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 123.151 1.453 . . . . 1.8400000000000001 112.247 172.689 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.21 -16.99 63.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 129.4 3.08 . . . . 3.1499999999999999 112.74 -175.303 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -58.47 -59.27 5.63 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.466 1.106 . . . . 4.2800000000000002 110.812 175.335 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -55.33 -47.67 75.32 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.567 -0.708 . . . . 1.9199999999999999 111.152 -178.473 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -62.56 -47.01 85.72 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.485 0.55 . . . . 0.55000000000000004 112.485 -178.365 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.3 t -69.78 -39.61 76.55 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.503 0.721 . . . . 1.5600000000000001 111.758 -179.538 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 44.2 mt -58.1 -46.13 86.05 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 118.001 -0.999 . . . . 0.82999999999999996 111.85 175.442 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 20.9 mm -50.56 -37.26 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 CA-C-N 119.549 1.068 . . . . 0.94999999999999996 112.775 -178.007 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.01 -20.07 47.74 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 119.686 1.13 . . . . 0.93999999999999995 114.189 176.258 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.99 0.78 82.12 Favored Glycine 0 CA--C 1.532 1.124 0 O-C-N 120.743 -1.445 . . . . 0.96999999999999997 114.48 175.32 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.412 HG12 ' HB2' ' A' ' 59' ' ' ALA . 0.7 OUTLIER -134.72 -45.44 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 126.193 1.797 . . . . 1.0 110.668 174.752 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 95.5 m -76.18 71.3 2.9 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.677 1.991 . . . . 1.45 107.131 163.024 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -149.77 -77.98 0.02 OUTLIER Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.212 1.387 . . . . 0.95999999999999996 111.077 -179.711 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -62.23 -34.14 79.21 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 123.227 2.618 . . . . 1.46 113.617 -176.634 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -82.95 0.06 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 114.549 1.314 . . . . 1.3700000000000001 114.549 179.839 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -35.88 -61.06 0.5 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.329 2.651 . . . . 2.3399999999999999 115.756 -176.158 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.51 -40.33 65.33 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.024 -1.047 . . . . 4.4299999999999997 111.719 176.296 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.3 tt -66.73 -42.29 86.52 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.432 0.693 . . . . 2.1400000000000001 109.898 -176.704 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.7 mt -51.29 -54.5 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.0 0.92 . . . . 2.8199999999999998 110.2 169.788 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -41.08 96.21 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.614 -0.679 . . . . 2.9900000000000002 112.733 -179.606 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -93.63 0.66 56.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.951 0.901 . . . . 3.2000000000000002 112.666 -169.051 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -29.82 70.3 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 125.821 1.649 . . . . 5.7199999999999998 112.501 163.856 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.475 ' CD ' HG21 ' B' ' 116' ' ' ILE . 3.2 mm-40 -74.09 8.09 2.3 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.415 1.086 . . . . 3.8399999999999999 111.957 171.529 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.466 0.336 0 C-N-CA 124.947 1.299 . . . . 4.21 109.644 174.754 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 121.386 0.612 . . . . 2.4199999999999999 110.28 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 20.8 p -71.11 163.38 27.72 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.468 1.507 . . . . 1.24 111.458 -173.892 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.51 -34.73 78.95 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 117.875 -1.059 . . . . 2.98 112.621 178.857 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.09 -50.2 64.89 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.971 1.26 . . . . 0.90000000000000002 109.119 172.621 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -67.51 -54.02 23.63 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.158 0.799 . . . . 2.54 113.158 -176.194 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -57.42 -30.55 65.07 Favored 'General case' 0 C--O 1.225 -0.187 0 O-C-N 120.759 -1.213 . . . . 4.4400000000000004 113.215 172.313 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 114' ' ' ALA . . . . . 0.868 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.36 -43.09 78.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 118.211 -0.899 . . . . 0.56999999999999995 112.326 169.134 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 77.2 t -54.95 -36.12 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 120.353 1.433 . . . . 0.68999999999999995 110.452 167.267 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 116' ' ' ILE . . . . . 0.475 HG21 ' CD ' ' A' ' 98' ' ' GLU 0.265 34.7 mt -60.9 -60.27 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 117.085 -1.436 . . . . 0.98999999999999999 112.129 166.972 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 21.9 t -51.74 -38.56 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 121.124 1.784 . . . . 0.57999999999999996 112.576 -179.685 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 9.8 mp -63.62 -36.74 84.8 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.096 -1.002 . . . . 0.93999999999999995 111.895 173.424 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 72.3 t -90.22 -29.55 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 117.4 -1.286 . . . . 1.0 112.456 -177.708 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 120' ' ' GLU . . . . . 0.418 ' CD ' ' HZ2' ' B' ' 124' ' ' LYS . 9.3 tm-20 -53.01 -50.44 64.21 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 121.359 1.89 . . . . 3.29 108.724 157.684 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 121' ' ' ASN . . . . . 0.511 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 26.9 t30 -65.22 -25.16 67.57 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.837 1.051 . . . . 2.1600000000000001 113.837 -173.447 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -77.48 -50.13 13.29 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 120.963 -1.086 . . . . 2.4500000000000002 112.242 165.369 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -64.87 -27.13 68.66 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 117.134 -1.413 . . . . 2.6200000000000001 113.788 -170.148 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 124' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 2.6 ptmt -52.63 -32.83 43.8 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 121.841 2.11 . . . . 2.0099999999999998 112.911 174.792 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -73.32 -23.87 60.31 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.43 1.27 . . . . 2.4199999999999999 114.43 179.252 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 31.3 m . . . . . 0 N--CA 1.483 1.2 0 CA-C-N 119.067 0.849 . . . . 2.7400000000000002 112.99 170.46 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 34.8 pt . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 113.731 1.012 . . . . 2.6499999999999999 113.731 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 90.3 p -108.4 142.57 38.57 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 119.446 -2.034 . . . . 3.1099999999999999 107.74 153.212 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 138' ' ' LYS . . . . . 0.469 ' CD ' ' HB3' ' B' ' 169' ' ' LEU . 20.8 mttp -67.53 -21.96 65.45 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.054 -1.029 . . . . 2.79 110.99 179.895 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 2.9 m -50.2 -23.07 1.99 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.324 1.602 . . . . 2.1800000000000002 115.324 162.1 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 21.7 t -70.35 -34.58 72.81 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 120.309 -1.495 . . . . 2.2799999999999998 112.761 169.92 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -64.52 -44.52 90.62 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 118.299 -0.858 . . . . 2.1699999999999999 112.334 178.805 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 16.4 ptt85 -57.88 -34.04 69.35 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.681 1.128 . . . . 4.0300000000000002 110.821 172.014 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 143' ' ' GLU . . . . . 0.472 ' HA ' ' HG2' ' B' ' 146' ' ' GLN . 6.2 tt0 -86.75 -38.55 16.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 113.977 1.103 . . . . 2.9900000000000002 113.977 -169.144 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.6 tmm? -62.31 -37.58 86.1 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.856 -0.528 . . . . 1.1899999999999999 110.941 165.927 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 12.6 mt -64.81 -41.67 95.6 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 120.658 -1.276 . . . . 1.0800000000000001 113.844 169.778 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 146' ' ' GLN . . . . . 0.5 ' HB2' ' HE ' ' B' ' 159' ' ' ARG . 14.3 pt20 -73.71 -19.91 60.68 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 114.05 1.13 . . . . 3.1800000000000002 114.05 -175.665 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -91.29 -68.54 0.79 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.826 2.05 . . . . 2.3700000000000001 113.005 168.954 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -65.96 -27.22 68.0 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.655 1.57 . . . . 3.6400000000000001 113.792 -167.233 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.25 6.1 42.79 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.245 1.018 . . . . 2.3399999999999999 112.87 -179.817 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -52.09 -36.68 51.57 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.773 1.768 . . . . 2.4700000000000002 115.773 -160.833 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -67.25 -53.02 33.83 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.11 0.868 . . . . 1.8899999999999999 112.699 -168.318 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 38.0 mtm -73.2 -23.81 60.45 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.414 1.264 . . . . 2.9500000000000002 114.414 173.565 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 8.8 tt -50.76 -38.09 45.92 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-O 118.141 -0.933 . . . . 5.6500000000000004 112.823 -160.927 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 50.2 m 81.58 102.81 0.06 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.235 1.814 . . . . 5.1500000000000004 112.28 172.237 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 14.1 t70 69.8 -173.43 0.18 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.541 1.536 . . . . 4.6200000000000001 114.5 165.32 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 62.2 m -73.23 -38.61 65.97 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.939 1.696 . . . . 2.6099999999999999 110.0 162.579 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.49 -45.71 89.12 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.407 1.003 . . . . 1.97 113.742 -172.692 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -72.66 -20.01 61.33 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 118.813 1.306 . . . . 4.6399999999999997 112.71 178.909 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 159' ' ' ARG . . . . . 0.5 ' HE ' ' HB2' ' B' ' 146' ' ' GLN . 38.7 mtt85 -70.4 -38.06 74.58 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 120.057 -1.652 . . . . 7.3700000000000001 112.83 167.652 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -61.97 -37.64 85.56 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.174 -0.954 . . . . 4.4299999999999997 111.26 169.596 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 161' ' ' ALA . . . . . 0.47 ' HA ' ' HE3' ' B' ' 164' ' ' LYS . . . -60.5 -38.49 84.48 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 117.668 -1.158 . . . . 1.3100000000000001 113.602 170.428 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -58.12 -48.05 81.41 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.454 1.025 . . . . 0.81999999999999995 111.84 168.6 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -61.67 -32.87 73.07 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.062 1.134 . . . . 2.2999999999999998 114.062 -177.681 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 164' ' ' LYS . . . . . 0.47 ' HE3' ' HA ' ' B' ' 161' ' ' ALA . 8.2 mtmp? -46.64 -44.63 18.57 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-O 123.131 1.443 . . . . 3.1800000000000002 113.206 171.777 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 5.6 mt -72.8 -39.7 66.47 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.199 -1.819 . . . . 1.1499999999999999 111.274 -170.386 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 26.1 mm -53.66 -55.16 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 126.096 1.758 . . . . 1.4199999999999999 109.651 178.437 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -66.48 -38.4 87.22 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.254 1.022 . . . . 2.7599999999999998 112.832 -179.262 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -57.57 -15.05 6.23 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.625 1.17 . . . . 3.54 113.939 169.19 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 169' ' ' LEU . . . . . 0.469 ' HB3' ' CD ' ' B' ' 138' ' ' LYS . 3.4 mm? -108.63 -38.93 5.53 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.686 1.194 . . . . 2.0800000000000001 113.346 170.046 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -77.82 -25.57 48.92 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 119.443 -2.036 . . . . 3.9300000000000002 113.787 -177.674 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.32 -20.13 44.99 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.723 1.147 . . . . 3.75 113.782 176.09 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -159.82 20.79 0.17 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.083 1.512 . . . . 4.9400000000000004 115.083 -161.407 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.44 15.35 4.51 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 120.597 -1.314 . . . . 5.2000000000000002 113.915 171.922 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 14.3 t70 60.56 -155.05 0.36 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.701 1.6 . . . . 3.8999999999999999 110.649 177.517 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -94.09 15.95 62.03 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 120.278 -1.513 . . . . 2.3900000000000001 112.857 165.609 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 53.6 mmt-85 -78.02 51.41 0.97 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.099 1.45 . . . . 4.7999999999999998 112.39 -177.696 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 177' ' ' ILE . . . . . 0.402 HG12 ' HE3' ' B' ' 138' ' ' LYS . 39.7 mt -58.04 127.71 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.212 1.005 . . . . 2.8199999999999998 110.316 -175.394 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.3 m -113.23 168.57 9.61 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.141 1.163 . . . . 2.1099999999999999 114.141 -173.21 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -63.38 -58.49 6.93 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.01 1.324 . . . . 1.8700000000000001 111.13 170.695 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -67.92 -22.45 65.06 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.246 2.219 . . . . 3.5299999999999998 111.482 -172.134 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -57.6 -58.72 7.09 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 125.56 1.544 . . . . 3.27 110.882 169.833 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -50.46 -50.44 52.35 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.971 -0.456 . . . . 2.2400000000000002 110.824 179.418 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.3 t-105 -62.82 -46.39 88.15 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.396 0.679 . . . . 0.56000000000000005 112.762 -179.672 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.1 t -68.77 -33.89 74.64 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 118.638 0.654 . . . . 1.4399999999999999 111.387 -178.68 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 75.9 mt -61.69 -43.07 99.57 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 117.449 -1.262 . . . . 0.68999999999999995 112.143 172.065 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 46.8 mm -48.39 -43.19 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 CA-C-N 121.077 1.762 . . . . 0.70999999999999996 112.122 -179.253 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.89 -19.06 58.3 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.179 0.895 . . . . 0.66000000000000003 114.311 -179.981 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -76.78 -4.85 82.9 Favored Glycine 0 CA--C 1.534 1.241 0 O-C-N 120.776 -1.426 . . . . 0.93999999999999995 114.274 174.775 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -123.17 -45.28 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.851 1.66 . . . . 0.85999999999999999 110.188 170.686 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 92.6 m -74.64 71.91 1.93 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.983 1.713 . . . . 1.52 107.739 165.574 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -144.43 -78.35 0.04 OUTLIER Glycine 0 CA--C 1.529 0.926 0 C-N-CA 125.535 1.54 . . . . 0.87 111.14 178.668 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -63.77 -32.29 67.71 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.344 2.696 . . . . 1.02 113.684 -176.894 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.4 pt -78.38 -3.13 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 114.306 1.224 . . . . 1.1100000000000001 114.306 178.846 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -35.61 -64.83 0.27 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 127.704 2.402 . . . . 2.2200000000000002 115.516 -176.889 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -57.64 -33.41 68.25 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.616 -1.303 . . . . 4.8700000000000001 113.202 177.101 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 10.4 tt -70.15 -41.36 73.94 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 117.991 -1.004 . . . . 2.8300000000000001 110.468 177.487 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 83.9 mt -52.58 -50.27 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 119.15 0.887 . . . . 2.79 110.71 172.181 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -61.28 -47.1 87.55 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.964 0.906 . . . . 2.96 113.301 175.019 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -92.44 2.44 56.66 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 120.713 -1.242 . . . . 3.3599999999999999 113.257 -169.074 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -22.37 61.06 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.636 1.574 . . . . 5.1200000000000001 113.301 161.571 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -87.88 15.31 7.29 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 123.784 1.754 . . . . 3.2799999999999998 111.152 172.891 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -121.75 -67.99 0.93 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.04 1.336 . . . . 4.0499999999999998 109.062 168.118 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.18 0 C-N-CA 129.243 3.017 . . . . 8.0299999999999994 116.873 165.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 CA--C 1.502 -0.879 0 N-CA-C 108.776 -0.824 . . . . 10.720000000000001 108.776 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -132.37 -21.77 2.27 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.762 1.289 . . . . 7.5599999999999996 112.096 -133.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 67.7 m 69.05 -23.38 0.14 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 129.323 3.049 . . . . 3.96 115.464 170.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.496 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 0.2 OUTLIER 65.17 102.07 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 127.431 2.293 . . . . 2.2599999999999998 110.489 -167.681 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.17 150.27 4.66 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 118.914 0.779 . . . . 1.1000000000000001 111.165 -173.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -59.26 -48.59 81.06 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 118.914 0.779 . . . . 2.5800000000000001 110.301 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.67 -47.69 14.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.594 1.558 . . . . 1.04 110.941 172.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -74.26 -50.59 18.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 118.005 -0.997 . . . . 2.79 113.235 -173.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 mtmm -50.4 -37.89 39.96 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 120.931 1.696 . . . . 6.0199999999999996 113.48 164.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.866 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.39 -44.95 85.89 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.206 -1.378 . . . . 0.56000000000000005 111.928 175.284 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.483 ' O ' HG23 ' A' ' 16' ' ' VAL . 69.1 t -60.14 -36.14 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 CA-C-N 121.339 1.882 . . . . 0.63 110.59 172.115 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 52.6 mt -58.49 -51.99 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 O-C-N 121.179 -0.95 . . . . 0.82999999999999996 111.766 167.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.2 t -61.97 -39.58 84.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.486 1.515 . . . . 0.59999999999999998 112.019 -177.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.3 mp -63.59 -43.12 97.87 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.798 0.839 . . . . 1.01 111.187 172.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 12' ' ' VAL . 89.0 t -62.34 -41.94 93.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 118.126 -0.94 . . . . 0.68999999999999995 109.864 177.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -65.88 -41.68 91.28 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.111 1.323 . . . . 4.4900000000000002 114.111 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -16.52 20.28 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 120.336 -1.478 . . . . 3.5800000000000001 113.48 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -98.8 -61.59 1.35 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.767 1.627 . . . . 1.8999999999999999 113.189 166.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -60.46 -24.4 65.21 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.462 1.483 . . . . 1.8500000000000001 114.365 -171.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -46.32 -26.63 0.85 Allowed 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.094 1.316 . . . . 2.6600000000000001 113.815 167.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -91.18 7.12 42.24 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.808 2.043 . . . . 2.3700000000000001 115.99 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.1 m -136.09 164.33 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 119.711 1.141 . . . . 2.3700000000000001 109.587 170.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.9 m -93.52 70.82 4.28 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 120.945 -1.097 . . . . 3.9900000000000002 111.222 169.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp 71.91 -52.1 0.69 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.242 1.817 . . . . 6.5599999999999996 115.086 159.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -110.4 -13.58 14.26 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.763 1.625 . . . . 6.8200000000000003 112.929 174.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 99.9 p -84.12 18.17 2.21 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 117.419 2.377 . . . . 4.7000000000000002 117.419 -143.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 61.7 mt -39.65 -7.43 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 131.627 3.971 . . . . 7.3499999999999996 119.776 -170.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.3 p -130.37 -44.96 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.845 2.058 . . . . 4.1100000000000003 112.572 172.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.42 -22.86 43.7 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.311 1.597 . . . . 8.1600000000000001 115.311 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -147.47 119.23 8.06 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.435 1.094 . . . . 7.4699999999999998 108.688 167.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 10.0 pttm -160.65 160.77 32.01 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.569 1.548 . . . . 7.2400000000000002 111.741 -166.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 22.9 pt -83.7 172.66 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 121.812 0.815 . . . . 2.96 111.441 178.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.6 t -78.74 134.7 37.04 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.571 -0.9 . . . . 2.75 108.571 159.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -55.25 -25.11 31.45 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.154 -0.966 . . . . 2.3799999999999999 112.346 172.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.6 m -61.97 -12.98 21.17 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.013 1.486 . . . . 2.9199999999999999 115.013 169.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.6 m -82.96 -23.95 33.2 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.59 1.541 . . . . 1.6899999999999999 114.273 168.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -52.76 -53.96 40.63 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.298 1.863 . . . . 2.1299999999999999 111.9 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 27.0 ptt180 -61.66 -17.17 54.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.767 2.027 . . . . 2.6299999999999999 114.874 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -101.64 -52.42 3.22 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 126.969 2.108 . . . . 3.1800000000000002 109.179 -175.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 17.1 tmm? -53.75 -36.4 62.28 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.174 1.39 . . . . 1.8899999999999999 112.535 170.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 mt -54.12 -30.06 47.36 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.027 1.331 . . . . 1.02 113.983 169.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.79 -3.69 58.05 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.416 1.007 . . . . 3.0899999999999999 112.869 176.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -56.5 2.19 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.691 1.596 . . . . 1.6000000000000001 112.346 170.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -90.46 -14.8 32.08 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.215 1.191 . . . . 3.0899999999999999 114.215 -167.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 mt -123.22 45.27 2.46 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.008 2.123 . . . . 1.6100000000000001 109.852 174.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -78.8 -21.01 48.4 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 115.343 1.608 . . . . 1.4199999999999999 115.343 -170.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.506 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 59.9 m-70 -83.43 -22.54 32.63 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 121.211 1.823 . . . . 1.6599999999999999 114.364 -168.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 73.6 mtm -91.6 -12.92 32.93 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.88 1.672 . . . . 1.8999999999999999 113.028 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.2 tp -99.06 117.87 34.54 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.768 1.227 . . . . 3.2999999999999998 111.016 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.7 m -159.19 -47.21 0.06 Allowed 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.569 -1.332 . . . . 5.3700000000000001 110.337 171.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -37.72 -26.78 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.631 2.772 . . . . 5.9400000000000004 115.471 160.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.7 m 71.79 -25.01 0.18 Allowed 'General case' 0 C--N 1.342 0.257 0 C-N-CA 128.758 2.823 . . . . 2.6299999999999999 112.73 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.26 -44.16 75.24 Favored Glycine 0 N--CA 1.473 1.103 0 C-N-CA 127.043 2.259 . . . . 1.8899999999999999 113.604 172.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -55.03 -42.74 73.0 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.498 1.119 . . . . 3.4199999999999999 111.774 171.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.7 ttt-85 -68.29 -40.07 81.91 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.534 -1.354 . . . . 5.2199999999999998 113.249 170.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.1 mtmt -55.32 -29.94 59.26 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 122.16 2.255 . . . . 4.8099999999999996 112.58 173.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.42 -10.22 59.26 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.984 1.476 . . . . 1.3899999999999999 114.984 173.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -82.43 -52.89 6.45 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.796 1.238 . . . . 0.89000000000000001 111.233 162.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.89 -33.47 74.27 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.316 0.647 . . . . 2.2400000000000002 112.655 -173.271 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -54.66 -32.0 58.5 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.719 1.007 . . . . 3.0600000000000001 113.719 169.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.0 mt -81.16 -40.19 24.34 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.618 1.167 . . . . 1.0800000000000001 110.735 -177.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.1 mm -48.7 -55.42 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.644 1.177 . . . . 1.3600000000000001 110.66 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -66.01 -38.81 89.38 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.417 1.087 . . . . 1.8700000000000001 113.174 -177.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -32.82 70.61 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.873 1.269 . . . . 3.1899999999999999 112.699 170.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.77 -41.57 14.0 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.142 0.977 . . . . 2.5299999999999998 110.593 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -47.95 -48.4 32.14 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.263 1.425 . . . . 2.73 112.111 172.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -53.51 -22.19 7.69 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.873 1.434 . . . . 2.0600000000000001 114.873 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.1 m-80 -113.81 5.62 16.39 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.066 1.346 . . . . 2.6800000000000002 113.539 -175.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 38.2 t-80 -149.16 101.68 3.17 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 117.216 2.302 . . . . 3.6899999999999999 117.216 -153.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -20.75 3.24 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 128.239 2.616 . . . . 4.6200000000000001 115.341 170.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 95.87 22.9 19.39 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 118.84 -0.978 . . . . 2.8599999999999999 113.015 -166.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 58.9 mmt-85 -75.45 88.18 2.63 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.608 1.704 . . . . 4.4500000000000002 106.61 153.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.94 143.41 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 108.875 -0.787 . . . . 2.75 108.875 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.87 149.2 39.04 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.526 1.131 . . . . 1.8300000000000001 108.538 174.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.36 -38.18 88.56 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 120.1 1.318 . . . . 2.0 110.896 176.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.31 -22.83 63.64 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.924 2.09 . . . . 2.9399999999999999 113.905 175.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.96 -61.2 2.75 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.795 1.238 . . . . 3.6099999999999999 110.969 -178.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -56.0 -44.87 79.04 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.392 -0.818 . . . . 2.3799999999999999 112.789 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -61.72 -44.39 97.0 Favored 'General case' 0 C--O 1.239 0.552 0 O-C-N 121.844 -0.535 . . . . 0.59999999999999998 111.247 -178.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.59 -21.35 59.53 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 117.421 -1.276 . . . . 1.6100000000000001 112.804 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.8 mt -70.59 -44.22 67.78 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 120.176 1.353 . . . . 0.90000000000000002 112.662 165.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.8 mm -56.21 -37.3 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 CA-C-N 120.869 1.668 . . . . 0.69999999999999996 112.452 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.28 -14.33 63.93 Favored Glycine 0 CA--C 1.533 1.208 0 CA-C-O 118.935 -0.925 . . . . 0.83999999999999997 114.502 178.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.02 -19.7 58.83 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-N 119.085 1.442 . . . . 0.81000000000000005 113.901 175.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.4 mp -90.76 -44.97 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 118.524 1.162 . . . . 1.1100000000000001 109.509 167.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.2 m -76.4 85.78 3.15 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 107.595 -1.261 . . . . 1.25 107.595 -178.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -167.79 -75.82 0.04 OUTLIER Glycine 0 CA--C 1.532 1.098 0 CA-C-O 117.918 -1.49 . . . . 0.89000000000000001 113.993 -170.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -59.91 -44.48 30.05 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 123.134 2.556 . . . . 1.0 111.496 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.8 pt -76.27 -12.73 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 114.487 1.292 . . . . 1.51 114.487 169.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.84 -49.09 77.86 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.788 1.631 . . . . 1.1299999999999999 112.599 -175.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -50.49 68.95 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.078 0.854 . . . . 3.4100000000000001 112.051 170.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.9 tt -53.75 -39.05 65.02 Favored 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 125.273 1.429 . . . . 1.45 112.399 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 80.4 mt -55.82 -63.22 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 119.623 1.101 . . . . 1.03 111.068 171.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -53.49 -30.48 41.34 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 118.596 0.635 . . . . 1.8 112.63 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -83.8 -21.03 32.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.45 1.1 . . . . 3.2400000000000002 112.54 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 -73.03 -38.15 66.63 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 120.938 -1.101 . . . . 2.29 112.13 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -69.34 0.85 4.44 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.303 1.441 . . . . 2.4500000000000002 112.798 175.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -120.93 -60.84 1.62 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 126.229 1.811 . . . . 2.2599999999999998 111.32 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . 0.276 6.8 pt20 54.99 1.06 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 130.664 3.586 . . . . 5.4400000000000004 115.23 175.475 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.9 m -111.73 10.25 20.93 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.173 1.789 . . . . 7.0899999999999999 112.971 -168.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 58.3 m -158.8 38.4 0.22 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.99 1.716 . . . . 8.8200000000000003 110.578 -177.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 53.9 p . . . . . 0 C--O 1.25 1.11 0 C-N-CA 128.841 2.856 . . . . 10.369999999999999 113.976 -175.054 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 CA--C 1.502 -0.873 0 N-CA-C 108.875 -0.787 . . . . 10.75 108.875 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -132.26 -21.25 2.34 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.757 1.285 . . . . 7.3799999999999999 112.158 -134.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 67.6 m 69.91 -23.43 0.16 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 129.478 3.111 . . . . 3.7799999999999998 115.263 169.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.506 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 0.2 OUTLIER 65.35 102.03 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.292 2.237 . . . . 2.3599999999999999 110.522 -166.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.53 150.18 7.13 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-N 118.958 0.799 . . . . 1.0800000000000001 111.371 -173.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -58.56 -49.21 78.27 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.458 1.026 . . . . 2.7599999999999998 110.238 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.38 -47.23 13.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.383 1.473 . . . . 1.02 111.129 172.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -74.71 -50.83 16.07 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 117.928 -1.034 . . . . 2.7000000000000002 113.071 -172.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -50.11 -37.0 31.91 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 120.965 1.712 . . . . 5.54 113.245 164.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.866 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.91 -41.63 82.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 117.438 -1.268 . . . . 0.57999999999999996 112.777 176.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 115' ' ' VAL . . . . . 0.477 ' O ' HG23 ' B' ' 119' ' ' VAL . 75.2 t -62.36 -37.63 79.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-N 121.122 1.783 . . . . 0.64000000000000001 110.396 170.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 55.8 mt -56.29 -53.42 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 119.398 0.999 . . . . 0.79000000000000004 111.197 167.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 7.5 t -61.19 -39.66 83.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 125.206 1.402 . . . . 0.54000000000000004 112.1 -176.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.5 mp -63.32 -44.49 94.81 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.128 0.876 . . . . 0.98999999999999999 111.431 172.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 119' ' ' VAL . . . . . 0.477 HG23 ' O ' ' B' ' 115' ' ' VAL . 91.0 t -62.85 -40.54 89.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 118.056 -0.974 . . . . 0.67000000000000004 109.852 178.461 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -67.52 -42.95 81.93 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.676 1.125 . . . . 4.0999999999999996 113.286 172.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.61 -18.99 23.02 Favored 'General case' 0 CA--C 1.552 1.027 0 O-C-N 120.447 -1.408 . . . . 3.6099999999999999 113.561 176.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -95.17 -63.75 1.13 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.629 1.172 . . . . 2.0 113.083 166.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -59.06 -23.82 62.35 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.656 1.571 . . . . 1.8300000000000001 114.833 -170.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -46.89 -25.04 0.69 Allowed 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 120.259 1.391 . . . . 2.46 113.884 167.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -93.23 8.78 38.85 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.298 2.239 . . . . 2.29 116.153 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.1 m -137.02 154.19 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 120.141 1.337 . . . . 2.4300000000000002 110.146 168.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 10.5 m -79.7 60.13 3.27 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.307 -0.87 . . . . 3.9700000000000002 111.998 169.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp 77.19 -52.6 0.55 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.332 1.453 . . . . 6.1900000000000004 114.132 156.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -107.58 -11.82 15.39 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.029 1.732 . . . . 6.71 113.211 172.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 85.6 p -87.92 7.66 29.9 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 117.928 2.566 . . . . 4.7599999999999998 117.928 -142.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 68.1 mt -20.99 -13.39 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 1 C-N-CA 134.356 5.062 . . . . 7.3600000000000003 121.667 -175.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 4.3 p -132.59 -47.32 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 127.25 2.22 . . . . 4.0599999999999996 112.437 176.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -21.25 46.48 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 114.532 1.308 . . . . 8.0700000000000003 114.532 -177.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -146.54 120.64 9.45 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.176 0.991 . . . . 7.5099999999999998 108.776 161.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 11.0 pttm -159.86 162.34 34.61 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.549 1.54 . . . . 7.1799999999999997 111.829 -167.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 9.0 pt -80.95 175.68 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-O 121.816 0.817 . . . . 2.98 111.475 175.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 32.5 t -84.99 138.35 32.52 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.7 -0.852 . . . . 2.54 108.7 163.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -58.78 -20.01 45.88 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 120.56 -1.337 . . . . 2.21 112.522 172.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 50.8 m -66.01 -16.76 64.18 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.237 1.415 . . . . 2.5800000000000001 114.586 167.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 61.6 m -80.41 -29.97 37.7 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.887 1.221 . . . . 1.2 113.098 176.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.411 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 70.1 t80 -50.91 -57.37 8.68 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.651 1.114 . . . . 1.8999999999999999 112.146 176.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -61.86 -17.79 57.74 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.57 1.948 . . . . 2.8599999999999999 114.606 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -97.52 -54.76 3.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.962 2.105 . . . . 3.3300000000000001 109.07 -177.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -53.31 -35.67 60.4 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.803 1.641 . . . . 1.8100000000000001 112.701 172.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.0 mt -54.31 -30.0 49.56 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.004 1.322 . . . . 1.0600000000000001 113.898 169.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.84 -3.43 56.78 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.611 1.096 . . . . 3.29 112.891 176.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.64 -57.27 2.05 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.874 1.67 . . . . 1.47 112.341 171.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -89.67 -15.78 31.89 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.682 0.993 . . . . 3.0600000000000001 113.682 -167.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.3 mt -121.97 44.98 2.44 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.334 1.854 . . . . 1.6200000000000001 110.088 174.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -79.04 -23.67 44.13 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.344 1.609 . . . . 1.3799999999999999 115.344 -169.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 151' ' ' HIS . . . . . 0.496 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 64.6 m-70 -81.3 -22.36 38.63 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 121.115 1.78 . . . . 1.6299999999999999 114.343 -167.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 73.2 mtm -91.19 -11.44 38.32 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.677 1.591 . . . . 1.97 113.102 171.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 40.0 tp -100.74 120.15 39.66 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.15 1.38 . . . . 3.2400000000000002 111.091 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 23.0 m -160.94 -47.29 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 O-C-N 120.524 -1.36 . . . . 5.1399999999999997 110.019 170.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -37.72 -27.69 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 128.995 2.918 . . . . 5.9100000000000001 115.527 161.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 100.0 m 71.71 -22.17 0.2 Allowed 'General case' 0 C--N 1.342 0.245 0 C-N-CA 128.471 2.708 . . . . 2.7999999999999998 112.969 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.84 -44.89 92.01 Favored Glycine 0 N--CA 1.471 1.008 0 C-N-CA 126.181 1.848 . . . . 1.9299999999999999 113.038 171.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -54.97 -41.34 71.05 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.823 1.249 . . . . 3.4300000000000002 111.731 172.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.6 ttt-85 -68.9 -41.36 78.36 Favored 'General case' 0 C--N 1.345 0.374 0 O-C-N 120.482 -1.387 . . . . 4.8700000000000001 113.121 170.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 19.5 mtmt -57.37 -26.49 61.1 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 121.65 2.023 . . . . 3.9900000000000002 112.885 173.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -74.54 -11.0 60.09 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.853 1.427 . . . . 1.4099999999999999 114.853 172.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.13 -56.89 3.52 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.307 1.443 . . . . 0.89000000000000001 111.145 163.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -34.18 69.0 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 113.255 0.835 . . . . 2.23 113.255 -176.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -55.14 -32.2 61.91 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 121.047 -1.033 . . . . 3.1200000000000001 113.765 170.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 165' ' ' LEU . . . . . 0.45 HD11 ' HA3' ' B' ' 188' ' ' GLY . 17.3 mt -79.97 -40.09 28.73 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.254 1.022 . . . . 1.0700000000000001 110.416 -176.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 39.6 mm -49.74 -54.42 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.101 1.36 . . . . 1.3100000000000001 110.733 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -65.4 -37.85 88.2 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.517 1.127 . . . . 1.8899999999999999 113.369 -178.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -34.18 74.36 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.1 1.36 . . . . 3.1400000000000001 112.988 170.101 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.81 -41.0 18.01 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.738 1.215 . . . . 2.6499999999999999 110.282 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -51.39 -46.61 62.88 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.676 1.59 . . . . 2.6499999999999999 112.817 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -55.22 -20.71 11.53 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.72 1.378 . . . . 2.1400000000000001 114.72 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -112.64 4.57 17.29 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.021 1.328 . . . . 2.71 113.459 -176.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -151.51 100.71 2.74 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 117.52 2.415 . . . . 3.48 117.52 -153.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -19.08 4.1 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.49 2.716 . . . . 4.6399999999999997 115.793 171.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 96.15 26.46 11.25 Favored Glycine 0 CA--C 1.53 0.987 0 CA-C-O 118.915 -0.936 . . . . 2.9500000000000002 113.087 -167.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 54.3 mmt-85 -78.63 84.16 4.76 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.35 1.575 . . . . 4.5 107.154 154.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 11.3 mt -62.05 132.59 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 CA-C-N 118.795 0.725 . . . . 2.8599999999999999 109.324 -173.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 21.2 m -94.39 158.45 15.56 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 122.012 -0.43 . . . . 1.5600000000000001 110.33 166.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -63.63 -37.86 88.95 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 119.521 -0.872 . . . . 2.0 111.474 166.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -21.63 65.53 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.652 1.581 . . . . 2.9399999999999999 114.266 177.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -62.43 -59.21 5.3 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.94 0.896 . . . . 3.4900000000000002 110.933 -177.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -54.51 -46.81 73.57 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.437 -0.789 . . . . 2.5 112.856 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 40.7 t-105 -61.96 -45.72 92.43 Favored 'General case' 0 C--O 1.239 0.542 0 O-C-N 121.998 -0.439 . . . . 0.62 111.078 -176.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -72.27 -23.19 61.16 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-O 117.317 -1.325 . . . . 1.6100000000000001 112.436 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.411 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 30.9 mt -69.91 -42.61 73.14 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 120.081 1.31 . . . . 0.84999999999999998 112.844 167.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 32.2 mm -56.81 -36.08 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 CA-C-N 120.928 1.694 . . . . 0.66000000000000003 112.497 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.21 -19.16 67.99 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.043 -0.865 . . . . 0.69999999999999996 114.077 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 188' ' ' GLY . . . . . 0.45 ' HA3' HD11 ' B' ' 165' ' ' LEU . . . -80.84 -20.55 65.35 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-N 119.356 1.578 . . . . 0.84999999999999998 113.751 176.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.2 mp -90.86 -43.21 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 CA-C-N 118.497 1.149 . . . . 1.1100000000000001 110.25 168.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 4.1 m -78.13 83.89 4.38 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 107.86 -1.163 . . . . 1.3100000000000001 107.86 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -165.31 -74.55 0.03 OUTLIER Glycine 0 CA--C 1.533 1.16 0 CA-C-O 118.128 -1.373 . . . . 0.88 114.109 -172.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.68 -42.55 38.34 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.158 2.572 . . . . 1.02 111.617 176.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.9 pt -77.11 -12.4 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 114.93 1.456 . . . . 1.5700000000000001 114.93 169.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.45 -52.17 66.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.75 1.614 . . . . 1.0900000000000001 112.605 -175.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.66 -48.8 69.09 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.523 -0.736 . . . . 3.5099999999999998 112.284 170.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 10.2 tt -56.52 -37.64 70.73 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 125.318 1.447 . . . . 1.7 111.979 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 75.4 mt -56.56 -61.94 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 119.648 1.113 . . . . 1.0 111.069 169.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -55.71 -28.42 55.6 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.726 -0.609 . . . . 1.8799999999999999 112.585 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -83.66 -23.76 31.63 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.33 1.052 . . . . 3.1200000000000001 112.35 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -76.55 -42.31 43.45 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.961 1.305 . . . . 2.25 112.838 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.58 3.01 6.79 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 122.659 1.219 . . . . 2.5699999999999998 112.548 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -120.23 -57.8 1.91 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 126.959 2.103 . . . . 2.6800000000000002 110.572 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.28 6.5 pt20 56.11 1.18 0.06 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 130.678 3.591 . . . . 5.1900000000000004 115.506 171.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 39.6 m -103.12 9.14 38.53 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.458 1.503 . . . . 7.1699999999999999 113.122 -168.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 46.9 m -159.68 43.71 0.22 Allowed 'General case' 0 N--CA 1.481 1.093 0 O-C-N 120.268 -1.52 . . . . 8.9299999999999997 111.556 -178.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 39.1 p . . . . . 0 C--O 1.25 1.08 0 C-N-CA 128.916 2.887 . . . . 10.4 115.072 -179.122 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.3 m . . . . . 0 N--CA 1.47 0.547 0 N-CA-C 107.0 -1.482 . . . . 8.5199999999999996 107.0 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -55.39 -117.53 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 120.129 -0.628 . . . . 6.2199999999999998 109.434 112.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 50.6 t -96.77 -95.7 0.2 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.557 2.343 . . . . 4.3799999999999999 108.237 171.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.1 m-30 140.95 153.42 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.079 1 C-N-CA 132.65 4.38 . . . . 2.2999999999999998 111.809 176.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.2 t -76.26 134.83 39.69 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 108.184 -1.043 . . . . 2.0800000000000001 108.184 153.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -61.7 -28.66 69.57 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 122.683 0.393 . . . . 2.9300000000000002 110.638 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.03 -40.82 67.41 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.541 -0.725 . . . . 1.01 110.991 175.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -67.16 -61.3 1.99 Allowed 'General case' 0 C--N 1.337 0.058 0 O-C-N 121.909 -0.494 . . . . 2.5299999999999998 109.971 176.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.4 tptt -54.56 -26.94 35.33 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.416 1.265 . . . . 5.71 114.416 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.794 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -73.7 -44.5 56.36 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.258 1.423 . . . . 0.71999999999999997 112.254 170.372 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 77.6 t -59.46 -39.53 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 120.547 1.521 . . . . 0.84999999999999998 110.025 168.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.5 mt -55.57 -50.42 66.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-O 117.689 -1.148 . . . . 0.80000000000000004 110.516 170.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.7 t -58.43 -40.68 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-N 120.42 1.464 . . . . 0.55000000000000004 111.685 178.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.23 -51.53 65.86 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.071 0.85 . . . . 0.93999999999999995 111.914 173.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.1 t -60.63 -46.8 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.5 1.52 . . . . 0.82999999999999996 112.883 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -66.6 -44.34 82.41 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 3.3300000000000001 110.111 -176.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.5 t30 -65.59 -34.66 78.76 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.085 0.772 . . . . 3.0 113.085 177.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -63.63 -50.65 68.51 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 120.556 -1.34 . . . . 2.2599999999999998 112.459 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -63.34 -42.91 98.98 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 117.491 -1.242 . . . . 2.4399999999999999 113.037 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.8 ptmt -63.0 -29.58 70.94 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.251 1.841 . . . . 4.7000000000000002 112.932 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -74.5 -49.23 22.96 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.043 -1.036 . . . . 2.6299999999999999 112.719 172.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.4 t -66.54 -50.85 63.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 CA-C-N 119.371 0.987 . . . . 3.6600000000000001 112.903 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.405 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 39.3 p -175.1 -81.44 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.343 1.857 . . . . 4.4500000000000002 109.392 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.413 ' HG3' ' HE2' ' B' ' 198' ' ' HIS . 42.6 tttp 179.85 -60.43 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 129.179 2.992 . . . . 5.7400000000000002 108.934 -177.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -131.22 3.06 4.29 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.545 1.138 . . . . 7.0300000000000002 113.993 -175.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.6 p -142.06 96.92 3.04 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.421 -1.424 . . . . 4.2699999999999996 112.886 -164.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 mp -87.26 -28.26 22.43 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.378 1.251 . . . . 8.8100000000000005 114.378 -173.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.1 m -65.11 -20.14 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 125.628 1.571 . . . . 5.0800000000000001 112.741 -175.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.55 111.94 23.88 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.17 1.388 . . . . 7.96 112.525 179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -42.33 131.56 3.63 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 125.672 1.589 . . . . 8.3900000000000006 112.527 170.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.405 ' HE3' ' HA ' ' A' ' 24' ' ' SER . 3.1 tmtt? -173.23 -52.91 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 126.883 2.073 . . . . 10.25 109.718 -170.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.4 tt -77.38 164.78 3.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 N-CA-C 108.236 -1.024 . . . . 2.52 108.236 157.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.4 m -118.05 156.3 28.84 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.402 -0.811 . . . . 2.5499999999999998 110.825 164.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -64.96 -19.27 65.88 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.237 -1.539 . . . . 2.0099999999999998 113.145 -177.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.1 p -65.34 -28.96 69.66 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.112 1.365 . . . . 1.8899999999999999 114.079 164.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.9 m -68.3 -30.78 69.86 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.383 -1.448 . . . . 1.1599999999999999 112.815 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.443 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 14.4 t80 -59.24 -57.86 11.16 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 120.579 1.536 . . . . 2.1600000000000001 111.819 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -55.27 -25.06 31.51 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.589 1.155 . . . . 2.2999999999999998 112.152 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.405 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 26.2 mt-10 -90.34 -50.13 6.14 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 125.774 1.629 . . . . 3.79 112.662 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 59.7 ttp -45.37 -45.57 12.64 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 124.12 0.968 . . . . 2.4100000000000001 110.243 162.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.1 mt -58.16 -50.49 73.33 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 125.264 1.426 . . . . 1.21 112.732 171.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -20.86 59.78 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 120.427 1.467 . . . . 3.0 113.972 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 1.4 mppt? -87.41 -48.55 7.87 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.778 1.231 . . . . 2.8500000000000001 110.237 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -74.64 -74.35 0.2 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.267 1.027 . . . . 3.8199999999999998 111.615 171.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.0 mt -74.77 32.68 0.09 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.69 1.596 . . . . 2.48 113.422 -173.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -59.25 -22.79 61.66 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.675 1.59 . . . . 1.6299999999999999 113.47 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -77.5 -62.55 1.62 Allowed 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.181 0.901 . . . . 1.6699999999999999 110.279 -178.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 6.8 ptp -62.23 -29.87 70.7 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.583 1.083 . . . . 3.2000000000000002 113.362 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.83 -61.62 1.79 Allowed 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.88 -0.785 . . . . 3.2200000000000002 108.88 170.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.9 m 54.86 -82.52 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.09 1.756 . . . . 4.7400000000000002 111.45 -169.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.2 161.12 24.13 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.7 2.0 . . . . 3.7999999999999998 113.97 -174.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.5 m -69.61 -23.81 63.57 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.864 1.666 . . . . 2.6099999999999999 112.377 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.86 -52.17 54.56 Favored Glycine 0 N--CA 1.471 1.018 0 C-N-CA 126.188 1.851 . . . . 1.53 112.784 173.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -61.5 -27.0 68.28 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.052 0.541 . . . . 3.48 112.15 172.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 94.0 mtm-85 -80.74 -17.06 52.23 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 114.055 1.132 . . . . 6.1200000000000001 114.055 170.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt -66.45 -36.05 81.82 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 119.055 -2.278 . . . . 3.6800000000000002 110.918 169.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.8 -18.74 34.84 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 114.859 1.429 . . . . 1.03 114.859 163.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -80.72 -53.26 6.67 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 119.913 1.233 . . . . 0.85999999999999999 110.896 166.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -57.44 -40.55 78.69 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.889 1.275 . . . . 2.7999999999999998 113.873 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.0 ptmt -53.3 -30.96 41.62 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.905 0.882 . . . . 3.1600000000000001 112.542 178.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 30.1 mt -80.21 -44.69 19.31 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 118.503 -0.761 . . . . 0.73999999999999999 111.067 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 6.2 mm -54.47 -48.14 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-O 118.624 -0.703 . . . . 0.79000000000000004 109.783 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -67.36 -28.76 68.22 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 114.162 1.171 . . . . 1.76 114.162 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -73.89 -35.52 64.7 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.307 0.643 . . . . 3.6299999999999999 112.244 171.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -72.43 -29.08 63.38 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.607 1.163 . . . . 2.3599999999999999 111.515 172.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -62.52 -21.6 65.66 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.83 1.652 . . . . 3.4199999999999999 113.355 175.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.15 -10.91 59.78 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.748 1.388 . . . . 1.9299999999999999 114.748 169.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -135.99 -34.28 0.81 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 116.206 1.928 . . . . 2.3500000000000001 116.206 -166.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.6 m170 -115.64 115.89 27.16 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.421 -1.425 . . . . 4.0199999999999996 112.105 -170.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -140.95 152.88 45.33 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.187 1.395 . . . . 5.8200000000000003 110.342 162.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.32 -41.6 0.78 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 127.309 2.385 . . . . 2.9100000000000001 114.353 -177.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.3 mmt85 -98.41 139.92 33.44 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 127.949 2.5 . . . . 5.3799999999999999 111.414 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 45.3 mm -101.41 145.67 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 N-CA-C 107.803 -1.184 . . . . 2.1000000000000001 107.803 148.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 t -101.62 152.93 20.22 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.518 -0.739 . . . . 1.5 111.759 169.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -58.23 -51.66 68.84 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.021 0.828 . . . . 2.4300000000000002 110.96 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -61.06 -15.14 29.16 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.119 1.368 . . . . 3.21 112.565 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -64.51 -57.85 8.03 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.468 1.107 . . . . 3.0499999999999998 111.963 -174.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.56 -42.32 78.39 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.012 -1.68 . . . . 2.02 111.768 176.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 30.0 t-105 -63.96 -48.54 76.06 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 119.247 -0.406 . . . . 0.68999999999999995 111.907 -177.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 36.5 p -62.59 -44.71 95.62 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.777 1.231 . . . . 2.7200000000000002 111.064 175.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.443 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 93.3 mt -62.28 -38.69 90.31 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 118.389 -0.815 . . . . 0.80000000000000004 112.852 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 23.3 mm -55.22 -46.67 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 CA-C-N 120.397 1.453 . . . . 0.93000000000000005 111.585 175.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.55 -29.23 72.93 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 119.458 -0.634 . . . . 0.82999999999999996 113.186 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.42 -22.82 77.79 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-O 118.676 -1.069 . . . . 0.58999999999999997 114.163 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.7 mp -88.24 -47.62 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 118.959 1.38 . . . . 0.90000000000000002 110.323 162.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.6 m -75.97 31.89 0.12 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 127.017 2.127 . . . . 1.77 112.355 -169.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.61 -85.39 1.16 Allowed Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.3 0.952 . . . . 0.98999999999999999 111.095 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -64.23 -36.16 47.93 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.743 2.295 . . . . 1.51 111.974 -176.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.62 -17.63 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 113.579 0.955 . . . . 1.1799999999999999 113.579 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.54 -44.31 94.55 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 120.037 1.289 . . . . 1.0700000000000001 112.846 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.25 -36.83 84.96 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 120.753 -1.217 . . . . 3.3199999999999998 110.643 176.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.32 -46.87 88.38 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.579 1.152 . . . . 1.1299999999999999 111.355 173.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 83.4 mt -50.69 -58.87 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.732 0.813 . . . . 1.1499999999999999 110.636 172.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -63.92 -37.13 86.29 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.859 -0.526 . . . . 1.9099999999999999 112.251 -176.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.291 3.9 pt-20 -76.83 -13.99 59.95 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.041 -1.037 . . . . 3.0499999999999998 112.239 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.61 -29.18 30.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.44 1.896 . . . . 2.46 114.643 167.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -76.23 3.94 9.74 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 123.104 1.43 . . . . 2.4399999999999999 111.995 173.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -132.41 -61.2 0.87 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 126.119 1.768 . . . . 2.6000000000000001 111.06 -175.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.32 14.12 2.02 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 129.113 2.965 . . . . 4.5199999999999996 115.879 164.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.6 t -158.89 32.7 0.22 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.298 1.439 . . . . 6.71 110.968 -174.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 49.2 m -78.37 -13.42 59.85 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.472 -1.393 . . . . 8.7699999999999996 114.332 176.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.255 1.365 0 C-N-CA 130.905 3.682 . . . . 10.82 109.032 -172.351 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 107.005 -1.479 . . . . 8.3300000000000001 107.005 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -50.5 -117.88 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.441 0 CA-C-N 118.387 0.54 . . . . 6.1200000000000001 110.389 109.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 50.2 t -98.6 -96.68 0.22 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.202 2.201 . . . . 3.9199999999999999 108.746 172.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 135.44 150.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.199 1 C-N-CA 132.793 4.437 . . . . 2.27 111.783 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 7.2 t -75.4 137.64 41.17 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.093 -1.077 . . . . 2.0600000000000001 108.093 153.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -60.77 -28.67 68.9 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 122.568 0.347 . . . . 2.8599999999999999 110.573 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -39.25 69.42 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.131 -0.981 . . . . 1.1399999999999999 111.006 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -68.43 -60.67 2.27 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-O 119.319 -0.372 . . . . 2.5499999999999998 110.359 176.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -55.87 -27.24 50.83 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.341 1.237 . . . . 6.5099999999999998 114.341 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.794 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -72.14 -45.61 59.84 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.193 1.397 . . . . 0.81000000000000005 111.821 169.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 63.2 t -59.63 -39.62 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-N 120.892 1.678 . . . . 0.85999999999999999 110.442 170.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 10.6 mt -53.9 -50.21 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-O 117.605 -1.188 . . . . 0.79000000000000004 110.962 169.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 3.7 t -59.07 -43.23 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.072 1.306 . . . . 0.55000000000000004 111.671 178.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.3 mp -61.25 -45.76 93.2 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.06 0.845 . . . . 1.03 111.615 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 38.6 t -66.89 -44.38 88.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.262 1.425 . . . . 0.71999999999999997 113.141 178.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -66.43 -42.17 88.12 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.346 1.058 . . . . 3.1299999999999999 110.359 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -62.76 -31.02 71.89 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.625 0.972 . . . . 2.6299999999999999 113.625 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -71.32 -55.32 8.26 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.478 -1.389 . . . . 2.3599999999999999 111.949 176.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -61.13 -39.6 90.63 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.86 -1.15 . . . . 2.4100000000000001 113.191 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.65 -32.43 72.59 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.179 1.354 . . . . 4.5899999999999999 112.798 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -76.32 -43.62 40.41 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.76 -1.213 . . . . 2.52 112.128 172.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 54.0 t -64.67 -51.03 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.462 1.105 . . . . 3.5800000000000001 113.173 -177.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 36.3 p 176.83 -80.47 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 127.624 2.37 . . . . 4.2999999999999998 108.379 -174.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 37.6 tttp 178.25 -60.24 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 129.97 3.308 . . . . 5.7400000000000002 108.72 -177.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -131.27 4.35 4.36 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 114.257 1.206 . . . . 7.0199999999999996 114.257 -173.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 5.6 p -141.77 106.53 4.89 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.371 -1.455 . . . . 4.25 113.503 -170.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 1.1 mt -85.84 -37.98 18.61 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.535 1.134 . . . . 8.9399999999999995 113.285 -176.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 6.4 m -62.08 -28.57 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.404 1.082 . . . . 5.0599999999999996 112.035 -176.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.12 93.06 5.74 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.342 1.057 . . . . 7.8200000000000003 111.587 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 64.1 t-20 -39.58 126.6 1.88 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 125.89 1.676 . . . . 8.5500000000000007 112.72 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -171.27 -55.87 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 126.23 1.812 . . . . 10.06 110.705 -164.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.5 tt -71.52 176.65 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 107.476 -1.305 . . . . 2.5899999999999999 107.476 156.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 66.8 m -142.96 161.36 38.32 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 119.769 -1.832 . . . . 2.5899999999999999 110.198 173.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -68.4 -20.7 64.69 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 120.907 -1.12 . . . . 2.0800000000000001 112.806 -175.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 7.8 p -66.77 -31.25 71.77 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.262 1.425 . . . . 1.95 113.371 164.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 6.1 m -67.51 -35.56 79.34 Favored 'General case' 0 C--O 1.225 -0.229 0 O-C-N 120.574 -1.329 . . . . 1.29 112.344 -177.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.455 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 12.9 t80 -57.72 -58.8 6.74 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 119.606 1.094 . . . . 1.95 111.434 -177.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -54.81 -26.07 32.44 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.618 1.167 . . . . 2.1600000000000001 112.373 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 143' ' ' GLU . . . . . 0.405 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 24.6 mt-10 -90.38 -50.88 5.71 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 125.739 1.616 . . . . 3.54 112.703 -174.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 63.5 ttp -45.53 -45.14 13.19 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 124.247 1.019 . . . . 2.6200000000000001 110.176 162.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 5.3 mt -57.85 -50.48 73.16 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 125.281 1.432 . . . . 1.27 112.759 170.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -75.12 -21.96 58.51 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.411 1.46 . . . . 3.1299999999999999 114.139 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 147' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 1.5 mppt? -85.02 -49.43 8.3 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.895 1.278 . . . . 2.6000000000000001 110.068 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -74.27 -74.23 0.2 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.092 0.957 . . . . 3.8500000000000001 111.442 172.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 10.7 mt -75.11 33.61 0.1 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.946 1.699 . . . . 2.5600000000000001 113.214 -173.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -59.01 -23.03 61.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.641 1.576 . . . . 1.51 113.286 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -79.34 -61.42 2.01 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.226 0.921 . . . . 1.6299999999999999 110.687 -177.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 ptp -63.14 -26.73 68.95 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.564 1.075 . . . . 3.2200000000000002 113.848 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.08 -62.25 1.46 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.433 0.561 . . . . 3.2400000000000002 109.696 167.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 32.3 m 56.75 -82.13 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.894 1.678 . . . . 4.6399999999999997 111.995 -169.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -85.22 161.65 19.5 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.368 1.867 . . . . 3.8999999999999999 113.779 -170.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 44.0 m -70.8 -25.58 62.93 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 125.684 1.594 . . . . 2.9199999999999999 112.164 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -59.01 -52.62 52.31 Favored Glycine 0 N--CA 1.469 0.889 0 C-N-CA 126.204 1.859 . . . . 1.71 112.345 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -60.34 -30.75 69.73 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.208 -0.584 . . . . 3.6299999999999999 112.101 172.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -77.61 -15.85 58.96 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 120.915 -1.116 . . . . 6.1399999999999997 113.878 171.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -65.54 -35.55 81.19 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 119.165 -2.209 . . . . 3.8999999999999999 111.192 169.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.61 -19.23 36.87 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 114.901 1.445 . . . . 1.01 114.901 164.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.69 -54.0 6.28 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.632 1.106 . . . . 0.90000000000000002 111.151 166.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -57.57 -40.41 78.91 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.487 1.115 . . . . 2.71 113.468 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -52.9 -32.71 46.68 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.897 0.879 . . . . 3.2200000000000002 112.456 178.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 39.7 mt -77.98 -45.14 24.65 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 118.708 -0.663 . . . . 0.73999999999999999 110.543 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.81 -47.83 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.36 -0.829 . . . . 0.80000000000000004 109.575 -177.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -66.84 -32.38 73.62 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.961 1.097 . . . . 1.76 113.961 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -69.22 -35.71 76.47 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.555 -0.716 . . . . 3.75 112.003 171.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -74.28 -28.54 61.24 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.829 1.252 . . . . 2.6499999999999999 111.943 173.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -63.73 -21.48 66.42 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.095 1.758 . . . . 3.48 113.266 175.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.57 -9.42 59.78 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.701 1.371 . . . . 1.95 114.701 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -136.34 -35.02 0.76 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.104 1.89 . . . . 2.3700000000000001 116.104 -166.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -109.54 108.1 18.44 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.47 -1.394 . . . . 3.9100000000000001 111.469 -174.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -121.04 156.32 32.45 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.32 1.448 . . . . 5.1399999999999997 110.309 161.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 64.91 -5.13 1.33 Allowed Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.647 1.594 . . . . 3.1600000000000001 116.615 169.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 21.8 mmt85 -144.88 152.73 40.69 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 126.902 2.081 . . . . 5.1100000000000003 111.214 -165.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 32.7 mm -122.01 150.18 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.528 1.531 . . . . 2.3199999999999998 107.44 156.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.3 t -108.03 157.97 17.79 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.632 0.773 . . . . 1.5800000000000001 112.226 169.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -60.01 -50.86 72.06 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 121.109 -0.995 . . . . 2.3100000000000001 111.353 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -61.7 -16.24 47.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.796 1.238 . . . . 3.3900000000000001 112.637 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -64.2 -55.25 22.98 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.115 0.966 . . . . 2.9700000000000002 112.188 -175.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -57.22 -44.17 83.48 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.185 -1.572 . . . . 2.0600000000000001 111.848 175.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -64.01 -48.04 77.92 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 119.258 -0.401 . . . . 0.69999999999999996 112.031 -177.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 40.3 p -62.42 -44.52 96.22 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.659 1.184 . . . . 2.6800000000000002 111.286 175.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.455 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 93.8 mt -62.91 -38.8 92.42 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 118.164 -0.922 . . . . 0.69999999999999996 112.599 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 23.2 mm -54.36 -46.18 69.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 CA-C-N 120.514 1.506 . . . . 0.89000000000000001 111.389 174.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.46 -29.1 72.4 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 118.569 0.622 . . . . 0.77000000000000002 113.035 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.69 -22.49 78.68 Favored Glycine 0 CA--C 1.535 1.304 0 CA-C-O 118.651 -1.083 . . . . 0.59999999999999998 114.264 178.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.6 mp -87.29 -48.67 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 CA-C-N 119.132 1.466 . . . . 0.93999999999999995 109.879 162.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 2.6 m -75.38 33.62 0.11 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 127.209 2.204 . . . . 1.6799999999999999 111.913 -169.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -88.95 -87.17 1.24 Allowed Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.54 1.067 . . . . 0.97999999999999998 110.758 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.78 -34.29 62.08 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.799 2.333 . . . . 1.45 111.954 -175.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.29 -20.98 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 118.703 -0.665 . . . . 1.1699999999999999 112.764 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.01 87.71 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 120.159 1.345 . . . . 1.0 112.911 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.37 -36.83 83.5 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 120.825 -1.172 . . . . 3.3199999999999998 110.231 177.118 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -46.68 88.54 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.751 1.221 . . . . 1.49 111.886 173.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 77.8 mt -50.61 -59.35 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.9 0.88 . . . . 1.1799999999999999 110.515 171.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 198' ' ' HIS . . . . . 0.413 ' HE2' ' HG3' ' A' ' 25' ' ' LYS . 81.2 t60 -65.02 -35.95 82.83 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.935 -0.478 . . . . 1.8500000000000001 112.269 -175.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.264 4.3 pt-20 -77.08 -15.89 59.41 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 117.951 -1.024 . . . . 3.2799999999999998 112.139 177.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -81.12 -32.04 33.98 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.944 1.697 . . . . 2.3999999999999999 114.392 168.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -73.47 5.04 4.07 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 123.212 1.482 . . . . 2.3100000000000001 112.177 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -134.29 -61.46 0.78 Allowed 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 126.644 1.977 . . . . 2.6000000000000001 111.24 -174.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.68 16.5 1.98 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 129.202 3.001 . . . . 4.3200000000000003 115.729 163.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 47.6 t -159.41 32.12 0.2 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.619 1.568 . . . . 6.8600000000000003 110.915 -175.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 46.4 m -78.38 -13.03 60.02 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 120.596 -1.315 . . . . 8.9600000000000009 114.467 176.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.257 1.468 0 C-N-CA 131.653 3.981 . . . . 10.949999999999999 107.723 -172.152 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 m . . . . . 0 N--CA 1.473 0.705 0 CA-C-O 118.871 -0.585 . . . . 10.289999999999999 110.645 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -71.54 -116.5 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 107.376 -1.342 . . . . 7.1399999999999997 107.376 140.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 53.2 t -79.06 -74.19 0.3 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.627 1.171 . . . . 4.3099999999999996 109.345 154.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 86.11 146.22 0.06 Allowed 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 129.58 3.152 . . . . 2.5699999999999998 112.029 -176.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 47.3 p -81.23 155.41 26.13 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 121.323 -0.861 . . . . 1.3 109.792 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -61.21 -35.44 77.2 Favored 'General case' 0 C--O 1.223 -0.307 0 O-C-N 120.556 -1.34 . . . . 2.1299999999999999 111.641 -177.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -49.56 76.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.507 1.523 . . . . 0.91000000000000003 110.9 174.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -69.0 -53.06 22.55 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.217 1.807 . . . . 2.7400000000000002 111.27 -177.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.07 -34.82 45.42 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.256 1.022 . . . . 5.4800000000000004 110.356 169.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.832 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -77.04 -39.28 50.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 117.343 -1.313 . . . . 0.46000000000000002 112.992 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.7 t -52.72 -45.28 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 121.111 1.778 . . . . 0.60999999999999999 110.719 164.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.06 -50.55 77.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.124 0.874 . . . . 0.79000000000000004 111.148 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.9 t -60.07 -34.95 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.63 1.172 . . . . 0.53000000000000003 112.702 176.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 mp -72.09 -43.03 65.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.8 1.182 . . . . 0.93999999999999995 110.967 174.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.3 t -58.6 -45.7 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 125.456 1.503 . . . . 0.56999999999999995 110.99 173.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.3 tm-20 -67.01 -45.76 76.57 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.867 1.267 . . . . 2.8999999999999999 111.12 174.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.429 ' HA ' ' HD2' ' A' ' 21' ' ' LYS 0.285 1.5 t30 -71.1 -7.32 45.69 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 115.143 1.534 . . . . 2.8300000000000001 115.143 179.244 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -82.82 -66.79 0.85 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.547 0.739 . . . . 2.2400000000000002 111.892 153.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -59.73 -32.8 70.88 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.266 1.21 . . . . 2.1099999999999999 114.266 -167.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.429 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 10.0 ptmt -54.76 -25.88 30.68 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 119.723 -1.861 . . . . 2.5 113.756 175.379 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -82.66 -1.36 50.88 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.719 1.377 . . . . 2.79 114.719 178.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.1 m -69.91 156.16 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.84 1.2 . . . . 3.8500000000000001 109.808 170.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.6 t -69.25 -13.3 62.33 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 115.777 1.769 . . . . 7.2400000000000002 115.777 -166.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -179.68 -51.26 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.025 2.13 . . . . 11.720000000000001 111.952 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -164.13 155.74 16.28 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 129.305 3.042 . . . . 9.2100000000000009 109.426 175.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.2 p -179.25 114.57 0.06 Allowed 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.391 0.996 . . . . 5.3200000000000003 113.219 176.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.0 mt -86.51 -11.21 52.34 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.533 1.679 . . . . 8.9900000000000002 115.533 -175.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.504 HG13 ' H ' ' A' ' 30' ' ' LYS . 11.3 p -140.54 -78.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.318 0 C-N-CA 124.839 1.255 . . . . 6.8600000000000003 108.809 157.177 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.504 ' H ' HG13 ' A' ' 29' ' ' VAL . 11.4 ttpp -69.36 109.77 4.34 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 112.809 0.67 . . . . 9.9199999999999999 112.809 -171.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -76.76 -179.91 5.67 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 122.321 1.058 . . . . 9.5500000000000007 112.911 178.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.3 tmtt? -143.37 44.55 1.53 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 126.014 1.726 . . . . 8.4399999999999995 109.404 172.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.4 tt -72.64 169.26 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.825 1.65 . . . . 2.7999999999999998 109.374 161.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.1 t -102.43 141.98 34.37 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.916 -1.115 . . . . 3.2400000000000002 109.526 164.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 73.4 mttt -61.24 -17.8 55.18 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.054 -1.654 . . . . 2.2200000000000002 113.026 174.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.3 t -61.4 -33.2 73.28 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.466 -0.771 . . . . 3.8599999999999999 112.578 166.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -65.02 -37.5 87.83 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 120.878 -1.138 . . . . 1.6399999999999999 113.185 -173.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.497 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 67.8 t80 -62.15 -54.75 36.61 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.887 1.221 . . . . 2.04 111.899 176.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 24.7 ptt180 -65.64 -5.91 9.71 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.203 1.001 . . . . 2.2200000000000002 113.187 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.414 ' HB3' ' HE2' ' A' ' 44' ' ' LYS . 6.5 mt-10 -102.27 -43.1 5.8 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 126.657 1.983 . . . . 2.8199999999999998 111.851 176.462 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 4.9 ttm -52.65 -43.29 65.4 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.766 1.27 . . . . 1.8899999999999999 109.968 168.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.497 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 72.1 mt -74.72 11.92 0.94 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 127.889 2.476 . . . . 2.2200000000000002 115.402 169.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -125.74 -11.38 6.67 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 125.7 1.6 . . . . 2.9500000000000002 113.023 166.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.414 ' HE2' ' HB3' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -109.0 -76.48 0.61 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.278 1.431 . . . . 1.8200000000000001 110.983 176.51 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.47 -19.67 66.03 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 120.624 1.557 . . . . 3.1000000000000001 115.026 -175.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.34 7.02 22.82 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.427 1.269 . . . . 1.8200000000000001 114.427 177.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -50.32 -33.9 21.82 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 117.615 2.45 . . . . 2.0699999999999998 117.615 -165.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -68.47 -25.12 64.82 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 121.102 1.773 . . . . 3.3799999999999999 112.214 -177.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.2 tpp -73.12 -7.44 51.37 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.673 1.989 . . . . 1.75 113.144 175.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.28 21.98 4.81 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.91 1.684 . . . . 3.6899999999999999 114.317 -162.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.5 t -35.31 -63.45 0.34 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 126.132 1.773 . . . . 4.4699999999999998 112.426 164.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -81.53 95.97 7.29 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 124.335 1.054 . . . . 6.1399999999999997 108.167 -177.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.2 p -51.42 -18.12 0.95 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.563 1.945 . . . . 3.4399999999999999 115.831 -168.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -58.02 -35.07 74.71 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.39 0.995 . . . . 1.72 112.63 171.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 74.1 m-80 -59.22 -38.41 79.87 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 117.83 0.815 . . . . 3.8500000000000001 111.535 172.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.94 -27.15 49.27 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 114.498 1.296 . . . . 4.9000000000000004 114.498 172.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -59.56 -37.01 77.32 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 119.546 -1.971 . . . . 3.1800000000000002 110.971 167.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.3 -11.5 42.33 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.952 1.464 . . . . 1.1200000000000001 114.952 169.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.69 -52.03 6.38 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 120.502 1.501 . . . . 0.66000000000000003 112.173 164.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.94 -35.32 76.42 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 118.951 0.796 . . . . 2.3100000000000001 112.268 -176.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -24.67 67.73 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.892 1.071 . . . . 4.6100000000000003 113.892 177.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.6 mt -73.98 -34.66 64.3 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 122.662 0.385 . . . . 0.77000000000000002 111.067 176.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 37.8 mm -58.27 -50.36 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.064 0.946 . . . . 1.01 110.982 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.36 -38.18 89.29 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.016 0.926 . . . . 2.2200000000000002 112.645 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.38 -41.51 76.34 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.845 0.858 . . . . 3.02 112.12 166.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -73.16 -40.97 64.41 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 123.437 0.695 . . . . 3.1000000000000001 111.449 -178.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -49.57 -41.99 43.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.893 1.277 . . . . 2.5600000000000001 112.723 175.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.82 -16.93 62.5 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.322 1.601 . . . . 2.1600000000000001 115.322 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -133.68 16.04 3.97 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.505 1.298 . . . . 3.7999999999999998 114.505 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -119.48 107.05 12.84 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.897 1.279 . . . . 5.0700000000000003 110.97 -174.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -73.63 0.23 13.38 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.467 1.907 . . . . 5.54 114.223 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.59 -2.43 57.31 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 117.785 -1.564 . . . . 2.8199999999999998 113.54 -167.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.532 HH11 ' HG2' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -70.89 77.03 0.64 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.134 1.967 . . . . 5.25 109.804 164.306 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -55.46 125.79 11.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 107.763 -1.199 . . . . 3.1699999999999999 107.763 164.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 36.9 t -137.31 146.19 44.34 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 124.792 1.237 . . . . 1.8200000000000001 111.594 -170.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -53.09 -41.6 65.09 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.95 1.093 . . . . 2.1800000000000002 113.95 -171.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -76.62 -14.46 59.98 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.837 0.681 . . . . 4.29 112.837 -174.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -64.84 -49.31 71.1 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.146 -0.971 . . . . 2.98 109.453 172.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -53.68 -48.18 69.73 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.261 -1.524 . . . . 2.0499999999999998 111.929 171.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 30.5 t-105 -68.97 -46.15 68.85 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.843 0.683 . . . . 0.56000000000000005 112.843 -171.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 57.5 p -59.73 -45.91 90.73 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.994 0.918 . . . . 2.5 111.027 171.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 91.6 mt -62.19 -38.46 89.21 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 117.31 -1.329 . . . . 0.59999999999999998 112.323 -179.084 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.4 mm -50.61 -44.02 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 121.294 1.861 . . . . 0.66000000000000003 111.261 174.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.11 -22.25 72.37 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 125.194 1.378 . . . . 0.56999999999999995 114.308 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.14 -20.0 70.66 Favored Glycine 0 CA--C 1.532 1.123 0 CA-C-N 118.362 1.081 . . . . 0.59999999999999998 113.193 173.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.5 mp -102.84 -45.49 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.768 1.227 . . . . 1.05 110.947 163.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.0 m -80.88 72.45 7.88 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 127.108 2.163 . . . . 1.48 108.635 -176.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -158.92 -71.23 0.02 OUTLIER Glycine 0 CA--C 1.525 0.664 0 C-N-CA 127.467 2.461 . . . . 0.90000000000000002 109.052 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -55.77 -55.63 2.84 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.187 2.591 . . . . 1.1100000000000001 111.64 170.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.8 pt -74.27 -17.33 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 N-CA-C 114.361 1.245 . . . . 1.01 114.361 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.74 -48.06 82.43 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.91 0.777 . . . . 1.0800000000000001 112.435 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.69 -47.65 76.43 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.217 -0.927 . . . . 2.9500000000000002 111.804 169.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.4 tt -57.01 -45.35 83.13 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-O 117.722 -1.132 . . . . 1.6899999999999999 111.403 -178.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.9 mt -46.32 -55.28 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 120.009 1.277 . . . . 0.88 111.005 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -61.73 -49.98 74.25 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.296 0.638 . . . . 1.8100000000000001 111.305 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -61.9 -36.58 81.73 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.891 0.876 . . . . 3.6800000000000002 111.434 -178.105 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -68.13 -44.6 75.73 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 127.896 2.478 . . . . 2.1899999999999999 111.314 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -68.2 -21.86 64.84 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.31 1.414 . . . . 3.3300000000000001 111.714 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.93 -51.49 8.5 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.535 0.734 . . . . 2.2400000000000002 111.191 172.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -64.6 -26.87 68.59 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.26 1.824 . . . . 6.46 113.324 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.6 m 53.91 20.26 2.3 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.608 2.363 . . . . 8.2100000000000009 114.021 -170.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 74.89 21.85 1.98 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 128.541 2.737 . . . . 12.76 114.242 -178.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 24.9 t . . . . . 0 C--O 1.253 1.247 0 CA-C-O 115.569 -2.158 . . . . 10.76 114.515 168.782 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 52.6 m . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 119.145 -0.455 . . . . 11.48 109.847 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.56 -117.47 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.123 0 N-CA-C 108.348 -0.982 . . . . 8.0800000000000001 108.348 138.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 42.0 t -80.81 -83.26 0.11 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.581 1.952 . . . . 4.7300000000000004 110.868 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 94.73 157.54 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 129.048 2.939 . . . . 2.3500000000000001 114.039 163.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.1 p -81.83 155.23 25.49 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.866 -1.146 . . . . 1.3400000000000001 109.754 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -61.05 -36.51 79.79 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 120.728 1.604 . . . . 2.3599999999999999 111.752 -178.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -47.86 84.43 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.615 1.166 . . . . 0.91000000000000003 110.34 176.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -68.15 -54.1 20.41 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.314 1.446 . . . . 2.98 111.645 -177.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -33.91 66.6 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.517 1.127 . . . . 4.54 109.96 172.323 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.832 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.96 -45.33 67.63 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 117.199 -1.381 . . . . 0.54000000000000004 112.201 173.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 22.5 t -53.78 -41.27 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-N 121.154 1.797 . . . . 0.68000000000000005 110.625 170.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 70.3 mt -58.48 -54.47 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.405 -0.807 . . . . 0.97999999999999998 112.172 169.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.4 t -58.34 -42.88 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 119.405 1.002 . . . . 0.68999999999999995 112.103 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.5 mp -64.87 -47.1 79.1 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.796 1.238 . . . . 1.2 111.469 176.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.9 t -57.65 -48.22 83.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 123.292 0.637 . . . . 0.69999999999999996 110.514 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -62.89 -34.18 76.86 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.532 1.133 . . . . 2.8700000000000001 111.738 175.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.0 -25.24 64.41 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.596 1.544 . . . . 2.6499999999999999 113.465 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -72.63 -52.86 13.62 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.566 -0.708 . . . . 2.0 111.0 165.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -65.9 -43.59 87.74 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.545 -0.722 . . . . 2.1400000000000001 112.923 -173.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 7.9 ptmt -58.01 -16.58 13.08 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 120.274 -1.516 . . . . 3.4300000000000002 114.941 177.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -89.61 -4.25 57.9 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.737 1.384 . . . . 3.25 114.737 173.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 3.4 m -77.96 158.72 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 120.593 1.542 . . . . 3.8999999999999999 111.188 173.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 2.1 t -60.27 -11.78 7.3 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 118.469 2.766 . . . . 7.2199999999999998 118.469 -168.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -176.2 -50.91 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.465 1.906 . . . . 10.91 111.973 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -172.84 148.72 1.86 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 130.313 3.445 . . . . 9.6999999999999993 107.313 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 100.0 p -162.74 121.68 2.18 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 121.106 1.775 . . . . 5.8399999999999999 114.127 174.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 32.5 mt -82.7 -20.26 36.43 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 115.61 1.707 . . . . 9.0 115.61 -168.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 11.9 p -149.05 -65.64 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 C-N-CA 126.996 2.118 . . . . 7.2800000000000002 108.874 168.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 12.4 ttpp -80.58 110.5 16.12 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.142 0.496 . . . . 9.6999999999999993 111.551 -177.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -77.47 179.36 6.54 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.989 1.376 . . . . 10.16 113.152 -178.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.45 56.18 0.98 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.479 1.911 . . . . 8.1799999999999997 107.936 168.278 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 16.6 tt -82.11 169.78 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 N-CA-C 106.991 -1.485 . . . . 2.9500000000000002 106.991 157.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 29.6 t -100.18 144.56 29.06 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 120.735 -1.228 . . . . 3.0600000000000001 109.559 161.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -58.16 -21.64 47.91 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.572 -1.33 . . . . 2.0899999999999999 112.766 171.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 5.1 t -63.43 -34.46 77.8 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.756 0.65 . . . . 3.6800000000000002 112.756 170.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 14.7 m -63.17 -42.66 99.44 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 120.942 -1.099 . . . . 1.78 112.05 -175.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.463 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 65.4 t80 -51.33 -60.28 3.3 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.174 0.99 . . . . 2.0899999999999999 112.061 171.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.1 ptt180 -65.18 -14.7 61.24 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.604 0.964 . . . . 2.2999999999999998 113.604 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 143' ' ' GLU . . . . . 0.445 ' HB3' ' HE2' ' B' ' 147' ' ' LYS . 7.6 mt-10 -94.21 -40.91 9.76 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 126.467 1.907 . . . . 2.8399999999999999 113.398 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.3 tmm? -59.77 -39.44 84.86 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.342 -0.614 . . . . 2.3100000000000001 109.342 167.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 145' ' ' LEU . . . . . 0.436 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 94.5 mt -66.76 9.15 0.2 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.275 2.23 . . . . 2.8300000000000001 115.352 164.249 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -128.6 -21.84 3.39 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.465 1.283 . . . . 3.0800000000000001 114.465 168.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 147' ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' B' ' 143' ' ' GLU . 0.0 OUTLIER -108.19 -42.44 4.63 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.758 1.223 . . . . 1.8100000000000001 113.56 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -106.77 -26.07 11.45 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.723 2.009 . . . . 2.77 112.67 -163.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.93 18.8 20.84 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.881 1.672 . . . . 1.8500000000000001 111.996 167.038 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -59.5 -35.46 74.18 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 116.04 1.867 . . . . 2.3599999999999999 116.04 -159.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -60.95 -45.48 94.55 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 120.002 1.273 . . . . 3.2000000000000002 111.159 -178.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 tpp -59.8 -17.03 32.6 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.042 1.737 . . . . 1.79 113.174 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.07 26.25 9.78 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.836 2.055 . . . . 3.98 112.686 -174.413 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 43.4 t -64.85 -16.69 63.48 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.161 1.541 . . . . 4.6500000000000004 115.161 177.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -100.98 125.41 47.58 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 120.019 1.281 . . . . 5.0899999999999999 108.354 161.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 58.0 p -64.43 -21.51 66.67 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.802 1.038 . . . . 3.2799999999999998 113.802 -173.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -61.64 -37.1 93.66 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-N 119.646 1.112 . . . . 1.9099999999999999 111.89 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -62.66 -38.71 91.41 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 119.01 -0.519 . . . . 4.0300000000000002 111.688 174.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -77.19 -27.45 53.6 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 119.739 1.154 . . . . 4.6900000000000004 114.018 173.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -57.68 -40.29 79.07 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 119.601 -1.937 . . . . 3.3700000000000001 111.473 166.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.06 -12.9 43.06 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.31 1.596 . . . . 1.3100000000000001 115.31 170.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.53 -50.04 8.65 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 120.368 1.44 . . . . 0.81000000000000005 112.337 165.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.55 -35.1 76.81 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.617 0.644 . . . . 2.1600000000000001 112.173 -177.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.8 -23.11 67.08 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 114.13 1.159 . . . . 4.6399999999999997 114.13 176.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 22.1 mt -74.13 -33.85 63.69 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 122.579 0.352 . . . . 0.81000000000000005 111.46 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 29.1 mm -59.71 -50.08 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 124.349 1.06 . . . . 0.90000000000000002 110.527 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -65.52 -36.04 82.65 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.471 0.653 . . . . 2.1000000000000001 112.671 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -57.14 -43.46 82.47 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.672 0.789 . . . . 3.1499999999999999 112.232 165.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 4.9 tp -69.79 -42.23 74.02 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 118.485 0.584 . . . . 3.1600000000000001 111.287 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -51.5 -40.83 60.33 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.196 1.398 . . . . 2.6699999999999999 112.173 174.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.46 -15.25 62.44 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.914 1.82 . . . . 2.1000000000000001 115.914 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -135.08 14.71 3.55 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 115.199 1.555 . . . . 3.8100000000000001 115.199 -175.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -122.68 110.0 14.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.934 1.294 . . . . 5.0700000000000003 110.908 -171.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -73.47 -27.04 61.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.876 2.07 . . . . 5.46 113.634 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 125.36 -8.33 7.91 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-O 117.953 -1.471 . . . . 2.8799999999999999 113.728 -169.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -68.51 76.7 0.28 Allowed 'General case' 0 C--N 1.346 0.421 0 CA-C-N 120.411 2.106 . . . . 7.5300000000000002 109.522 157.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.73 137.4 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 107.922 -1.14 . . . . 3.48 107.922 164.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 16.9 t -142.24 147.25 36.18 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.623 0.601 . . . . 1.9199999999999999 112.623 -173.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -48.9 -48.53 42.38 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.793 1.237 . . . . 2.1200000000000001 113.751 -172.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -74.36 -12.71 60.6 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 113.636 0.976 . . . . 4.3899999999999997 113.636 -174.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -60.96 -51.45 69.21 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.135 -0.978 . . . . 3.0600000000000001 109.399 171.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -52.29 -49.13 64.75 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.746 -1.221 . . . . 1.98 112.494 172.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 26.7 t-105 -69.1 -45.13 71.02 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 118.576 -0.726 . . . . 0.66000000000000003 112.457 -172.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 46.3 p -59.34 -45.36 91.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.458 1.103 . . . . 2.5600000000000001 110.808 170.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.463 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 58.7 mt -59.06 -40.91 86.61 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 117.36 -1.305 . . . . 0.53000000000000003 112.584 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 22.5 mm -53.69 -40.8 44.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 121.382 1.901 . . . . 0.60999999999999999 112.074 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -65.18 -25.84 71.25 Favored Glycine 0 N--CA 1.473 1.107 0 C-N-CA 124.407 1.004 . . . . 0.56000000000000005 113.545 177.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -62.25 -19.68 59.86 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 118.391 1.095 . . . . 0.71999999999999997 113.986 173.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.2 mp -110.27 -36.78 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 CA-C-N 118.449 1.125 . . . . 1.1799999999999999 111.733 166.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 22.7 m -82.32 73.79 9.33 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 125.948 1.699 . . . . 1.52 108.04 -178.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -161.85 -67.78 0.02 OUTLIER Glycine 0 CA--C 1.529 0.947 0 C-N-CA 127.283 2.373 . . . . 0.79000000000000004 110.026 -175.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -58.27 -61.28 0.28 Allowed 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.307 2.671 . . . . 0.95999999999999996 111.178 168.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.9 pt -66.48 -28.09 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 CA-C-N 119.242 0.928 . . . . 1.1799999999999999 112.975 177.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 194' ' ' ALA . . . . . 0.445 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -56.57 -46.01 80.98 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.889 0.768 . . . . 1.05 112.826 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -65.98 -30.17 70.69 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.171 -0.955 . . . . 4.7699999999999996 113.488 172.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 35.4 mt -68.14 -41.02 82.26 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.589 1.086 . . . . 4.8600000000000003 111.943 176.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 197' ' ' ILE . . . . . 0.445 HD12 ' HA ' ' B' ' 194' ' ' ALA . 70.5 mt -53.53 -42.88 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 119.278 0.944 . . . . 1.1200000000000001 110.805 171.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -61.98 -47.77 83.33 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 117.835 -1.078 . . . . 2.1099999999999999 111.93 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -52.57 -49.32 65.2 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.368 1.067 . . . . 3.4700000000000002 110.666 171.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -46.52 66.55 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.036 1.334 . . . . 4.5199999999999996 112.761 -177.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -77.8 -4.7 47.78 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.614 0.643 . . . . 2.7000000000000002 112.527 -177.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -98.82 -49.04 4.7 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.061 0.945 . . . . 3.3199999999999998 111.261 170.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -64.43 -28.7 69.85 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 128.019 2.527 . . . . 5.6399999999999997 112.967 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 59.46 16.72 5.41 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.373 1.869 . . . . 7.3799999999999999 113.314 -166.136 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 8.0 t 82.43 12.65 0.54 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 128.397 2.679 . . . . 12.23 116.229 174.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.255 1.365 0 CA-C-O 115.184 -2.341 . . . . 11.15 115.757 175.306 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 CA--C 1.503 -0.827 0 N-CA-C 108.736 -0.839 . . . . 9.9600000000000009 108.736 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -133.74 -17.7 2.2 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 124.813 1.321 . . . . 6.8300000000000001 113.223 -134.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 74.8 m 64.65 20.66 12.21 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.677 1.991 . . . . 3.27 115.828 162.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.408 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 5.3 m-30 -44.72 120.75 2.4 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.978 1.311 . . . . 2.4399999999999999 111.916 -177.165 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.9 p -61.84 156.58 20.27 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 118.967 0.803 . . . . 1.1499999999999999 110.403 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -63.19 -27.78 69.6 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.047 0.758 . . . . 2.1600000000000001 113.047 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt -69.36 -47.87 63.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.728 1.211 . . . . 1.3200000000000001 109.984 172.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -49.74 62.8 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 122.837 0.455 . . . . 2.5499999999999998 111.367 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.94 -36.49 17.48 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.729 1.612 . . . . 5.5300000000000002 111.124 172.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.19 -21.33 56.6 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.184 -1.572 . . . . 0.68000000000000005 113.716 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.1 t -60.89 -38.03 78.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 CA-C-N 121.143 1.792 . . . . 1.22 110.066 169.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.5 mt -56.7 -56.95 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-O 118.825 -0.607 . . . . 1.1200000000000001 109.967 168.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 99.5 t -54.34 -40.28 47.66 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 124.642 1.177 . . . . 0.71999999999999997 112.933 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -72.62 -39.02 67.6 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.268 -0.895 . . . . 1.0900000000000001 112.432 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.1 t -64.55 -40.41 88.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.067 0.947 . . . . 0.81000000000000005 111.53 172.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -55.15 -54.21 46.16 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.38 1.072 . . . . 2.6899999999999999 110.094 174.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -56.48 -30.16 62.6 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 115.479 1.659 . . . . 3.25 115.479 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -73.59 -57.85 3.71 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.532 0.606 . . . . 2.3500000000000001 112.171 173.032 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -68.38 -17.33 64.21 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.311 1.226 . . . . 1.8200000000000001 114.311 -171.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -44.27 -32.64 1.34 Allowed 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 120.546 1.521 . . . . 2.9199999999999999 113.215 171.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -93.4 8.02 42.17 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.07 1.748 . . . . 2.3399999999999999 114.033 -174.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.4 m -139.66 165.49 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 125.398 1.479 . . . . 2.2999999999999998 110.27 172.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.21 -42.68 62.39 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.39 0.885 . . . . 3.4300000000000002 113.39 -172.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.423 ' HA ' ' HE2' ' A' ' 25' ' ' LYS . 0.9 OUTLIER -169.5 -51.19 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.951 1.3 . . . . 5.3899999999999997 110.246 173.959 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -125.85 13.52 7.95 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.426 1.49 . . . . 7.46 111.925 -175.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -80.36 36.94 0.38 Allowed 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 115.665 1.728 . . . . 4.2699999999999996 115.665 -156.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -59.02 14.09 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 130.199 3.4 . . . . 8.5 115.331 176.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.5 t -152.71 141.47 14.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 128.941 2.897 . . . . 4.1600000000000001 107.059 -178.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt 72.96 -47.08 0.67 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 127.063 2.145 . . . . 8.7100000000000009 114.294 177.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -65.38 -65.21 0.7 Allowed 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.021 0.828 . . . . 6.5700000000000003 109.876 -178.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.15 111.55 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.855 1.662 . . . . 6.8099999999999996 112.207 167.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 12.0 pt -64.61 151.87 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 O-C-N 120.681 -1.262 . . . . 2.9399999999999999 111.085 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.4 t -76.41 138.63 40.5 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 120.504 -1.372 . . . . 3.4399999999999999 111.954 177.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.9 mtpt -72.51 -6.74 45.96 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.098 -0.955 . . . . 3.2799999999999998 113.309 169.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.1 p -80.3 -48.31 13.2 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.294 0.952 . . . . 3.0899999999999999 111.056 156.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.6 m -59.06 -35.6 73.61 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 117.234 -1.365 . . . . 1.28 113.751 -167.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -60.16 -60.38 3.91 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 121.058 1.754 . . . . 2.3799999999999999 112.07 172.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -63.78 -23.87 67.54 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.872 0.693 . . . . 2.79 112.872 -178.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -71.45 -49.0 45.77 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.121 1.368 . . . . 3.23 112.774 169.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 8.4 tmm? -59.37 -35.88 74.73 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 126.125 1.77 . . . . 1.3700000000000001 111.804 -174.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.2 mt -59.07 -20.24 51.58 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.679 1.592 . . . . 1.24 114.695 168.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -1.15 18.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.789 1.177 . . . . 2.79 113.228 175.509 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.62 -37.14 7.23 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.144 1.378 . . . . 1.8600000000000001 112.839 172.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -96.79 -72.2 0.65 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.93 1.692 . . . . 4.5 109.637 169.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.95 20.7 0.06 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 125.944 1.698 . . . . 1.5 114.769 -171.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -66.63 -23.01 66.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 128.964 2.906 . . . . 1.45 116.2 -164.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.494 ' H ' ' CD2' ' A' ' 48' ' ' HIS . 0.3 OUTLIER -76.42 -54.84 6.16 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.417 1.008 . . . . 1.49 109.608 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.4 tpp -47.7 -42.91 26.07 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.485 2.314 . . . . 1.79 113.797 162.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -109.22 34.72 3.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.729 1.212 . . . . 4.0199999999999996 113.076 -175.262 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.4 p -62.88 -39.49 94.63 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 114.942 -1.026 . . . . 5.6399999999999997 110.942 167.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -68.98 137.43 53.72 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.286 1.434 . . . . 4.6799999999999997 112.991 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.8 m -69.35 -32.79 72.08 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.954 1.701 . . . . 2.3300000000000001 112.327 175.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.85 -50.53 57.82 Favored Glycine 0 N--CA 1.47 0.922 0 CA-C-N 119.568 1.076 . . . . 1.5600000000000001 111.963 178.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -59.4 -29.29 67.63 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.971 -0.723 . . . . 3.3599999999999999 112.35 172.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -80.02 -31.85 39.59 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.679 0.992 . . . . 5.8499999999999996 113.679 174.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 mmmt -60.67 -35.88 77.34 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 119.249 -2.157 . . . . 3.7000000000000002 111.872 169.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.88 -29.89 56.73 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 117.25 -1.357 . . . . 1.04 114.076 167.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.65 -41.32 79.53 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 120.514 1.506 . . . . 0.79000000000000004 113.157 167.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -63.38 -35.31 79.99 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 125.845 1.658 . . . . 3.46 112.606 -177.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -47.82 -43.04 27.64 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.628 1.171 . . . . 3.27 112.835 168.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.487 ' HB3' HD22 ' A' ' 82' ' ' LEU . 16.4 mt -70.12 -38.48 75.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.601 -1.182 . . . . 1.01 110.35 -174.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.3 mm -63.89 -42.12 94.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 122.988 0.515 . . . . 0.87 111.518 -176.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -72.13 -37.4 69.46 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 123.319 0.648 . . . . 1.97 111.583 176.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -67.16 -30.68 70.72 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.183 -0.948 . . . . 3.6000000000000001 112.383 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.444 HD22 HD11 ' A' ' 82' ' ' LEU . 28.2 tp -69.14 -24.3 64.07 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 120.895 -1.128 . . . . 3.5 112.394 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.51 -25.96 28.7 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.143 1.777 . . . . 4.8899999999999997 113.731 171.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -85.47 -4.43 59.16 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.817 1.414 . . . . 3.77 114.817 174.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -127.59 -30.22 2.58 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 114.372 1.249 . . . . 3.9399999999999999 114.372 -171.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -90.97 57.97 3.65 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.943 1.297 . . . . 5.7199999999999998 112.528 -163.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -87.47 84.23 7.18 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.361 1.065 . . . . 5.6799999999999997 111.543 177.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 74.0 -28.6 0.95 Allowed Glycine 0 N--CA 1.476 1.309 0 C-N-CA 125.831 1.681 . . . . 4.1399999999999997 115.863 167.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 -89.14 152.15 21.79 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 126.229 1.812 . . . . 7.4500000000000002 110.329 169.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.4 mp -127.39 138.48 54.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 106.0 -1.852 . . . . 4.2699999999999996 106.0 170.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.0 152.28 20.38 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.579 0.228 . . . . 2.25 111.219 173.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -61.62 -48.67 79.84 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 123.408 1.575 . . . . 2.1299999999999999 109.558 167.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.2 -16.5 64.34 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.95 2.9 . . . . 2.8999999999999999 114.308 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.2 tt0 -59.85 -55.04 39.07 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.444 1.498 . . . . 2.9199999999999999 110.256 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -59.49 -38.3 80.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.367 -0.833 . . . . 2.4500000000000002 111.813 177.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 22.2 t-105 -61.96 -49.98 73.94 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 118.818 -0.611 . . . . 0.56999999999999995 111.084 177.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.3 t -71.63 -15.6 62.25 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 113.924 1.083 . . . . 1.8700000000000001 113.924 176.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.487 HD22 ' HB3' ' A' ' 62' ' ' LEU . 89.3 mt -74.34 -47.53 33.81 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 120.009 1.277 . . . . 0.76000000000000001 111.861 164.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.8 mm -51.31 -40.66 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-N 120.895 1.679 . . . . 0.78000000000000003 113.77 -174.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.11 -22.62 60.81 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 118.767 0.712 . . . . 0.71999999999999997 113.641 177.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.41 -16.76 80.43 Favored Glycine 0 CA--C 1.534 1.234 0 O-C-N 121.181 -1.187 . . . . 0.58999999999999997 113.882 175.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.8 mp -95.62 -46.36 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 CA-C-N 118.382 1.091 . . . . 0.79000000000000004 110.871 161.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 28.8 m -84.78 83.55 8.0 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 126.128 1.771 . . . . 1.27 108.54 -171.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -167.45 -64.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.961 0 C-N-CA 125.428 1.49 . . . . 1.1699999999999999 111.932 -171.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -58.19 -53.17 4.5 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.2 2.6 . . . . 1.47 111.293 165.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.9 pt -61.22 -24.61 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 113.115 0.783 . . . . 1.8500000000000001 113.115 174.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.39 -53.42 52.64 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.412 1.006 . . . . 1.0 112.389 -175.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -61.08 -34.17 74.51 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.621 -1.299 . . . . 2.9900000000000002 112.662 175.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.6 tt -66.24 -44.47 83.67 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.211 1.004 . . . . 1.29 111.23 -178.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 56.0 mt -49.32 -59.91 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.63 0.772 . . . . 1.0600000000000001 109.734 166.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -61.95 -28.52 69.6 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.014 -1.054 . . . . 1.9399999999999999 113.409 -173.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.348 3.2 pt-20 -87.21 -11.43 49.84 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 121.277 -0.89 . . . . 3.1400000000000001 113.095 175.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.448 ' C ' ' H ' ' A' ' 99' ' ' GLN . 0.6 OUTLIER -81.86 -40.73 22.02 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.433 1.893 . . . . 2.1899999999999999 113.935 169.553 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -66.43 7.66 0.31 Allowed 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 123.501 1.62 . . . . 2.4500000000000002 112.889 174.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.448 ' H ' ' C ' ' A' ' 97' ' ' GLN . 16.0 mm-40 -130.8 -64.94 0.81 Allowed 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.891 2.076 . . . . 1.8899999999999999 109.704 -175.092 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 49.05 12.06 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 130.419 3.488 . . . . 4.5999999999999996 116.162 171.183 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.0 t 179.75 31.72 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 128.116 2.566 . . . . 6.5999999999999996 109.764 -168.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 23.3 p -95.02 24.72 4.64 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 119.82 -1.8 . . . . 8.5700000000000003 112.255 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 41.3 m . . . . . 0 N--CA 1.479 0.989 1 C-N-CA 133.504 4.722 . . . . 10.19 107.905 -162.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 23.1 m . . . . . 0 CA--C 1.503 -0.83 0 N-CA-C 108.626 -0.879 . . . . 9.8399999999999999 108.626 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -134.49 -16.13 2.1 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 124.824 1.327 . . . . 6.7000000000000002 113.364 -134.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 93.6 m 66.42 19.61 10.94 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.769 2.028 . . . . 3.4399999999999999 115.798 162.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 5.9 m-30 -46.93 124.34 6.18 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.562 1.145 . . . . 2.4500000000000002 112.237 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 5.4 p -65.52 166.78 9.85 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 118.436 0.562 . . . . 1.1599999999999999 111.878 -176.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -62.19 -37.9 87.07 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.379 -0.826 . . . . 2.9300000000000002 111.957 173.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.38 -51.49 65.66 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.278 0.631 . . . . 1.0600000000000001 109.724 173.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.79 -54.8 10.29 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.26 -0.274 . . . . 2.4700000000000002 110.26 -169.343 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . 0.257 0.7 OUTLIER -60.49 -23.41 64.48 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 122.057 -0.402 . . . . 4.6200000000000001 111.621 177.06 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.24 -25.03 61.47 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 119.34 -2.1 . . . . 1.05 114.324 169.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 34.3 t -61.58 -35.38 66.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 121.297 1.862 . . . . 1.05 110.879 170.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 71.2 mt -54.52 -55.8 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 121.383 -0.823 . . . . 1.0800000000000001 110.713 165.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 78.9 t -56.26 -41.45 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.951 1.3 . . . . 0.83999999999999997 112.474 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.71 -38.77 87.41 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.369 0.668 . . . . 1.1899999999999999 112.287 176.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 71.7 t -71.39 -39.32 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.709 0.804 . . . . 0.91000000000000003 111.494 177.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -51.04 -55.89 15.24 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.726 1.21 . . . . 2.71 109.605 171.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -50.52 -40.77 52.43 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.9 1.444 . . . . 3.3500000000000001 114.9 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -66.44 -57.53 7.18 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.705 0.684 . . . . 2.3900000000000001 111.79 178.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -66.05 -20.52 66.2 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.617 0.969 . . . . 1.8400000000000001 113.617 -171.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -45.88 -32.68 2.77 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 120.216 1.371 . . . . 3.0800000000000001 113.526 170.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -93.89 8.37 41.51 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.242 1.417 . . . . 2.1400000000000001 113.916 -174.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.0 m -135.74 175.56 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.742 1.617 . . . . 2.29 110.033 169.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.48 -32.65 64.42 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 120.823 -1.173 . . . . 3.46 113.93 -175.413 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 171.08 -55.41 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 129.846 3.258 . . . . 4.9000000000000004 109.945 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -118.73 3.76 11.63 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.728 1.211 . . . . 7.5300000000000002 113.855 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 1.4 m -78.29 41.77 0.39 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 117.047 2.24 . . . . 4.2800000000000002 117.047 -152.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.05 10.02 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 129.065 2.946 . . . . 8.6500000000000004 115.806 176.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 15.0 t -143.64 137.98 25.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 128.111 2.565 . . . . 4.2800000000000002 106.916 -179.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt 75.29 -44.04 0.52 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.931 2.492 . . . . 8.4100000000000001 114.166 -178.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -68.14 -64.18 0.91 Allowed 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.674 0.67 . . . . 6.5899999999999999 111.842 -167.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.27 108.6 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.15 1.78 . . . . 6.71 112.954 177.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 22.0 pt -59.9 145.41 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 108.441 -0.948 . . . . 2.7599999999999998 108.441 169.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 30.3 t -73.18 138.14 45.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 117.637 -1.625 . . . . 2.9100000000000001 111.209 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mtpt -63.94 -13.93 49.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.641 0.776 . . . . 3.3300000000000001 112.934 167.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 97.2 p -77.38 -27.73 52.6 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.02 -1.05 . . . . 2.46 113.233 163.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.3 m -78.55 -39.56 37.44 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.937 1.244 . . . . 1.1699999999999999 113.118 -173.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.444 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 64.5 t80 -55.51 -55.9 26.47 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 120.366 1.439 . . . . 2.2599999999999998 111.727 -177.461 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -55.49 -19.45 9.71 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.402 1.481 . . . . 2.5099999999999998 113.805 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 143' ' ' GLU . . . . . 0.404 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 23.4 mt-10 -100.36 -46.23 5.32 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 125.332 1.453 . . . . 3.25 112.496 -174.307 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -51.15 -41.95 60.47 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.944 1.297 . . . . 1.1899999999999999 110.646 165.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.8 mt -59.82 -17.25 34.62 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 116.098 1.888 . . . . 1.0800000000000001 116.098 168.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -114.77 -5.0 12.65 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 120.679 1.581 . . . . 2.6699999999999999 113.955 174.007 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 147' ' ' LYS . . . . . 0.404 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 1.3 mppt? -107.18 -36.02 6.67 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.605 1.562 . . . . 3.02 113.23 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -87.92 -72.65 0.52 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.307 1.443 . . . . 4.3499999999999996 108.617 163.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.58 22.65 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.794 2.038 . . . . 1.5700000000000001 114.918 -171.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -66.11 -25.67 67.1 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.376 2.67 . . . . 1.54 116.622 -166.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 151' ' ' HIS . . . . . 0.549 ' H ' ' CD2' ' B' ' 151' ' ' HIS . 0.6 OUTLIER -73.17 -55.87 5.87 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.936 1.244 . . . . 1.51 109.805 -177.639 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 27.2 tpp -47.77 -49.79 27.5 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.704 2.002 . . . . 1.99 112.891 163.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 1.4 mt -99.7 35.37 2.02 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.667 1.187 . . . . 4.0199999999999996 113.147 -174.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 13.5 p -65.51 -36.77 84.82 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.785 -1.098 . . . . 5.3600000000000003 111.183 167.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -71.89 135.7 46.64 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.102 1.361 . . . . 4.96 113.062 174.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 96.9 m -67.07 -33.15 74.88 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.877 1.671 . . . . 2.4900000000000002 112.533 174.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -64.29 -52.56 42.84 Favored Glycine 0 N--CA 1.471 0.992 0 CA-C-N 119.98 1.264 . . . . 1.6599999999999999 112.152 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -58.4 -29.87 66.39 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.013 0.925 . . . . 3.54 112.446 173.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 57.7 mtm-85 -78.64 -31.52 46.9 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.779 1.4 . . . . 6.0599999999999996 114.779 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -60.93 -37.09 81.11 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 119.879 -1.763 . . . . 3.8500000000000001 111.68 168.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -53.22 -32.14 46.75 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-O 117.581 -1.2 . . . . 1.0600000000000001 113.795 168.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.6 -44.42 74.36 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.869 1.268 . . . . 0.97999999999999998 113.152 169.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -62.96 -36.32 83.08 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.754 2.022 . . . . 3.5899999999999999 112.842 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -52.53 -36.21 55.05 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.916 -1.115 . . . . 2.96 112.336 171.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 9.8 mt -73.36 -36.14 66.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.949 -0.569 . . . . 1.04 111.247 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.0 mm -58.86 -44.8 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 123.797 0.839 . . . . 0.92000000000000004 111.54 177.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -76.04 -33.11 59.62 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 123.168 0.587 . . . . 1.74 112.014 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -67.29 -32.4 73.36 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.341 -0.85 . . . . 3.52 112.364 170.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 22.2 tp -67.73 -23.85 65.31 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.014 -1.054 . . . . 3.3799999999999999 112.123 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.2 -32.78 49.77 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.537 1.535 . . . . 5.0300000000000002 113.843 170.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.09 -7.4 58.86 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.645 1.35 . . . . 3.7599999999999998 114.645 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -127.31 -26.44 3.07 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 115.091 1.515 . . . . 3.7000000000000002 115.091 -168.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 32.7 t60 -100.21 66.75 1.33 Allowed 'General case' 0 CA--C 1.548 0.889 0 O-C-N 120.885 -1.135 . . . . 5.29 112.817 -163.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -81.41 69.58 8.08 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.847 1.308 . . . . 5.8499999999999996 111.898 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.96 -24.54 1.04 Allowed Glycine 0 CA--C 1.536 1.399 0 C-N-CA 125.858 1.694 . . . . 3.6899999999999999 115.694 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 16.9 mmt85 -79.97 142.71 34.8 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.752 1.221 . . . . 7.29 110.494 169.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 3.4 mp -111.27 145.53 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 N-CA-C 106.547 -1.649 . . . . 4.5700000000000003 106.547 165.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.79 150.74 25.28 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 122.907 0.483 . . . . 2.2200000000000002 109.816 168.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -59.61 -49.6 77.13 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 123.569 1.652 . . . . 2.1400000000000001 109.559 169.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.44 -16.91 26.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 129.821 3.248 . . . . 3.1600000000000001 114.687 176.368 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -59.36 -57.51 12.67 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.243 1.417 . . . . 3.0299999999999998 110.649 175.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -57.62 -40.2 78.61 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.444 -0.785 . . . . 2.3700000000000001 112.331 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.9 t-105 -60.85 -51.47 69.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.229 -0.891 . . . . 0.67000000000000004 111.351 174.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 7.1 t -69.43 -18.58 63.75 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.982 1.264 . . . . 1.6499999999999999 113.701 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.444 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 97.3 mt -68.87 -51.27 42.12 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 120.092 1.314 . . . . 0.78000000000000003 110.978 164.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 30.1 mm -52.0 -37.29 21.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 CA-C-N 121.035 1.743 . . . . 0.69999999999999996 114.336 -173.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.33 -22.07 65.02 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 119.309 0.959 . . . . 0.67000000000000004 114.238 175.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.79 -18.22 78.72 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 118.63 1.215 . . . . 0.69999999999999996 113.527 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.2 mp -101.48 -41.54 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 118.385 1.093 . . . . 0.82999999999999996 110.681 166.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 24.7 m -82.11 84.93 6.87 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.272 1.429 . . . . 1.3700000000000001 108.84 -177.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -171.88 -66.17 0.04 OUTLIER Glycine 0 CA--C 1.528 0.896 0 CA-C-O 118.258 -1.301 . . . . 1.0700000000000001 112.194 -170.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -58.36 -54.19 3.3 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.066 2.511 . . . . 1.3899999999999999 110.95 167.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 35.5 pt -64.95 -21.04 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 113.387 0.884 . . . . 1.8 113.387 175.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.01 -55.91 24.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.493 1.042 . . . . 0.97999999999999998 112.643 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -59.56 -34.21 72.4 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.518 -1.364 . . . . 3.1200000000000001 112.558 175.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.3 tt -66.14 -43.58 86.66 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 124.126 0.97 . . . . 1.45 110.725 -177.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 48.4 mt -51.69 -58.26 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.97 0.908 . . . . 1.23 109.631 167.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 198' ' ' HIS . . . . . 0.422 ' CD2' ' HE2' ' A' ' 25' ' ' LYS . 80.7 t60 -70.79 -5.57 31.22 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 114.668 1.358 . . . . 1.8300000000000001 114.668 -173.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.339 3.5 pt-20 -104.01 -15.06 15.71 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.954 1.302 . . . . 3.0600000000000001 112.842 167.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 200' ' ' GLN . . . . . 0.462 ' C ' ' H ' ' B' ' 202' ' ' GLN . 11.2 mm-40 -80.08 -39.55 29.43 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 126.434 1.894 . . . . 2.1699999999999999 114.674 169.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.06 10.34 0.11 Allowed 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 121.411 1.914 . . . . 2.5099999999999998 112.977 171.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 202' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' B' ' 200' ' ' GLN . 2.3 mm-40 -126.29 -76.51 0.58 Allowed 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 127.241 2.216 . . . . 1.8899999999999999 109.149 -178.022 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.17 17.07 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 130.333 3.453 . . . . 4.1699999999999999 116.72 169.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 41.9 t -173.43 26.58 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 127.142 2.177 . . . . 6.4000000000000004 109.937 -168.096 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 94.2 p -114.45 10.34 16.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.126 1.37 . . . . 8.5500000000000007 112.783 -177.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 49.9 m . . . . . 0 C--O 1.247 0.938 1 C-N-CA 132.667 4.387 . . . . 9.9100000000000001 107.198 -167.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 CA--C 1.504 -0.799 0 N-CA-C 109.165 -0.68 . . . . 9.8800000000000008 109.165 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -131.29 -14.62 3.34 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 118.914 -1.114 . . . . 6.71 113.525 -132.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.9 t 69.25 3.39 4.09 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.836 2.054 . . . . 4.79 115.88 164.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -35.25 106.71 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 126.198 1.799 . . . . 2.04 113.94 -174.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 81.8 p -68.2 153.88 42.84 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.871 0.469 . . . . 1.03 110.661 -175.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.446 ' HG2' HG21 ' B' ' 117' ' ' VAL . 6.2 tp10 -52.58 -38.46 60.05 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.776 0.83 . . . . 2.5699999999999998 111.355 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -42.77 99.77 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.362 1.865 . . . . 0.82999999999999996 111.672 177.018 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -50.69 13.61 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 118.69 0.677 . . . . 2.7999999999999998 111.607 -177.547 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -49.68 -34.82 19.59 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.237 1.015 . . . . 6.0599999999999996 111.17 165.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.745 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.38 -40.63 77.31 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 116.821 -1.561 . . . . 0.57999999999999996 114.229 171.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.4 t -53.76 -47.32 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 CA-C-N 121.438 1.926 . . . . 0.98999999999999999 110.077 169.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.2 mt -52.46 -51.53 32.84 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 CA-C-N 118.556 0.617 . . . . 0.75 111.505 172.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 16.9 t -60.21 -47.67 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.421 1.088 . . . . 0.53000000000000003 112.195 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 mp -57.92 -45.85 85.9 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.417 1.087 . . . . 0.90000000000000002 111.022 175.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.9 t -59.22 -54.13 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 126.072 1.749 . . . . 0.69999999999999996 111.792 -178.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 tp10 -71.22 -32.95 69.43 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.11 1.323 . . . . 5.04 112.234 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -67.72 -17.64 64.63 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 120.214 1.37 . . . . 2.5899999999999999 113.432 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -80.26 -56.68 4.04 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.321 -0.862 . . . . 2.02 111.65 161.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.435 ' HB3' ' CE1' ' B' ' 198' ' ' HIS . 21.2 m-85 -59.67 -34.28 72.65 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.246 -0.883 . . . . 2.02 113.059 -169.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -47.6 -39.34 16.57 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.672 1.578 . . . . 2.8999999999999999 113.949 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.476 ' CE2' ' HG3' ' A' ' 41' ' ' MET . 90.9 m-85 -82.61 -19.69 37.86 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 120.747 -1.221 . . . . 2.3700000000000001 113.562 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 1.5 t -77.38 -38.64 26.92 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.283 1.833 . . . . 3.3999999999999999 110.97 168.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.4 p 146.57 -110.67 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.891 1 C-N-CA 132.29 4.236 . . . . 4.8200000000000003 111.648 171.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.42 -10.51 0.36 Allowed 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 116.266 1.951 . . . . 8.0899999999999999 116.266 -170.077 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -151.92 -6.94 0.23 Allowed 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 116.208 1.929 . . . . 7.75 116.208 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.5 t -163.38 143.17 8.65 Favored 'General case' 0 N--CA 1.477 0.917 0 O-C-N 118.936 -2.353 . . . . 4.6399999999999997 112.211 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 91.7 mt -49.58 -31.44 10.56 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 127.937 2.495 . . . . 8.1699999999999999 114.002 172.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.9 t -133.94 61.67 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-O 123.935 1.826 . . . . 4.3700000000000001 110.041 -175.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.8 ttpp -111.71 -6.19 14.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.414 2.286 . . . . 8.5099999999999998 113.315 168.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -170.08 -35.01 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 128.024 2.53 . . . . 7.0099999999999998 110.783 -168.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 71.89 84.98 0.13 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.062 1.345 . . . . 7.3700000000000001 111.529 163.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.0 tt -50.94 142.1 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.647 0.779 . . . . 3.75 110.539 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.9 m -113.61 138.27 50.41 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.12 -1.437 . . . . 3.2799999999999998 107.12 168.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.503 ' HE2' ' OE2' ' A' ' 78' ' ' GLU . 15.2 mttp -76.64 -15.96 59.68 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.133 0.973 . . . . 3.3799999999999999 110.633 -154.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.3 p -41.49 -27.86 0.11 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.238 1.815 . . . . 2.1499999999999999 114.722 154.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.9 m -74.33 -44.27 53.14 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.19 0.996 . . . . 1.48 112.64 171.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -52.95 -50.47 63.97 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.152 1.381 . . . . 1.8200000000000001 112.104 -172.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -54.35 -31.53 54.76 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.878 1.271 . . . . 3.3100000000000001 113.397 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -95.56 -36.67 11.18 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 112.78 0.659 . . . . 4.1100000000000003 112.78 -174.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' MET . . . . . 0.476 ' HG3' ' CE2' ' A' ' 22' ' ' TYR . 11.8 tmm? -48.57 -47.77 39.36 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.487 0.715 . . . . 1.5600000000000001 110.179 159.004 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.1 mt -54.48 -51.49 64.89 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.523 0.729 . . . . 1.05 112.685 173.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.41 -6.49 59.39 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.535 1.68 . . . . 3.0 115.535 -174.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.93 -37.33 9.44 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.63 1.172 . . . . 2.1699999999999999 113.715 167.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -107.1 -21.85 12.84 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.006 1.322 . . . . 2.9300000000000002 114.537 -167.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 64.3 mt -111.01 44.49 1.28 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.846 1.258 . . . . 2.3799999999999999 109.843 162.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.6 p30 -66.76 -2.78 5.43 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 115.865 1.802 . . . . 1.53 115.865 -169.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.433 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -100.34 -48.77 4.47 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.648 1.979 . . . . 2.5099999999999998 111.977 178.678 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 45.4 tpp -72.17 33.03 0.06 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.801 2.04 . . . . 2.2999999999999998 112.816 175.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 tp -89.1 -36.05 15.95 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 127.014 2.126 . . . . 4.0300000000000002 113.129 -157.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.96 28.13 17.09 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.733 0.813 . . . . 4.9800000000000004 112.094 -175.041 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.5 t70 58.61 -77.53 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 129.043 2.937 . . . . 5.2300000000000004 112.617 -170.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 50.9 m -132.26 -17.28 2.68 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 126.827 2.051 . . . . 2.29 111.334 -173.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -69.84 -65.37 2.58 Favored Glycine 0 N--CA 1.473 1.129 0 CA-C-N 120.566 1.53 . . . . 1.5600000000000001 112.983 -170.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -59.7 -24.09 63.67 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.652 0.781 . . . . 3.7799999999999998 112.83 172.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -79.89 -46.04 17.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.675 1.19 . . . . 5.0199999999999996 113.736 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -58.28 -37.1 74.34 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.039 -1.663 . . . . 3.6000000000000001 111.26 167.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.26 -46.17 79.78 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 117.45 -1.262 . . . . 1.8100000000000001 112.0 168.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.34 -48.76 65.3 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.244 1.018 . . . . 0.79000000000000004 112.386 170.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.37 -28.53 69.76 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 124.458 1.103 . . . . 2.5899999999999999 113.319 -178.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -59.24 -38.22 79.47 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 120.446 -1.409 . . . . 3.54 112.196 173.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 mt -66.05 -35.35 80.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.308 -0.86 . . . . 0.88 110.953 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 20.0 mm -67.1 -50.11 66.94 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.253 0 C-N-CA 123.938 0.895 . . . . 1.02 110.973 -177.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -67.41 -24.91 65.71 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.234 1.014 . . . . 3.3700000000000001 112.363 -178.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -67.71 -49.61 61.8 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 124.328 1.051 . . . . 3.0600000000000001 113.795 164.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.408 HD12 ' HE2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -97.73 -34.0 11.08 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 120.461 -1.4 . . . . 2.5099999999999998 114.674 -163.792 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -65.39 -14.43 60.86 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 119.888 -1.758 . . . . 4.5800000000000001 112.861 169.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.25 -16.65 52.03 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.533 1.308 . . . . 3.6200000000000001 114.533 167.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -128.44 -4.04 5.44 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.726 1.75 . . . . 3.73 115.726 -167.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -137.54 118.94 14.72 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 120.376 -1.453 . . . . 4.1900000000000004 109.854 172.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -94.24 -108.03 0.13 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.485 1.514 . . . . 4.04 113.33 -163.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -89.03 15.44 57.98 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 128.09 2.757 . . . . 3.8599999999999999 113.342 176.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.4 mmt-85 -126.38 147.57 49.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.816 1.646 . . . . 4.9699999999999998 109.311 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.0 mm -142.8 141.35 27.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 125.337 1.455 . . . . 2.5299999999999998 108.453 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.4 t -94.4 156.38 16.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.393 0.542 . . . . 2.3399999999999999 112.059 169.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -58.98 -40.39 84.7 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.796 0.808 . . . . 1.9299999999999999 111.188 161.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -73.38 -16.6 61.34 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.385 1.074 . . . . 4.0899999999999999 112.686 -172.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.503 ' OE2' ' HE2' ' A' ' 35' ' ' LYS . 25.6 mt-10 -60.75 -52.44 65.08 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.893 0.77 . . . . 3.0899999999999999 111.374 175.059 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -54.13 -42.84 69.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 121.228 -0.92 . . . . 1.8500000000000001 111.092 174.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -65.33 -52.34 54.58 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 118.292 -0.861 . . . . 0.67000000000000004 112.475 -177.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.7 t -68.65 -26.82 65.52 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.572 1.078 . . . . 1.8400000000000001 112.742 177.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.0 mt -68.57 -38.71 80.93 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 119.986 1.266 . . . . 0.79000000000000004 111.357 173.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.4 mm -58.42 -38.88 72.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 120.469 1.486 . . . . 0.96999999999999997 112.718 -178.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.42 -24.64 52.85 Favored Glycine 0 CA--C 1.54 1.594 0 CA-C-N 119.288 0.949 . . . . 0.90000000000000002 113.405 174.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.68 -8.81 57.62 Favored Glycine 0 CA--C 1.534 1.266 0 O-C-N 121.131 -1.217 . . . . 0.78000000000000003 114.12 173.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.2 mp -124.44 -41.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.878 1.339 . . . . 1.04 112.154 172.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 79.5 m -81.74 94.05 6.93 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.052 1.741 . . . . 1.3500000000000001 108.361 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -177.37 -68.95 0.06 OUTLIER Glycine 0 CA--C 1.527 0.829 0 CA-C-O 118.606 -1.108 . . . . 1.0800000000000001 112.253 -172.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.76 -43.73 30.07 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.71 2.273 . . . . 1.1000000000000001 111.378 169.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 12.2 pt -75.64 -19.56 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 N-CA-C 113.569 0.952 . . . . 1.21 113.569 172.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.08 -54.67 43.2 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.717 1.144 . . . . 1.1799999999999999 111.973 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.49 -42.68 78.7 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 118.23 -0.89 . . . . 2.8199999999999998 112.673 169.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.9 tt -59.78 -42.15 92.69 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 118.891 0.769 . . . . 1.25 112.126 -176.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.2 mt -55.79 -56.9 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 124.109 0.964 . . . . 1.21 109.504 173.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.4 ' CE1' ' HB3' ' B' ' 123' ' ' TYR . 60.0 t60 -59.64 -36.29 76.08 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.82 1.248 . . . . 2.2400000000000002 112.789 -177.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -88.47 -9.19 53.32 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.07 0.948 . . . . 3.1499999999999999 113.282 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -87.9 -48.47 7.77 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 124.453 1.101 . . . . 2.9300000000000002 113.802 169.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -57.52 -37.59 73.27 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.128 0.966 . . . . 2.5299999999999998 111.99 -171.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -68.56 -53.05 25.38 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.471 1.108 . . . . 2.3799999999999999 111.553 174.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -59.71 -0.87 0.21 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 127.462 2.305 . . . . 6.3700000000000001 114.098 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.1 m -144.73 30.2 1.21 Allowed 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.26 -1.525 . . . . 6.6600000000000001 112.487 163.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 39.1 m -75.13 -6.3 48.83 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.933 -1.104 . . . . 10.02 113.316 168.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 C--O 1.247 0.932 0 C-N-CA 129.582 3.153 . . . . 11.52 109.313 -174.565 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 24.1 m . . . . . 0 CA--C 1.504 -0.816 0 N-CA-C 108.982 -0.748 . . . . 9.5099999999999998 108.982 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -135.8 -10.1 2.08 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.821 1.045 . . . . 6.21 113.821 -132.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 8.6 t 78.45 -7.7 1.76 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 128.139 2.575 . . . . 6.0999999999999996 114.799 169.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -35.25 106.4 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 126.881 2.072 . . . . 2.1200000000000001 113.111 -175.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 82.2 p -74.08 157.47 36.01 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 122.831 0.453 . . . . 1.1399999999999999 109.797 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -63.6 -23.34 67.34 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.656 -0.653 . . . . 2.6499999999999999 111.962 176.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.4 -41.11 98.41 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.369 0.668 . . . . 0.75 110.053 170.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.76 -51.02 12.16 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.759 0.651 . . . . 3.0299999999999998 112.759 -177.605 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -34.31 -50.26 0.41 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.774 1.23 . . . . 4.2400000000000002 111.899 159.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.745 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.04 -41.85 85.84 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 116.488 -1.72 . . . . 0.73999999999999999 113.959 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 15.6 t -53.83 -47.37 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-N 122.138 2.245 . . . . 1.01 110.788 168.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 16.6 mt -55.01 -49.19 73.62 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 119.454 1.025 . . . . 0.84999999999999998 111.224 173.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.446 HG21 ' HG2' ' A' ' 7' ' ' GLU . 23.2 t -65.62 -42.14 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.958 1.303 . . . . 0.57999999999999996 112.389 -176.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.6 mp -60.55 -42.44 96.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.615 1.166 . . . . 0.97999999999999998 111.153 172.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 18.0 t -65.06 -54.13 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.113 1.365 . . . . 0.68000000000000005 112.807 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 34.7 tp10 -69.69 -34.35 73.8 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 121.016 1.735 . . . . 4.75 111.874 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -68.73 -19.34 64.34 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.885 1.22 . . . . 2.5800000000000001 113.481 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -72.65 -65.97 0.72 Allowed 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.452 -0.78 . . . . 2.0499999999999998 110.985 158.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 123' ' ' TYR . . . . . 0.4 ' HB3' ' CE1' ' A' ' 95' ' ' HIS . 32.6 m-85 -56.35 -34.07 66.27 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 117.802 -1.094 . . . . 2.1000000000000001 113.777 -167.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 13.5 ptmt -46.78 -38.06 9.54 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 121.392 1.905 . . . . 2.7400000000000002 114.034 175.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 125' ' ' TYR . . . . . 0.535 ' CE2' ' HG3' ' B' ' 144' ' ' MET . 91.3 m-85 -82.89 -10.01 59.03 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 120.359 -1.463 . . . . 2.25 114.145 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 2.3 t -101.73 -30.87 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 127.057 2.143 . . . . 3.2799999999999998 111.459 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 79.4 p 147.02 -110.5 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.873 1 C-N-CA 132.327 4.251 . . . . 4.7599999999999998 111.913 163.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.87 -12.92 0.19 Allowed 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 116.057 1.873 . . . . 8.1099999999999994 116.057 -168.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -151.65 -4.61 0.27 Allowed 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 116.157 1.91 . . . . 7.75 116.157 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 25.1 t -162.7 148.97 12.62 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 118.996 -2.315 . . . . 4.7300000000000004 112.464 177.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.53 -26.62 68.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.932 1.693 . . . . 8.2599999999999998 114.113 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 4.5 t -132.2 61.53 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 CA-C-O 123.749 1.738 . . . . 4.2999999999999998 109.944 -177.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 4.6 ttpp -112.49 -5.2 14.07 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.947 2.099 . . . . 8.3900000000000006 113.283 171.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -172.54 -35.78 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 127.58 2.352 . . . . 7.21 110.198 -165.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.48 83.84 0.14 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.978 1.311 . . . . 7.3700000000000001 110.715 164.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 8.2 tt -51.45 144.77 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 123.316 0.646 . . . . 3.5699999999999998 109.952 173.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 58.6 m -117.84 144.31 45.51 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 121.011 -1.055 . . . . 3.2000000000000002 108.26 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 138' ' ' LYS . . . . . 0.453 ' HE2' ' OE1' ' B' ' 181' ' ' GLU . 17.2 mttp -73.1 -16.71 61.46 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.331 -0.856 . . . . 2.9399999999999999 112.183 -154.667 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.1 p -48.85 -29.5 4.71 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.652 1.981 . . . . 2.0 114.048 161.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 46.7 m -68.59 -46.9 68.11 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.745 1.157 . . . . 1.3100000000000001 112.577 171.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -55.93 -53.85 51.86 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 120.196 1.362 . . . . 1.9199999999999999 112.245 -170.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -50.17 -29.56 9.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.285 1.034 . . . . 3.2400000000000002 113.19 175.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -94.89 -36.2 11.72 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 114.505 1.298 . . . . 3.6000000000000001 114.505 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 144' ' ' MET . . . . . 0.535 ' HG3' ' CE2' ' B' ' 125' ' ' TYR . 4.6 tmm? -53.37 -44.77 68.84 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 118.942 -0.551 . . . . 1.2 110.43 163.06 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 43.1 mt -53.21 -49.11 67.44 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.92 0.782 . . . . 1.1799999999999999 112.155 170.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.0 -8.13 59.65 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.012 1.486 . . . . 2.6699999999999999 115.012 -172.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.37 -40.64 7.0 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.852 1.261 . . . . 1.8500000000000001 113.859 167.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -101.35 -28.74 12.43 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.382 1.473 . . . . 2.7599999999999998 113.209 -165.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 46.3 mt -108.41 40.5 1.76 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.323 1.449 . . . . 2.6400000000000001 111.022 166.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -62.0 -20.17 63.61 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.597 1.703 . . . . 1.3500000000000001 115.597 -169.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 151' ' ' HIS . . . . . 0.584 ' H ' ' CD2' ' B' ' 151' ' ' HIS . 0.0 OUTLIER -80.83 -59.94 2.49 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.165 1.386 . . . . 1.9199999999999999 111.916 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 42.7 tpp -58.64 -15.63 12.5 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 126.055 1.742 . . . . 2.0 115.524 173.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 50.9 tp -51.08 -29.87 14.3 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.634 2.774 . . . . 4.2400000000000002 115.779 -171.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 21.7 m 60.08 29.67 19.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.622 1.169 . . . . 4.6900000000000004 112.823 -174.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 12.0 t70 42.64 -97.53 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.352 1.861 . . . . 6.1799999999999997 111.71 -163.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 30.4 m -93.89 -25.3 17.37 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.106 1.362 . . . . 2.5600000000000001 112.164 -168.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -67.13 -68.44 1.66 Allowed Glycine 0 N--CA 1.477 1.383 0 CA-C-N 120.712 1.596 . . . . 1.5900000000000001 113.305 -167.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -60.53 -21.87 62.97 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.094 0.958 . . . . 3.5699999999999998 112.759 173.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 159' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' B' ' 162' ' ' ALA . 1.1 ttt-85 -82.41 -37.83 24.94 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.326 1.45 . . . . 4.9400000000000004 114.509 -178.156 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 18.2 mmmt -63.56 -37.54 87.71 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 119.981 -1.699 . . . . 4.6500000000000004 111.387 165.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -55.03 -43.54 73.81 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-O 117.192 -1.385 . . . . 1.8 111.646 168.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 162' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' B' ' 159' ' ' ARG . . . -52.53 -52.57 54.05 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.46 1.104 . . . . 0.94999999999999996 111.926 170.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -56.78 -37.18 70.74 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.865 1.266 . . . . 2.5800000000000001 113.212 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 34.7 mtmt -57.79 -38.36 75.37 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 121.167 -0.958 . . . . 3.5899999999999999 112.753 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 10.2 mt -66.27 -42.42 88.47 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.037 -0.983 . . . . 0.94999999999999996 110.619 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 17.3 mm -56.13 -56.09 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.464 1.106 . . . . 0.73999999999999999 109.925 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -68.01 -27.56 66.67 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.201 0.815 . . . . 2.5299999999999998 113.201 -175.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.08 -42.98 99.75 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.253 1.021 . . . . 2.73 113.472 167.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.46 -26.88 16.29 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.045 -1.034 . . . . 3.0099999999999998 112.605 -169.391 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.17 -12.26 54.8 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.137 -1.602 . . . . 3.48 113.714 172.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.08 -11.79 60.0 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.942 1.09 . . . . 2.1699999999999999 113.942 164.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -128.02 -15.55 4.76 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.502 1.667 . . . . 2.5899999999999999 115.502 -166.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -143.18 125.81 15.91 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 120.448 1.476 . . . . 4.1600000000000001 110.418 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 174' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' B' ' 175' ' ' GLY . 12.2 p-10 -114.6 -108.06 0.37 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 125.358 1.463 . . . . 3.77 112.835 -167.104 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 175' ' ' GLY . . . . . 0.423 ' H ' ' CG ' ' B' ' 174' ' ' ASP . . . -77.57 15.18 7.87 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 127.126 2.298 . . . . 3.5800000000000001 114.196 173.321 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -131.57 150.24 52.22 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.412 1.885 . . . . 4.9900000000000002 110.039 170.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 35.2 mm -143.8 139.61 25.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 126.802 2.041 . . . . 2.6200000000000001 107.622 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 25.2 t -92.33 151.4 20.31 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.133 0.424 . . . . 2.3100000000000001 110.447 167.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -50.14 -41.37 48.78 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.403 0.621 . . . . 1.9299999999999999 111.169 164.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -71.65 -12.89 61.56 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.5 0.926 . . . . 4.2199999999999998 113.5 -173.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 181' ' ' GLU . . . . . 0.453 ' OE1' ' HE2' ' B' ' 138' ' ' LYS . 14.6 mt-10 -60.13 -51.63 68.77 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.655 1.116 . . . . 2.79 111.385 177.126 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -56.64 -43.58 80.42 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.134 -0.979 . . . . 2.04 111.89 174.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 24.2 t-105 -62.87 -57.38 11.02 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 118.837 -0.602 . . . . 0.63 111.875 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.7 t -65.09 -28.71 69.64 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.923 -1.037 . . . . 1.6299999999999999 112.73 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 77.2 mt -71.54 -35.57 70.7 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.854 1.206 . . . . 0.77000000000000002 112.975 173.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 7.0 mm -54.98 -39.2 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 CA-C-N 121.242 1.837 . . . . 0.80000000000000004 112.292 177.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.07 -28.83 71.19 Favored Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.067 0.841 . . . . 0.72999999999999998 113.317 176.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -67.98 -14.23 65.42 Favored Glycine 0 CA--C 1.533 1.164 0 O-C-N 121.03 -1.277 . . . . 0.81999999999999995 113.461 175.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.7 mp -109.3 -32.52 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 118.465 1.133 . . . . 1.0700000000000001 112.313 166.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 18.6 m -91.88 97.24 10.85 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.379 1.871 . . . . 1.5 110.05 -175.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -177.06 -64.77 0.06 OUTLIER Glycine 0 CA--C 1.529 0.938 0 C-N-CA 124.868 1.223 . . . . 1.05 111.968 -172.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -62.33 -47.86 8.98 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.627 2.218 . . . . 1.1699999999999999 110.762 167.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 13.5 pt -67.93 -25.15 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 112.966 0.728 . . . . 1.3999999999999999 112.966 172.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.24 -58.95 6.18 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.836 1.198 . . . . 1.05 111.939 -178.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -38.99 74.21 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 118.378 -0.82 . . . . 2.9100000000000001 112.549 173.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.1 tt -61.89 -41.97 98.52 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 118.511 -0.757 . . . . 1.5 112.019 -177.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 32.8 mt -55.59 -56.17 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 119.478 1.035 . . . . 1.27 109.639 173.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 198' ' ' HIS . . . . . 0.435 ' CE1' ' HB3' ' A' ' 20' ' ' TYR . 62.1 t60 -59.46 -36.13 75.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.275 1.03 . . . . 2.3799999999999999 112.555 -176.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -90.51 -8.94 49.04 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.249 0.833 . . . . 3.3599999999999999 113.249 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -88.16 -49.02 7.28 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.434 1.094 . . . . 3.0 113.792 169.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -58.82 -33.85 70.85 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.05 0.929 . . . . 2.6600000000000001 112.144 -170.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -72.77 -52.82 13.48 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.675 1.19 . . . . 2.3900000000000001 111.388 175.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -60.16 -0.29 0.22 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.212 2.205 . . . . 6.8300000000000001 113.837 177.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 69.7 m -145.13 31.05 1.13 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.394 -1.441 . . . . 6.4100000000000001 112.369 163.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 16.8 m -76.36 -3.67 38.15 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.809 -1.182 . . . . 9.7599999999999998 112.973 168.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 74.6 m . . . . . 0 C--O 1.249 1.043 0 C-N-CA 129.347 3.059 . . . . 11.32 109.641 -175.684 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.5 m . . . . . 0 CA--C 1.502 -0.902 0 N-CA-C 108.773 -0.825 . . . . 10.4 108.773 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -133.32 -14.93 2.55 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 118.539 -1.264 . . . . 6.9800000000000004 113.889 -134.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 87.5 m 61.97 -82.2 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.235 2.214 . . . . 3.2999999999999998 113.061 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.418 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 3.6 m-30 59.43 104.77 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.674 2.39 . . . . 2.3700000000000001 110.279 -159.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.3 p -71.82 155.52 40.33 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 119.186 0.903 . . . . 1.21 110.703 -176.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -61.29 -24.33 66.33 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 114.276 1.213 . . . . 2.7599999999999998 114.276 -171.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -48.86 79.41 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 119.7 1.137 . . . . 1.03 110.643 170.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.24 -46.84 69.39 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.381 1.472 . . . . 2.8900000000000001 112.025 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.4 mmtt -52.17 -42.09 63.14 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.973 -1.08 . . . . 6.1799999999999997 111.495 169.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.42 -39.46 77.87 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.098 -1.43 . . . . 0.67000000000000004 112.064 177.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.2 t -54.6 -40.09 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 121.503 1.956 . . . . 1.1000000000000001 110.458 167.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.1 mt -59.67 -55.67 22.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 CA-C-N 120.07 1.304 . . . . 0.89000000000000001 111.809 170.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.9 t -58.11 -39.28 72.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 125.467 1.507 . . . . 0.60999999999999999 112.976 -177.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -70.48 -41.7 72.37 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.518 1.127 . . . . 0.94999999999999996 112.098 176.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 70.6 t -71.03 -35.88 61.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 123.826 0.85 . . . . 0.59999999999999998 111.396 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -62.32 -46.29 89.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.115 0.966 . . . . 2.7000000000000002 110.848 168.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -55.11 -31.78 61.5 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.827 1.418 . . . . 2.0800000000000001 114.827 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -78.24 -62.23 1.75 Allowed 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.645 -0.659 . . . . 2.1200000000000001 111.607 171.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -64.6 -26.57 68.46 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 118.288 -0.863 . . . . 1.9199999999999999 113.094 -169.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.0 -20.05 8.28 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 120.502 1.501 . . . . 2.5 114.146 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -90.41 0.22 57.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.142 1.377 . . . . 2.5299999999999998 114.584 176.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.0 m -138.29 170.81 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 125.592 1.557 . . . . 2.3700000000000001 111.007 178.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.33 -36.72 77.22 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.397 1.258 . . . . 3.3300000000000001 114.397 -177.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt 150.37 -76.64 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 130.921 3.688 . . . . 5.8700000000000001 110.45 -166.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -124.7 -0.35 8.04 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.133 1.531 . . . . 8.3800000000000008 115.133 -171.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.6 m -61.67 -1.3 0.56 Allowed 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 116.634 2.087 . . . . 5.0800000000000001 116.634 -173.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 84.7 mt -50.77 -28.34 9.05 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 127.936 2.494 . . . . 7.6200000000000001 116.051 -156.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.06 -47.18 94.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 119.218 0.917 . . . . 5.2300000000000004 110.745 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 mtpp -87.58 -53.16 4.94 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.17 0.988 . . . . 8.5500000000000007 111.737 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -122.05 127.83 50.68 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.579 0.752 . . . . 7.4100000000000001 111.581 -164.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.49 172.86 14.83 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.908 1.683 . . . . 7.3399999999999999 111.451 -173.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.5 pt -82.21 173.78 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.979 0.912 . . . . 2.8900000000000001 111.85 166.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.2 t -77.61 149.39 34.78 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.693 0.759 . . . . 3.0600000000000001 111.533 168.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -56.1 -23.0 31.38 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 120.607 -1.308 . . . . 2.2400000000000002 111.624 164.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.8 p -80.8 -9.42 59.81 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.009 -1.682 . . . . 1.6899999999999999 115.388 170.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.8 m -83.36 -33.98 25.71 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.042 1.292 . . . . 1.25 112.24 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.451 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 23.8 t80 -45.49 -60.25 2.27 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.865 1.266 . . . . 2.0499999999999998 110.934 176.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.7 ptt180 -58.1 -24.25 57.92 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.692 1.597 . . . . 2.3300000000000001 113.229 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -94.5 -40.39 9.91 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 126.154 1.782 . . . . 3.29 111.842 -172.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 5.7 tmm? -55.06 -40.44 70.32 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 120.298 -1.501 . . . . 1.24 111.811 163.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.428 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 81.8 mt -68.87 6.06 0.98 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.94 2.496 . . . . 1.73 114.972 169.569 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -115.58 -13.5 11.52 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.207 1.803 . . . . 2.6899999999999999 113.607 165.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.55 -37.57 9.11 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.847 1.425 . . . . 1.75 114.847 178.286 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -82.9 -56.29 3.91 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 118.591 0.632 . . . . 4.5800000000000001 109.77 164.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.95 75.06 4.49 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.482 -0.762 . . . . 2.1200000000000001 109.704 171.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -121.82 -2.92 9.23 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.216 1.807 . . . . 2.1899999999999999 113.965 -174.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -118.11 -28.01 5.96 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.114 -0.991 . . . . 1.78 112.027 176.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 36.9 tpp -65.49 -12.91 57.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.608 1.963 . . . . 1.9299999999999999 112.443 163.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.3 pp -151.5 175.39 12.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.555 1.542 . . . . 3.5899999999999999 112.841 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.0 m 156.06 -37.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 130.903 3.681 . . . . 7.46 107.922 -164.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -55.27 132.33 47.59 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.197 0.999 . . . . 4.25 110.505 156.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 50.3 m -80.73 -25.81 37.81 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.221 1.408 . . . . 2.4700000000000002 111.274 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.16 -48.12 87.49 Favored Glycine 0 N--CA 1.472 1.098 0 C-N-CA 124.738 1.161 . . . . 1.6699999999999999 111.82 177.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -46.52 -55.73 7.08 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.918 1.687 . . . . 3.3500000000000001 112.173 166.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -60.59 -29.08 68.98 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.536 -0.727 . . . . 6.8099999999999996 112.669 -177.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 mmmt -59.98 -37.73 80.47 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.613 -1.304 . . . . 4.3399999999999999 113.213 174.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.82 -19.48 62.6 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.4 1.259 . . . . 1.02 114.4 172.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.2 -43.25 19.56 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.669 1.122 . . . . 0.66000000000000003 111.42 164.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -60.96 -43.08 99.23 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 113.375 0.88 . . . . 2.23 113.375 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -56.4 -27.61 56.88 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.076 0.951 . . . . 2.6899999999999999 112.715 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 24.3 mt -77.01 -35.22 57.26 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 121.809 -0.557 . . . . 0.78000000000000003 111.763 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.6 mm -55.28 -40.81 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.244 1.018 . . . . 0.93999999999999995 110.89 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -73.42 -35.14 65.78 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.462 0.912 . . . . 2.98 113.462 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -60.78 -28.05 68.45 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.782 0.833 . . . . 3.2000000000000002 111.914 170.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.4 HD23 HD21 ' A' ' 82' ' ' LEU . 0.3 OUTLIER -85.74 -32.32 21.94 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.904 2.082 . . . . 2.0099999999999998 111.832 174.14 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -67.46 -22.24 65.5 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.114 1.366 . . . . 3.8100000000000001 113.972 172.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.4 -15.5 49.33 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.408 1.262 . . . . 2.48 114.408 169.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -151.37 -31.4 0.16 Allowed 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 118.048 2.61 . . . . 3.96 118.048 -170.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -90.37 100.95 13.69 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 121.427 1.921 . . . . 3.4399999999999999 111.385 -177.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -65.76 -5.23 8.14 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 116.635 2.087 . . . . 3.9300000000000002 116.635 -173.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.34 7.71 8.16 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.629 1.109 . . . . 2.5099999999999998 115.179 -169.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 41.4 mmt-85 -75.28 -179.89 4.73 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.714 1.757 . . . . 4.6299999999999999 109.71 149.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.5 mm -136.34 137.28 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 N-CA-C 106.672 -1.603 . . . . 2.0699999999999998 106.672 166.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.3 m -96.41 146.7 24.54 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.144 0.884 . . . . 2.1099999999999999 110.175 167.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -64.39 -51.34 63.71 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.729 0.641 . . . . 2.54 112.729 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -70.55 -20.67 62.78 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.702 1.201 . . . . 4.6799999999999997 112.953 -177.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -63.78 -35.86 82.0 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 121.34 -0.85 . . . . 5.2300000000000004 110.834 173.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -53.85 -52.13 61.39 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.213 -1.555 . . . . 1.72 110.749 170.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 -65.29 -45.82 82.88 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.865 0.866 . . . . 0.70999999999999996 111.465 -175.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 99.5 m -57.83 -46.25 85.01 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 127.102 2.161 . . . . 2.3999999999999999 111.287 177.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.451 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 85.1 mt -60.94 -26.52 67.56 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 118.196 -0.907 . . . . 0.75 113.06 174.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 35.9 mm -61.37 -32.69 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 CA-C-N 121.603 2.001 . . . . 0.98999999999999999 112.445 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.59 -28.07 67.16 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.572 1.082 . . . . 0.71999999999999997 112.939 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -72.79 -19.98 79.57 Favored Glycine 0 CA--C 1.533 1.192 0 O-C-N 121.373 -1.075 . . . . 0.62 114.301 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.9 mp -97.47 -35.25 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 CA-C-N 118.451 1.125 . . . . 0.78000000000000003 110.281 166.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.4 m -82.83 56.64 3.49 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.688 1.995 . . . . 1.3700000000000001 110.666 -175.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -131.98 -71.6 0.1 OUTLIER Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.341 1.924 . . . . 1.3300000000000001 111.497 175.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -63.94 -56.04 0.55 Allowed 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.302 2.668 . . . . 1.6200000000000001 111.872 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.3 pt -65.31 -27.16 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 112.966 0.728 . . . . 1.8 112.966 173.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.32 -35.81 78.35 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.429 1.013 . . . . 1.29 113.458 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.4 ptpt -69.25 -32.41 71.6 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.379 -1.451 . . . . 3.2200000000000002 113.478 166.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.96 -37.43 85.97 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 120.457 1.48 . . . . 1.49 112.031 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -47.04 -59.95 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-N 119.785 1.175 . . . . 1.1200000000000001 109.411 162.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.418 ' NE2' ' HE3' ' B' ' 128' ' ' LYS . 30.0 t60 -64.72 -19.05 65.55 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.692 1.367 . . . . 2.3100000000000001 114.692 -175.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -74.6 -47.36 32.82 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.307 -0.871 . . . . 3.1699999999999999 112.372 162.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -69.21 -40.01 78.27 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 117.424 -1.274 . . . . 2.3100000000000001 114.065 -172.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -60.37 -17.21 42.04 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 120.023 1.283 . . . . 2.7400000000000002 112.227 173.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -92.11 -47.53 7.2 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.448 -1.407 . . . . 3.1099999999999999 110.919 172.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -67.99 1.91 2.4 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.335 1.854 . . . . 5.1600000000000001 113.097 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 52.0 m -143.72 35.64 1.28 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.829 1.652 . . . . 7.1399999999999997 111.655 161.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.5 m -71.65 -1.53 14.04 Favored 'General case' 0 N--CA 1.483 1.177 0 O-C-N 120.594 -1.316 . . . . 9.6699999999999999 113.811 168.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 58.5 m . . . . . 0 C--O 1.25 1.121 0 C-N-CA 129.595 3.158 . . . . 11.630000000000001 110.533 -176.185 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 CA--C 1.502 -0.894 0 N-CA-C 108.824 -0.806 . . . . 10.73 108.824 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -135.43 -17.91 1.74 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.656 1.222 . . . . 7.5300000000000002 113.162 -135.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 85.5 m 59.63 -75.35 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 128.003 2.521 . . . . 3.4199999999999999 114.489 172.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 56.54 106.74 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 128.175 2.59 . . . . 2.8700000000000001 111.816 -154.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.36 166.44 14.46 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 119.126 0.876 . . . . 1.0 111.124 -177.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.87 -24.04 66.67 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 118.977 0.808 . . . . 2.8999999999999999 113.155 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.37 -43.67 98.27 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.921 1.237 . . . . 0.85999999999999999 110.036 172.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -71.34 -43.83 66.26 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.742 0.817 . . . . 3.1899999999999999 112.004 175.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 44.7 mmtt -53.52 -42.27 67.22 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.798 1.181 . . . . 6.25 111.101 170.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.42 -45.41 69.25 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 124.331 1.052 . . . . 0.64000000000000001 111.977 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.33 -38.83 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 120.428 1.467 . . . . 0.79000000000000004 110.031 170.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 76.9 mt -59.29 -56.1 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-O 117.694 -1.146 . . . . 0.93000000000000005 111.378 168.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 t -58.21 -35.36 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 126.048 1.739 . . . . 0.69999999999999996 113.46 -177.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.42 -46.96 62.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.503 1.121 . . . . 0.96999999999999997 111.227 174.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 68.0 t -69.13 -34.68 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.976 0.91 . . . . 0.60999999999999999 111.316 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -67.98 -44.55 76.42 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.39 1.476 . . . . 2.6699999999999999 110.445 170.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -55.63 -34.12 64.62 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.977 1.717 . . . . 2.1000000000000001 113.952 175.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -73.31 -64.93 0.88 Allowed 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.885 -0.51 . . . . 1.99 111.405 170.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 123' ' ' TYR . . . . . 0.406 ' HB3' ' CE1' ' A' ' 95' ' ' HIS . 47.4 m-85 -64.93 -28.89 69.83 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.66 0.985 . . . . 1.8600000000000001 113.66 -169.199 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -19.97 16.56 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 120.856 1.662 . . . . 2.6499999999999999 113.834 177.24 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -89.94 -0.23 57.45 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.207 1.403 . . . . 2.1299999999999999 114.17 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 33.6 m -136.66 172.77 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 125.295 1.438 . . . . 2.4100000000000001 110.763 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.3 m -68.55 -38.19 80.59 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.292 1.219 . . . . 3.4700000000000002 114.292 -178.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.446 ' HG2' ' CD2' ' B' ' 129' ' ' TYR . 8.4 ttmt 150.58 -76.21 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 130.845 3.658 . . . . 5.96 110.526 -164.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 129' ' ' TYR . . . . . 0.446 ' CD2' ' HG2' ' B' ' 128' ' ' LYS . 25.3 m-85 -127.64 3.17 6.13 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 115.329 1.603 . . . . 8.6799999999999997 115.329 -173.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 10.9 m -61.81 0.04 0.41 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 116.551 2.056 . . . . 5.04 116.551 -175.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 80.6 mt -50.69 -28.17 8.47 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 128.321 2.648 . . . . 7.5800000000000001 116.032 -157.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 24.3 t -62.51 -47.47 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 O-C-N 121.287 -0.883 . . . . 5.0999999999999996 110.888 175.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -87.9 -49.13 7.28 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.229 1.012 . . . . 8.4499999999999993 112.341 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -126.03 129.95 50.2 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.485 0.714 . . . . 7.4800000000000004 111.515 -164.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.36 171.57 11.9 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.098 1.759 . . . . 7.2699999999999996 111.916 -172.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 23.9 pt -80.21 179.45 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.604 1.162 . . . . 2.9500000000000002 112.583 166.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 42.1 t -83.04 148.92 27.25 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.369 -0.832 . . . . 2.9100000000000001 111.233 171.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 18.0 ttpt -56.18 -20.3 17.31 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.734 -1.229 . . . . 2.4300000000000002 112.14 163.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 76.0 p -83.04 -8.32 59.56 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 115.674 1.731 . . . . 1.6699999999999999 115.674 169.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 67.4 m -76.71 -42.09 42.75 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.444 1.474 . . . . 1.1599999999999999 112.692 -176.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -50.86 -54.79 20.89 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.443 1.019 . . . . 1.9299999999999999 112.88 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -54.38 -26.26 29.21 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.292 1.037 . . . . 2.5800000000000001 113.517 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -95.75 -42.37 8.4 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.231 1.813 . . . . 3.1499999999999999 112.238 -174.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.9 tmm? -53.72 -40.06 65.78 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.852 -1.155 . . . . 1.1299999999999999 111.917 163.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.71 -21.36 54.72 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.688 1.366 . . . . 1.02 114.688 168.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -97.24 -5.37 37.0 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.418 1.487 . . . . 2.6099999999999999 112.386 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.85 -33.12 8.99 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.78 1.4 . . . . 1.55 114.78 168.034 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -89.09 -63.87 1.23 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.904 0.881 . . . . 4.0300000000000002 111.521 175.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.35 35.98 0.15 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.045 1.338 . . . . 1.98 112.514 174.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -80.26 3.75 19.88 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.655 2.382 . . . . 1.8999999999999999 114.43 -171.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 151' ' ' HIS . . . . . 0.418 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 17.3 m-70 -117.05 -26.12 6.95 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 118.826 0.739 . . . . 1.6599999999999999 111.611 173.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 42.5 tpp -68.43 -26.99 65.8 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.21 2.204 . . . . 2.1299999999999999 112.406 165.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 1.8 pp -123.98 167.25 14.4 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.849 1.66 . . . . 3.3399999999999999 111.131 167.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 21.8 m -167.8 -54.58 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.299 1.84 . . . . 6.4100000000000001 107.479 175.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -63.82 143.93 57.46 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.636 0.732 . . . . 4.2599999999999998 109.678 160.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 5.9 m -65.58 -23.72 66.91 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.602 1.161 . . . . 4.2000000000000002 111.08 172.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.36 -28.39 50.26 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.292 1.425 . . . . 2.3100000000000001 114.793 -178.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -71.25 -61.86 1.61 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 118.133 0.967 . . . . 3.0899999999999999 109.142 168.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.6 ttp-105 -48.56 -21.4 0.57 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.501 1.92 . . . . 4.6699999999999999 116.137 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -45.68 -38.35 6.73 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.635 1.107 . . . . 3.6299999999999999 113.224 164.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -70.94 -18.38 62.64 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 115.286 1.587 . . . . 1.04 115.286 174.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.46 -46.93 12.83 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 120.041 1.291 . . . . 0.73999999999999999 109.926 165.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -57.32 -41.96 80.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.544 1.538 . . . . 1.98 112.539 -177.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -58.43 -28.33 65.15 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.445 1.276 . . . . 2.8300000000000001 114.445 174.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 52.5 mt -76.98 -35.87 56.86 Favored 'General case' 0 C--O 1.222 -0.388 0 O-C-N 121.908 -0.495 . . . . 0.84999999999999998 110.773 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 14.7 mm -55.38 -40.36 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.607 0.763 . . . . 0.90000000000000002 110.64 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -71.35 -34.76 70.78 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.583 0.957 . . . . 3.1400000000000001 113.583 176.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -64.15 -31.18 72.28 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.973 0.909 . . . . 3.23 111.712 171.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.56 -36.28 57.72 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.123 2.169 . . . . 2.1000000000000001 111.56 172.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -70.3 -22.19 62.86 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.631 1.172 . . . . 3.8199999999999998 113.556 177.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -63.61 -13.36 41.41 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.573 1.323 . . . . 2.29 114.573 169.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -149.36 -34.07 0.19 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 118.169 2.655 . . . . 3.9199999999999999 118.169 -171.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -88.44 98.21 11.5 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 121.229 1.831 . . . . 3.3300000000000001 111.326 -175.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -64.83 -4.21 4.17 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 116.994 2.22 . . . . 3.8799999999999999 116.994 -172.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 120.41 5.67 10.18 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.679 -1.067 . . . . 2.4399999999999999 115.044 -167.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 37.7 mmt-85 -75.94 176.14 8.16 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.829 1.815 . . . . 4.6799999999999997 109.848 150.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 32.7 mm -135.3 136.63 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 106.832 -1.544 . . . . 2.2200000000000002 106.832 167.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 23.8 m -95.21 147.55 23.35 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.837 0.744 . . . . 2.1499999999999999 110.28 168.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -61.87 -51.63 67.41 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.513 0.673 . . . . 2.5 112.384 177.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -70.36 -16.02 62.93 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.562 1.545 . . . . 4.5700000000000003 112.777 -176.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -68.32 -38.02 81.16 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.085 -1.01 . . . . 4.8200000000000003 111.319 174.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -56.16 -45.43 79.68 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 119.963 -1.711 . . . . 1.8200000000000001 111.826 170.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.9 t-105 -68.09 -45.27 74.22 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.309 0.644 . . . . 0.71999999999999997 112.062 -177.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 87.2 m -58.25 -48.23 81.08 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.702 2.001 . . . . 2.2200000000000002 110.783 175.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 84.0 mt -61.25 -27.65 68.6 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.394 0.887 . . . . 0.56000000000000005 113.394 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 23.7 mm -62.12 -39.88 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 CA-C-N 120.851 1.659 . . . . 0.65000000000000002 111.604 176.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -59.34 -30.65 68.21 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.645 1.117 . . . . 0.58999999999999997 113.012 175.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -69.12 -20.09 74.54 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-O 118.836 -0.98 . . . . 0.57999999999999996 114.297 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.5 mp -98.27 -36.53 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 119.17 1.485 . . . . 0.79000000000000004 110.912 163.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 17.4 m -81.54 64.92 6.46 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.973 2.109 . . . . 1.3999999999999999 110.203 -173.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -137.66 -72.5 0.06 OUTLIER Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.403 1.478 . . . . 0.93000000000000005 111.649 178.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -65.43 -47.74 3.99 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.049 2.5 . . . . 1.1799999999999999 111.563 177.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 10.0 pt -66.99 -25.42 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 112.814 0.672 . . . . 1.23 112.814 174.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.76 -38.2 79.91 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.32 -0.863 . . . . 0.90000000000000002 112.692 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -65.78 -34.23 77.69 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 117.54 -1.219 . . . . 3.3900000000000001 112.922 165.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.2 tt -65.82 -39.43 90.84 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 121.206 1.821 . . . . 1.6100000000000001 111.872 177.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 96.3 mt -48.59 -59.28 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 CA-C-N 119.773 1.17 . . . . 1.0900000000000001 109.655 163.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 21.5 t60 -63.86 -22.37 66.89 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.661 1.356 . . . . 2.21 114.661 -175.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -71.06 -46.29 62.21 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.385 1.074 . . . . 3.1600000000000001 112.106 164.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 25.2 mm100 -68.6 -41.99 78.8 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 117.64 -1.171 . . . . 2.4700000000000002 113.731 -173.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.25 -18.73 28.69 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.616 1.098 . . . . 2.7000000000000002 112.553 174.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -91.38 -47.37 7.5 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.603 -1.31 . . . . 3.1000000000000001 111.064 173.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -67.67 2.66 1.75 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 126.429 1.891 . . . . 5.4400000000000004 113.355 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 48.9 m -145.4 33.63 1.07 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.248 1.819 . . . . 6.9000000000000004 111.511 163.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 3.8 m -71.32 -5.25 31.02 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 120.727 -1.233 . . . . 9.6199999999999992 113.649 167.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 55.5 m . . . . . 0 C--O 1.25 1.104 0 C-N-CA 130.293 3.437 . . . . 11.52 109.641 -176.269 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 t . . . . . 0 N--CA 1.469 0.516 0 N-CA-C 110.786 -0.079 . . . . 12.199999999999999 110.786 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -67.35 -100.12 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 128.947 2.899 . . . . 9.0999999999999996 112.503 171.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 14.8 m -64.0 -44.88 91.3 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.662 -1.274 . . . . 4.6399999999999997 112.12 -167.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -82.78 103.59 12.38 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 106.949 -1.5 . . . . 3.2400000000000002 106.949 158.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 p -57.5 169.02 0.7 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.027 1.731 . . . . 2.1299999999999999 113.799 -163.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.0 -8.94 53.23 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.743 -1.223 . . . . 3.6800000000000002 113.786 172.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.51 -39.94 10.14 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.458 1.026 . . . . 1.1899999999999999 110.641 167.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -77.51 -58.85 3.04 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 120.702 -1.249 . . . . 3.5699999999999998 110.784 -173.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.437 ' O ' HG23 ' A' ' 14' ' ' VAL . 11.9 tptp -56.67 -23.56 42.65 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.865 -0.522 . . . . 5.8600000000000003 111.624 171.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.801 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -66.04 -53.8 33.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.066 -1.021 . . . . 1.3700000000000001 112.785 168.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.03 -36.04 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 CA-C-N 119.865 1.211 . . . . 1.3200000000000001 110.727 174.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.4 mm -54.6 -50.93 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 119.463 1.029 . . . . 2.1000000000000001 110.645 167.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 10' ' ' LYS . 31.0 t -69.67 -29.49 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 124.759 1.224 . . . . 1.4099999999999999 112.188 -174.735 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.2 mp -70.59 -39.79 73.63 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.7 1.137 . . . . 1.54 111.571 170.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.8 t -63.48 -46.46 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.046 0.938 . . . . 1.3500000000000001 111.295 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -65.18 -45.72 83.73 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.362 0.983 . . . . 4.9500000000000002 111.244 172.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -57.85 -27.93 63.67 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 119.534 -1.979 . . . . 3.9199999999999999 113.815 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -74.63 -67.35 0.64 Allowed 'General case' 0 C--O 1.24 0.559 0 C-N-CA 123.266 0.626 . . . . 2.1600000000000001 111.709 165.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -61.11 -34.67 75.33 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 117.578 -1.201 . . . . 2.6200000000000001 112.334 -168.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.8 mtpt -43.54 -51.43 6.79 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 126.861 2.064 . . . . 2.27 113.044 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -81.6 -32.64 31.95 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.788 1.235 . . . . 2.6099999999999999 111.248 -176.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.455 HG12 ' H ' ' A' ' 28' ' ' LEU . 60.6 t -77.96 56.01 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 128.217 2.607 . . . . 3.7799999999999998 110.115 177.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 t 72.89 -29.07 0.2 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 130.263 3.425 . . . . 3.8100000000000001 116.122 -171.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.1 tptp 119.32 -14.87 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.944 1 C-N-CA 133.677 4.791 . . . . 7.71 113.279 -158.584 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -166.45 -17.57 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 117.155 2.28 . . . . 7.1100000000000003 117.155 -162.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.0 m -120.66 5.44 10.55 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 118.308 2.707 . . . . 4.5499999999999998 118.308 -140.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.455 ' H ' HG12 ' A' ' 23' ' ' VAL . 91.0 mt 56.37 -81.92 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.575 1.95 . . . . 7.5999999999999996 113.286 177.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.5 p -102.74 -25.24 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 128.132 2.573 . . . . 3.98 113.535 -170.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.32 -36.18 65.94 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.076 0.95 . . . . 7.71 111.235 178.473 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.3 m120 -140.93 101.1 3.98 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.652 -1.61 . . . . 6.7400000000000002 106.652 161.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.73 134.16 35.42 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 119.092 -0.48 . . . . 8.0399999999999991 110.896 178.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 36.3 pt -68.83 160.48 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 CA-C-N 119.996 1.271 . . . . 2.0899999999999999 111.337 169.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.5 m -78.19 135.98 37.72 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 121.196 -0.94 . . . . 2.4199999999999999 109.072 157.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.5 mttp -59.1 -27.91 66.02 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.069 -1.02 . . . . 2.0800000000000001 112.256 -178.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.2 p -57.37 -30.8 65.17 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.253 1.575 . . . . 1.6399999999999999 115.253 168.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.8 m -71.19 -39.07 72.04 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.641 1.11 . . . . 1.3 112.461 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -50.95 -53.91 28.83 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.038 0.935 . . . . 2.1000000000000001 111.611 176.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 23.7 ptt85 -69.61 -14.42 62.82 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.611 1.337 . . . . 2.9500000000000002 114.611 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -89.18 -46.02 9.12 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.193 0.997 . . . . 4.5199999999999996 111.009 175.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 3.3 tmm? -47.45 -47.25 27.1 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.518 1.127 . . . . 1.26 111.69 164.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.5 mt -60.12 -37.29 79.6 Favored 'General case' 0 C--O 1.212 -0.879 0 C-N-CA 123.49 0.716 . . . . 2.0600000000000001 111.655 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -69.96 -14.31 62.65 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 120.001 1.273 . . . . 3.0299999999999998 113.736 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.82 -46.48 3.48 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.391 1.476 . . . . 2.6499999999999999 114.108 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -87.28 -28.17 22.46 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 119.478 1.035 . . . . 3.5899999999999999 111.921 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.48 49.04 0.81 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.87 2.068 . . . . 1.71 110.766 162.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 42.1 p30 -69.05 -178.37 1.24 Allowed 'General case' 0 CA--C 1.548 0.904 0 O-C-N 120.561 -1.337 . . . . 4.6699999999999999 111.467 166.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 61.5 m170 80.29 -32.27 0.12 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 116.872 2.175 . . . . 2.7200000000000002 116.872 158.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.7 ptp -76.21 -19.66 58.18 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 113.383 0.883 . . . . 2.52 113.383 163.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.8 mp -69.28 107.87 3.44 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.505 0.722 . . . . 3.02 110.857 -177.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.5 m -76.58 -19.5 57.81 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.956 0.724 . . . . 4.04 112.956 167.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -162.67 160.61 25.83 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 127.73 2.412 . . . . 3.6899999999999999 107.902 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 p -51.28 -20.93 1.85 Allowed 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 126.455 1.902 . . . . 4.2300000000000004 114.004 164.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -48.88 -34.86 16.46 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-N 120.983 1.719 . . . . 2.1699999999999999 114.291 176.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 30.5 t30 -71.57 -38.71 70.91 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 118.158 0.979 . . . . 3.6099999999999999 112.304 175.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -63.73 -37.56 87.84 Favored 'General case' 0 C--N 1.346 0.446 0 O-C-N 121.003 -1.061 . . . . 4.7000000000000002 112.184 165.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -64.34 -27.48 69.05 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 119.643 -1.911 . . . . 3.23 113.327 174.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.56 -12.95 61.63 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.906 1.076 . . . . 1.0900000000000001 113.906 166.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.75 -46.47 14.2 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.162 0.892 . . . . 1.0900000000000001 111.608 160.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -51.86 -44.01 63.48 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.64 1.176 . . . . 1.8999999999999999 113.259 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -55.92 -28.45 56.88 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.715 1.005 . . . . 3.0899999999999999 113.715 175.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.7 mt -79.39 -41.43 27.76 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.346 1.059 . . . . 0.96999999999999997 111.238 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 mm -53.44 -54.22 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 124.407 1.083 . . . . 0.92000000000000004 110.175 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -58.1 -43.06 86.94 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.234 0.54 . . . . 1.8799999999999999 112.439 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -31.31 70.73 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.374 1.47 . . . . 2.8500000000000001 112.829 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.6 mt -95.05 -23.24 17.43 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 114.01 1.115 . . . . 2.8700000000000001 114.01 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -67.84 -14.67 63.15 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.506 1.503 . . . . 3.0 112.394 170.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.15 -18.73 48.95 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.064 1.505 . . . . 2.5600000000000001 115.064 163.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -130.53 -24.17 2.53 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 116.455 2.02 . . . . 3.2400000000000002 116.455 -166.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -121.88 138.94 54.2 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.288 -1.507 . . . . 4.4400000000000004 112.885 -171.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -96.37 -160.6 0.81 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 126.456 1.902 . . . . 4.5800000000000001 111.072 -175.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.84 -10.74 14.52 Favored Glycine 0 CA--C 1.527 0.793 0 O-C-N 120.011 -1.681 . . . . 2.79 113.843 152.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.7 mmt-85 -69.93 79.1 0.47 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.356 1.578 . . . . 4.8099999999999996 108.992 161.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.4 mt -83.32 135.54 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 N-CA-C 107.505 -1.294 . . . . 2.3599999999999999 107.505 172.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.7 t -104.17 166.45 10.39 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.551 0.691 . . . . 1.6599999999999999 111.79 172.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -78.11 -42.97 30.31 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.273 1.035 . . . . 2.6899999999999999 112.496 -178.164 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.5 p-10 -71.63 -24.1 61.81 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.588 1.955 . . . . 3.6499999999999999 112.644 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -52.86 -57.31 10.65 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.311 1.844 . . . . 2.8799999999999999 111.103 169.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -56.47 -46.73 80.26 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.223 -0.923 . . . . 2.27 111.814 177.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -59.76 -39.94 86.52 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.822 -0.549 . . . . 1.21 111.747 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 73.2 m -63.9 -42.02 97.55 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 126.243 1.817 . . . . 2.0299999999999998 110.769 175.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.01 -38.83 92.22 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 117.929 -1.034 . . . . 0.81999999999999995 113.289 174.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.1 mm -57.75 -34.4 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 120.716 1.598 . . . . 1.1299999999999999 110.947 173.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.02 -6.06 36.32 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.87 1.224 . . . . 1.4099999999999999 114.618 176.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -97.46 -19.85 24.18 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.034 1.417 . . . . 0.73999999999999999 114.599 171.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 5.1 mp -92.89 -35.96 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 118.776 1.288 . . . . 1.6399999999999999 110.451 170.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.8 m -74.42 145.7 43.49 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.575 -0.898 . . . . 2.2799999999999998 108.575 171.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.45 -60.15 0.49 Allowed Glycine 0 CA--C 1.535 1.292 0 CA-C-O 117.086 -1.952 . . . . 0.91000000000000003 115.428 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -65.55 -64.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.81 0 CA-C-N 121.356 2.578 . . . . 1.1599999999999999 111.095 -173.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.5 -7.98 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 112.897 0.703 . . . . 1.72 112.897 175.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.512 ' HA ' HD12 ' A' ' 94' ' ' ILE . . . -58.67 -34.04 70.8 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.846 1.203 . . . . 1.1699999999999999 113.225 -178.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -66.68 -27.59 67.78 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.335 -1.478 . . . . 3.7999999999999998 111.873 175.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.1 tt -80.21 -33.56 38.01 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.655 1.582 . . . . 1.47 111.564 174.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.512 HD12 ' HA ' ' A' ' 91' ' ' ALA . 98.0 mt -47.42 -52.49 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 CA-C-N 119.226 0.921 . . . . 0.92000000000000004 110.435 165.249 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -53.53 -42.06 67.02 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.157 1.169 . . . . 3.7000000000000002 114.157 177.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.56 -49.5 76.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.794 0.838 . . . . 6.5 110.731 173.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -60.56 -39.91 89.72 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 120.905 -1.122 . . . . 2.6600000000000001 113.35 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -66.94 -22.71 65.93 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 119.589 1.086 . . . . 3.4399999999999999 112.283 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -96.9 -47.72 5.72 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.162 -0.961 . . . . 2.1099999999999999 112.017 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -67.45 -18.8 65.22 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.601 0.76 . . . . 4.6100000000000003 112.329 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.1 t -86.7 11.31 13.3 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.699 1.2 . . . . 8.5399999999999991 113.515 164.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 46.8 t -150.73 52.13 0.87 Allowed 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.296 -1.503 . . . . 9.3800000000000008 112.798 -169.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 C--O 1.25 1.107 0 C-N-CA 126.997 2.119 . . . . 11.199999999999999 110.844 172.934 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 N--CA 1.47 0.556 0 CA-C-O 120.362 0.125 . . . . 12.050000000000001 110.856 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -65.07 -100.42 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 129.172 2.989 . . . . 8.7599999999999998 112.689 172.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 19.1 m -66.2 -51.11 60.87 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.435 -1.415 . . . . 4.3600000000000003 111.668 -168.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -74.61 98.21 3.34 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 106.426 -1.694 . . . . 3.2799999999999998 106.426 159.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 11.2 p -58.32 168.2 1.15 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 126.214 1.805 . . . . 2.1600000000000001 113.72 -162.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.51 -6.88 21.73 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.432 -1.417 . . . . 3.4399999999999999 113.742 171.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.61 -38.72 9.43 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.663 1.12 . . . . 1.0700000000000001 111.344 166.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.87 -58.39 3.29 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 120.537 -1.352 . . . . 3.5 110.407 -174.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 113' ' ' LYS . . . . . 0.461 ' O ' HG23 ' B' ' 117' ' ' VAL . 14.0 tptp -57.84 -26.06 61.51 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 122.087 -0.383 . . . . 6.7000000000000002 110.66 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.801 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -62.23 -55.97 23.25 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 121.477 -0.764 . . . . 1.27 112.887 169.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.25 -35.09 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-N 119.911 1.232 . . . . 1.3300000000000001 110.668 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 19.8 mt -57.68 -44.53 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 118.596 0.635 . . . . 1.3200000000000001 112.167 167.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.461 HG23 ' O ' ' B' ' 113' ' ' LYS . 39.8 t -72.73 -29.46 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 124.26 1.024 . . . . 1.45 111.558 -177.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.4 mp -69.68 -43.44 72.51 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.15 0.886 . . . . 1.6599999999999999 111.184 168.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 19.2 t -57.41 -46.76 85.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.566 1.146 . . . . 1.4199999999999999 111.728 171.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -62.31 -51.9 65.81 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.961 0.904 . . . . 4.6799999999999997 111.869 172.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -59.95 -25.59 65.32 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.489 -1.382 . . . . 3.9199999999999999 113.497 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -72.64 -69.54 0.4 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.688 0.795 . . . . 2.52 111.534 164.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -62.98 -32.15 73.42 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 118.328 -0.844 . . . . 2.4300000000000002 113.025 -167.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -43.86 -54.23 5.42 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.376 1.87 . . . . 2.2000000000000002 113.2 174.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 125' ' ' TYR . . . . . 0.458 ' CZ ' ' HG3' ' B' ' 144' ' ' MET . 43.1 m-85 -75.5 -30.2 59.78 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 123.531 0.732 . . . . 2.4300000000000002 110.783 -177.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.509 HG12 ' H ' ' B' ' 131' ' ' LEU . 65.2 t -79.29 49.91 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 C-N-CA 127.683 2.393 . . . . 3.3500000000000001 110.702 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 72.97 -26.41 0.19 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 129.504 3.122 . . . . 3.8100000000000001 115.791 -172.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 38.9 tptt 116.67 -17.79 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.946 1 C-N-CA 133.47 4.708 . . . . 8.4700000000000006 113.631 -157.128 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -159.54 -26.07 0.07 Allowed 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 117.693 2.479 . . . . 7.2699999999999996 117.693 -169.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 4.0 m -104.66 6.72 34.57 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 118.57 2.804 . . . . 4.6699999999999999 118.57 -140.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 131' ' ' LEU . . . . . 0.509 ' H ' HG12 ' B' ' 126' ' ' VAL . 88.0 mt 57.43 -79.31 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.987 2.115 . . . . 7.2800000000000002 113.788 173.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 11.0 p -102.71 -25.12 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 126.12 1.768 . . . . 4.0800000000000001 113.56 -174.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.15 -40.4 77.13 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.382 1.073 . . . . 7.6200000000000001 111.164 177.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 23.1 m120 -131.12 83.81 2.14 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.449 1.5 . . . . 6.79 107.652 162.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.92 133.31 49.75 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.106 -0.637 . . . . 8.0600000000000005 111.757 171.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 35.9 pt -80.09 168.12 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-O 121.708 0.766 . . . . 2.0800000000000001 112.403 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 5.5 m -99.07 127.2 44.97 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 121.825 -0.547 . . . . 2.3900000000000001 109.933 176.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 32.0 mttp -60.79 -28.63 68.9 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 120.836 -1.165 . . . . 2.0600000000000001 112.256 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 10.8 p -60.2 -33.69 72.58 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.75 1.62 . . . . 1.5900000000000001 113.801 168.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.2 m -79.95 -37.36 34.63 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 118.197 -0.906 . . . . 1.8100000000000001 111.792 174.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -49.05 -54.07 17.49 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.571 1.078 . . . . 2.02 111.878 173.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 14.0 ptt85 -66.08 -17.17 64.53 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 114.211 1.189 . . . . 3.0099999999999998 114.211 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -94.02 -48.12 6.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.205 1.402 . . . . 3.8599999999999999 110.086 -177.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 144' ' ' MET . . . . . 0.458 ' HG3' ' CZ ' ' B' ' 125' ' ' TYR . 5.6 tmm? -45.17 -45.73 11.69 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.118 2.167 . . . . 1.25 112.51 162.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 8.9 mt -54.35 -40.87 68.48 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 123.625 0.77 . . . . 2.2000000000000002 111.292 176.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -71.04 -13.66 62.06 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.634 -1.292 . . . . 2.9700000000000002 113.944 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.76 -53.78 3.31 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.902 1.281 . . . . 1.9299999999999999 113.086 175.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -86.98 -26.96 23.55 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.385 0.539 . . . . 3.6400000000000001 111.657 -174.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -107.61 46.83 0.92 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.921 2.089 . . . . 1.8 110.951 164.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 48.9 p30 -65.84 -178.38 0.57 Allowed 'General case' 0 CA--C 1.554 1.109 0 O-C-N 120.952 -1.093 . . . . 4.79 111.864 168.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 60.6 m170 79.17 -35.43 0.16 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 117.168 2.284 . . . . 2.6499999999999999 117.168 156.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 10.5 ptp -73.46 -19.37 60.96 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 118.716 0.689 . . . . 2.4199999999999999 112.77 162.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.33 99.83 0.58 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.935 0.894 . . . . 2.9500000000000002 111.04 -172.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 1.2 m -75.14 -14.7 60.58 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.259 1.024 . . . . 4.21 113.378 175.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -167.22 159.97 13.29 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 128.574 2.749 . . . . 3.8900000000000001 108.035 166.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 72.9 p -50.01 -24.19 2.47 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.035 1.734 . . . . 5.0099999999999998 113.5 165.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -51.71 -29.67 26.24 Favored Glycine 0 CA--C 1.529 0.967 0 CA-C-N 120.822 1.646 . . . . 2.3700000000000001 114.073 174.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -74.31 -36.16 63.71 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 118.3 1.05 . . . . 3.4700000000000002 112.377 174.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 17.4 ttt-85 -64.12 -39.56 94.3 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.994 0.815 . . . . 4.5999999999999996 111.884 162.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.6 mtmt -65.8 -20.95 66.44 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 119.893 -1.754 . . . . 3.54 113.652 174.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 161' ' ' ALA . . . . . 0.428 ' HA ' ' HG2' ' B' ' 164' ' ' LYS . . . -73.18 -10.39 59.72 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.239 -0.913 . . . . 1.28 113.447 168.367 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.02 -44.44 15.21 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 117.334 -1.317 . . . . 1.1100000000000001 111.471 158.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 163' ' ' ASP . . . . . 0.408 ' HA ' HG12 ' B' ' 166' ' ' ILE . 1.8 m-20 -48.52 -44.59 36.31 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 120.86 1.664 . . . . 1.9399999999999999 113.632 176.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 164' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' B' ' 161' ' ' ALA . 3.0 ptmm? -55.37 -30.29 60.06 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.105 1.15 . . . . 3.7400000000000002 114.105 174.006 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 39.5 mt -78.4 -38.25 42.04 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.481 -0.762 . . . . 1.1899999999999999 111.892 173.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 166' ' ' ILE . . . . . 0.408 HG12 ' HA ' ' B' ' 163' ' ' ASP . 9.5 mm -58.8 -53.39 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 124.004 0.815 . . . . 1.22 109.669 -174.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -60.61 -31.34 70.52 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.256 0.835 . . . . 2.1000000000000001 113.256 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -73.84 -39.9 63.69 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.927 1.691 . . . . 2.6099999999999999 112.738 176.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.02 -18.02 22.29 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 114.09 1.144 . . . . 3.0899999999999999 114.09 -173.419 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -58.88 -24.2 61.92 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.847 1.259 . . . . 3.0800000000000001 113.021 166.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.58 -24.75 45.35 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.065 1.135 . . . . 2.3399999999999999 114.065 169.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -109.34 -16.49 14.02 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.739 1.385 . . . . 2.5899999999999999 114.739 -170.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 5.7 t-80 -142.08 97.2 3.09 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 120.57 -1.331 . . . . 3.52 112.576 -163.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -65.49 167.52 8.68 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 108.857 -0.794 . . . . 4.7999999999999998 108.857 149.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -67.39 31.35 0.21 Allowed Glycine 0 CA--C 1.527 0.818 0 C-N-CA 126.113 1.816 . . . . 3.1099999999999999 116.799 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 30.8 mmt-85 -76.24 50.57 0.64 Allowed 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.476 1.638 . . . . 5.25 109.864 161.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.9 mt -62.29 136.71 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.023 1.329 . . . . 2.6499999999999999 111.144 -162.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 12.8 t -117.83 155.91 29.28 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.667 1.187 . . . . 2.5699999999999998 109.471 167.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -56.35 -34.78 66.94 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.488 1.115 . . . . 2.54 113.122 -173.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -68.52 -21.78 64.56 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.773 2.029 . . . . 3.9199999999999999 114.052 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -66.96 -58.63 4.59 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.008 1.277 . . . . 3.0899999999999999 110.944 178.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -50.03 -49.56 50.48 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.787 -0.571 . . . . 2.2599999999999998 111.706 172.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -61.17 -39.57 90.61 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.725 -0.609 . . . . 1.26 112.085 -176.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 27.5 m -64.85 -44.18 90.58 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.746 1.618 . . . . 2.0299999999999998 110.86 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 88.4 mt -64.83 -36.47 84.45 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 117.847 -1.073 . . . . 1.02 113.097 177.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 34.5 mm -56.21 -45.32 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 CA-C-N 120.898 1.681 . . . . 1.0600000000000001 111.344 172.073 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -64.82 -19.4 65.32 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 123.849 0.738 . . . . 1.1200000000000001 113.272 177.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.37 -20.82 65.94 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-O 118.257 -1.302 . . . . 1.03 113.915 173.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.3 mp -86.95 -43.09 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 CA-C-N 119.607 1.704 . . . . 1.1799999999999999 109.994 164.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 11.5 m -77.92 66.01 3.48 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.868 1.667 . . . . 1.53 111.375 -168.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -131.91 -75.39 0.12 Allowed Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.853 1.692 . . . . 1.3200000000000001 112.961 -174.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.52 -59.43 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.256 2.638 . . . . 1.47 112.753 -168.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.3 pp -69.08 -11.55 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 113.282 0.845 . . . . 1.6299999999999999 113.282 -173.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 194' ' ' ALA . . . . . 0.489 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -56.5 -35.9 68.53 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.624 1.102 . . . . 1.27 112.899 175.201 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -74.08 -10.24 59.43 Favored 'General case' 0 CA--C 1.55 0.979 0 O-C-N 120.287 -1.508 . . . . 4.2999999999999998 112.785 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.1 tt -93.88 -30.33 14.84 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.176 2.19 . . . . 1.8100000000000001 112.377 166.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 197' ' ' ILE . . . . . 0.489 HD12 ' HA ' ' B' ' 194' ' ' ALA . 91.6 mt -49.24 -48.14 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 120.661 -1.274 . . . . 1.0600000000000001 109.558 165.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -57.21 -30.31 64.46 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 115.458 1.651 . . . . 3.5699999999999998 115.458 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.67 -54.14 15.27 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.846 -0.427 . . . . 6.1799999999999997 109.846 168.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -58.8 -41.69 87.36 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.791 1.404 . . . . 2.7599999999999998 114.791 -172.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -69.66 -17.65 63.52 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 119.541 1.064 . . . . 3.25 112.471 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.8 -50.82 4.3 Favored 'General case' 0 CA--C 1.514 -0.409 0 O-C-N 121.232 -0.918 . . . . 1.98 111.735 177.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -67.08 -17.13 64.74 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.954 -1.021 . . . . 4.2199999999999998 112.757 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 26.3 t -91.71 15.29 13.04 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.549 1.14 . . . . 8.2699999999999996 113.031 165.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 41.4 t -148.17 55.5 1.04 Allowed 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.62 -1.3 . . . . 9.0899999999999999 112.106 -173.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 26.5 t . . . . . 0 C--O 1.254 1.315 0 C-N-CA 127.52 2.328 . . . . 11.1 111.029 174.892 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.1 m . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 120.997 0.427 . . . . 11.33 110.185 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -110.16 53.66 0.69 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 125.454 2.549 . . . . 7.0800000000000001 112.964 -133.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 74.0 m -83.49 77.25 9.85 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 109.608 -3.451 . . . . 3.3799999999999999 109.75 176.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -43.92 110.26 0.2 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.705 1.202 . . . . 2.0699999999999998 111.942 175.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.9 t -64.69 151.9 43.8 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.48 0.712 . . . . 3.0099999999999998 110.329 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.425 ' HG2' HG21 ' B' ' 117' ' ' VAL . 4.5 tp10 -51.09 -38.95 54.82 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.484 1.114 . . . . 2.5299999999999998 112.033 -173.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.54 -49.16 73.39 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.281 1.432 . . . . 0.81999999999999995 111.611 178.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -72.95 -46.14 54.13 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.521 -0.737 . . . . 3.1699999999999999 111.341 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.85 -37.13 18.6 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.635 0.731 . . . . 6.0899999999999999 110.951 169.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.822 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -75.96 -47.35 25.43 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.301 1.44 . . . . 0.53000000000000003 112.326 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 74.3 t -54.66 -38.5 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 120.027 1.285 . . . . 0.62 110.398 171.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 85.5 mt -60.37 -55.01 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 118.403 -0.808 . . . . 0.93000000000000005 110.364 170.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.4 t -56.09 -40.98 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.537 1.062 . . . . 0.64000000000000001 112.569 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -64.35 -36.98 85.88 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.265 -0.897 . . . . 1.0700000000000001 111.566 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.5 t -80.84 -35.98 15.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 124.363 1.065 . . . . 0.73999999999999999 111.339 -178.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.457 ' CD ' ' HZ2' ' A' ' 21' ' ' LYS . 14.6 tm-20 -54.83 -49.96 69.78 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.032 0.933 . . . . 2.8799999999999999 109.98 164.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.535 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 6.3 t30 -66.14 -9.48 31.94 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.496 1.295 . . . . 2.6400000000000001 114.496 -170.258 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -112.46 -50.42 2.9 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.729 1.211 . . . . 2.5600000000000001 113.631 -178.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -59.68 -25.87 65.1 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.368 1.44 . . . . 2.02 112.912 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.535 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 7.3 ptmt -53.64 -20.45 5.29 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.623 -1.298 . . . . 2.1099999999999999 114.437 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -80.3 -2.86 47.05 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.43 1.27 . . . . 2.5800000000000001 114.43 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.8 m -128.46 152.5 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 126.298 1.839 . . . . 2.7000000000000002 109.53 171.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 p -92.2 -45.04 8.45 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.161 1.541 . . . . 3.75 115.161 -174.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 178.0 -63.54 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.9 1.28 . . . . 5.46 113.01 -174.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -99.14 128.76 45.33 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.426 -0.806 . . . . 8.4900000000000002 110.624 -161.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 48.3 t -170.73 157.6 5.68 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.237 0.615 . . . . 5.0899999999999999 111.877 -166.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 34.8 mt -87.32 4.57 42.34 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.483 1.913 . . . . 10.109999999999999 113.237 176.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.4 p -164.81 153.76 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.631 1.972 . . . . 5.5300000000000002 110.541 -165.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.6 ' HE3' ' H ' ' A' ' 76' ' ' PHE . 46.1 mtmt -61.18 -28.48 69.17 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.186 1.18 . . . . 16.93 114.186 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -151.11 154.88 37.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.382 1.473 . . . . 11.42 112.423 168.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . 0.256 44.0 tttt -147.28 46.46 1.14 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 125.19 1.396 . . . . 8.6300000000000008 111.235 162.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.9 pt -68.99 167.26 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-N 114.722 -1.127 . . . . 2.5 109.735 172.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.7 t -71.82 129.72 39.33 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 120.549 -1.344 . . . . 2.79 109.932 166.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.6 mttp -61.53 -20.52 63.34 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.023 -1.048 . . . . 2.2999999999999998 111.815 173.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.8 m -68.72 -28.41 66.8 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.357 -0.839 . . . . 2.3599999999999999 112.99 172.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.2 m -74.98 -21.42 59.16 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 120.029 1.286 . . . . 1.25 113.71 -173.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -63.15 -57.26 11.14 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.656 -1.278 . . . . 1.8600000000000001 112.021 165.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -60.65 -30.06 69.65 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.849 -0.532 . . . . 2.9199999999999999 112.227 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.98 -58.64 5.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.31 2.244 . . . . 3.5099999999999998 110.266 171.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -52.53 -37.66 58.05 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 127.798 2.439 . . . . 1.3999999999999999 113.868 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 58.9 mt -56.68 -16.17 5.83 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 115.088 1.514 . . . . 1.1899999999999999 115.088 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . 0.253 0.1 OUTLIER -110.87 11.42 22.36 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 115.058 1.503 . . . . 2.2000000000000002 115.058 171.786 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.94 -56.28 2.22 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.54 1.136 . . . . 1.76 111.532 164.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -81.28 -46.86 14.14 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.327 -0.858 . . . . 3.1200000000000001 112.344 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.43 15.4 3.06 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.385 -1.447 . . . . 2.0899999999999999 114.295 -172.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.15 29.69 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 130.582 3.553 . . . . 2.3300000000000001 118.226 -174.087 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.428 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 21.4 m-70 -126.89 -67.1 0.87 Allowed 'General case' 0 CA--C 1.545 0.786 0 O-C-N 120.07 -1.644 . . . . 1.75 111.705 -178.054 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.3 ptp -65.3 -11.83 45.61 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.301 1.41 . . . . 2.1499999999999999 114.181 167.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.4 tp -58.44 99.54 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.12 1.768 . . . . 2.3500000000000001 110.286 -176.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.19 61.39 6.8 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.412 1.085 . . . . 4.4500000000000002 110.143 -171.569 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.1 t70 48.1 -135.74 1.04 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 127.318 2.247 . . . . 5.0 112.904 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.4 p -76.61 -37.89 55.67 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 127.082 2.153 . . . . 2.75 111.18 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.82 -40.58 93.19 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 119.166 0.893 . . . . 1.6499999999999999 111.824 175.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -68.81 -56.91 6.51 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.326 1.051 . . . . 3.1400000000000001 111.259 172.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -56.4 -39.27 72.72 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 114.459 1.281 . . . . 4.8499999999999996 114.459 -176.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 48.6 mmtt -54.15 -38.19 65.24 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.67 1.577 . . . . 3.02 113.45 174.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.14 -30.02 61.54 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.869 -1.062 . . . . 1.0700000000000001 113.423 175.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.61 -47.96 65.33 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.173 0.897 . . . . 0.81000000000000005 111.206 171.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -63.46 -32.36 73.78 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.433 1.093 . . . . 2.04 112.825 -175.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -57.27 -32.24 66.41 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 119.287 0.949 . . . . 3.3399999999999999 113.35 173.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -75.58 -43.54 47.77 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.01 0.924 . . . . 0.93999999999999995 111.637 175.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 27.0 mm -59.88 -45.21 95.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 117.847 0.294 . . . . 1.05 110.671 -170.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -59.28 -40.4 85.98 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.837 0.827 . . . . 2.3700000000000001 113.094 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -65.2 -23.83 67.2 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.794 1.238 . . . . 2.9900000000000002 112.486 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -93.21 -33.68 13.89 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 125.827 1.651 . . . . 2.3700000000000001 113.171 174.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -58.71 -28.87 66.21 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.663 -1.273 . . . . 2.7200000000000002 112.961 163.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.34 -14.43 62.92 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.115 1.524 . . . . 1.9199999999999999 115.115 167.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -136.69 3.1 2.72 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.972 1.841 . . . . 2.5499999999999998 115.972 -165.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.414 ' CD2' ' HA ' ' A' ' 74' ' ' ILE . 0.2 OUTLIER -150.54 127.89 11.37 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 119.789 -1.819 . . . . 3.3799999999999999 112.231 -171.809 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -58.71 13.13 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 130.494 3.518 . . . . 4.7699999999999996 115.134 173.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.47 -18.96 4.12 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 118.537 -2.602 . . . . 3.2400000000000002 111.745 -162.279 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -44.19 135.83 4.22 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.181 1.49 . . . . 4.5 107.232 150.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.414 ' HA ' ' CD2' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -140.23 146.77 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.983 0.897 . . . . 3.3500000000000001 109.367 171.955 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 16.1 m -56.69 167.82 0.69 Allowed 'General case' 0 CA--C 1.552 1.057 0 CA-C-O 121.995 0.902 . . . . 1.8700000000000001 111.969 162.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.6 ' H ' ' HE3' ' A' ' 30' ' ' LYS . 19.6 t80 -76.23 -33.16 59.21 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-O 124.258 1.98 . . . . 2.3100000000000001 109.874 160.221 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.31 -20.38 48.09 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 130.284 3.434 . . . . 3.6699999999999999 110.859 -162.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -68.11 -58.46 4.44 Favored 'General case' 0 C--O 1.22 -0.475 0 C-N-CA 127.242 2.217 . . . . 4.8499999999999996 111.859 176.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -48.32 -49.14 35.26 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 121.395 1.907 . . . . 1.75 111.937 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 14.7 t-105 -59.68 -47.71 84.56 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 118.802 -0.618 . . . . 1.0 110.84 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 94.6 m -58.59 -51.29 70.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.958 1.303 . . . . 2.5899999999999999 111.249 175.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.8 mt -58.6 -33.35 69.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.33 1.452 . . . . 1.1599999999999999 113.227 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 19.5 mm -50.6 -42.48 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 CA-C-N 120.441 1.473 . . . . 0.68999999999999995 111.047 173.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.94 -17.88 37.96 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.455 1.026 . . . . 0.70999999999999996 114.776 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.75 -24.21 60.69 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-N 118.472 1.136 . . . . 0.78000000000000003 113.741 174.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.6 mp -95.32 -44.32 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 119.398 1.599 . . . . 0.73999999999999999 109.704 169.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.8 m -74.29 54.07 0.54 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.167 2.187 . . . . 1.25 109.983 165.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -124.1 -77.79 0.35 Allowed Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.532 1.539 . . . . 0.81000000000000005 111.182 177.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.88 -46.84 0.68 Allowed 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 123.323 2.682 . . . . 0.93000000000000005 112.685 -174.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -76.11 -16.38 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 113.195 0.813 . . . . 1.28 113.195 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.89 -31.38 64.64 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.34 0.867 . . . . 1.22 113.34 -169.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -45.84 90.87 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.283 -0.886 . . . . 2.8599999999999999 111.777 168.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -57.81 -36.75 72.67 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 123.83 0.852 . . . . 1.6799999999999999 111.493 -173.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.1 mt -48.42 -59.7 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.72 1.208 . . . . 1.1299999999999999 110.699 171.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -64.39 -32.93 74.75 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.379 -0.825 . . . . 1.8200000000000001 112.978 -176.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.322 3.1 pt-20 -81.91 -22.66 36.68 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 112.989 0.737 . . . . 2.9100000000000001 112.989 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -68.15 -41.48 81.51 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 125.381 1.472 . . . . 3.0 113.761 167.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.08 -40.42 76.91 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.642 1.11 . . . . 2.6699999999999999 110.371 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -58.92 -49.88 76.16 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.339 0.656 . . . . 3.1400000000000001 111.28 173.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -67.97 -9.7 47.49 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.281 1.032 . . . . 5.71 113.451 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.4 m -111.76 7.83 20.39 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.048 1.739 . . . . 6.7199999999999998 111.912 177.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.0 m -82.63 10.18 7.98 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.637 1.347 . . . . 9.5199999999999996 114.637 -172.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 96.2 p . . . . . 0 C--O 1.247 0.968 0 C-N-CA 125.461 1.504 . . . . 11.859999999999999 112.96 -169.676 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 74.5 m . . . . . 0 N--CA 1.479 0.99 0 CA-C-O 121.333 0.587 . . . . 11.26 110.133 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -113.39 65.78 0.65 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 125.137 2.399 . . . . 6.96 110.908 -138.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 39.4 t -66.43 -25.91 66.97 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 109.142 -3.663 . . . . 3.7999999999999998 113.849 -178.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.428 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 15.6 m-85 52.98 82.46 0.07 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 126.543 1.937 . . . . 2.3700000000000001 113.481 -174.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.4 t -67.43 152.92 44.84 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.514 0.726 . . . . 3.27 111.73 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -64.86 -31.65 72.98 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 114.149 1.166 . . . . 2.5899999999999999 114.149 -159.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.77 -46.39 84.62 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.524 1.056 . . . . 0.87 110.184 177.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.25 -50.34 22.85 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.136 -0.935 . . . . 3.1099999999999999 110.913 -176.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -38.43 -50.17 1.5 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.479 1.036 . . . . 4.1600000000000001 113.239 164.065 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.822 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.19 -37.39 80.89 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 118.234 -0.889 . . . . 0.5 112.553 -177.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 70.4 t -61.43 -40.2 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.842 1.201 . . . . 0.62 110.477 169.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 48.0 mt -58.72 -51.12 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 119.452 1.024 . . . . 0.77000000000000002 109.894 170.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.425 HG21 ' HG2' ' A' ' 7' ' ' GLU . 19.7 t -61.95 -41.02 89.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.799 1.24 . . . . 0.56999999999999995 112.717 -176.044 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.7 mp -63.72 -43.39 96.68 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.287 -0.883 . . . . 0.96999999999999997 111.078 175.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 54.1 t -71.66 -36.16 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.861 0.865 . . . . 0.63 112.142 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 120' ' ' GLU . . . . . 0.431 ' CD ' ' HZ2' ' B' ' 124' ' ' LYS . 10.0 tm-20 -55.07 -51.06 67.55 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.496 1.118 . . . . 3.21 110.358 166.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 121' ' ' ASN . . . . . 0.54 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 5.5 t30 -64.32 -6.52 7.14 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.947 1.462 . . . . 2.4700000000000002 114.947 -174.377 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -110.24 -57.37 2.21 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.988 1.315 . . . . 2.25 112.856 -178.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -61.5 -20.86 63.67 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.426 1.012 . . . . 2.0899999999999999 113.45 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 124' ' ' LYS . . . . . 0.54 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 5.9 ptmt -53.86 -19.36 4.33 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 120.278 -1.513 . . . . 2.0 114.598 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -81.14 -1.66 45.35 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 114.406 1.261 . . . . 2.52 114.406 174.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 29.4 m -128.72 158.47 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 125.503 1.521 . . . . 2.5899999999999999 110.778 172.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 5.8 p -84.52 -41.82 16.14 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 114.959 1.466 . . . . 3.79 114.959 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.474 ' HZ2' ' HB2' ' B' ' 128' ' ' LYS . 4.6 ttmp? 141.1 -43.97 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.941 1 C-N-CA 132.121 4.168 . . . . 5.2999999999999998 112.546 -164.291 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -95.41 116.16 28.41 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.879 0.871 . . . . 8.7400000000000002 111.124 -166.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 29.3 t -174.2 160.67 3.4 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.165 0.986 . . . . 4.9699999999999998 110.961 -165.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 80.2 mt -81.51 -7.07 59.53 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.793 1.237 . . . . 10.24 113.436 171.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 132' ' ' VAL . . . . . 0.453 HG11 HH11 ' B' ' 176' ' ' ARG . 2.3 m -153.43 160.58 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 126.629 1.972 . . . . 5.1600000000000001 111.716 -174.278 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 133' ' ' LYS . . . . . 0.41 ' HE3' ' C ' ' B' ' 178' ' ' SER . 46.9 mtmt -48.66 -50.99 30.66 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.539 1.136 . . . . 16.5 111.985 171.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -144.25 136.87 26.86 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.06 0.944 . . . . 11.24 112.502 170.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -126.82 54.65 1.6 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.953 1.301 . . . . 8.8599999999999994 108.55 153.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 29.7 pt -77.19 156.13 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 108.72 -0.845 . . . . 2.54 108.72 173.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 41.7 t -61.21 122.2 14.47 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.918 -1.114 . . . . 2.6800000000000002 109.726 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 14.2 mttp -64.45 -17.35 63.74 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 120.961 -1.087 . . . . 2.6400000000000001 111.379 177.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 37.0 m -63.98 -29.54 70.69 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.331 -0.856 . . . . 2.2799999999999998 112.778 167.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 58.6 m -74.83 -20.89 59.57 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.967 1.258 . . . . 1.3 113.733 -174.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.18 -58.68 5.38 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.171 1.35 . . . . 1.97 110.744 167.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.6 ptt180 -60.49 -27.04 67.27 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.658 -0.651 . . . . 3.3799999999999999 112.475 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -66.82 -58.61 4.69 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.259 1.824 . . . . 3.6200000000000001 110.601 169.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.9 tmm? -50.98 -39.11 54.71 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 127.744 2.418 . . . . 1.25 113.514 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 75.2 mt -63.14 -0.03 0.69 Allowed 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 116.106 1.891 . . . . 1.5700000000000001 116.106 175.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . 0.263 0.1 OUTLIER -118.46 9.88 12.49 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.27 1.582 . . . . 2.1899999999999999 115.27 164.044 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.91 -64.36 1.19 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.29 1.436 . . . . 1.75 111.826 168.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -76.57 -30.2 56.95 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.778 0.717 . . . . 3.1299999999999999 111.511 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 mp -100.98 77.78 1.87 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.777 0.798 . . . . 1.8799999999999999 110.87 165.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -109.68 0.7 19.09 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.74 1.385 . . . . 2.0699999999999998 114.74 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -109.9 -39.83 4.95 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.9 1.227 . . . . 1.6299999999999999 113.671 -171.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 17.3 ptp -85.41 -15.78 41.94 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.766 -1.209 . . . . 2.3999999999999999 113.714 171.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.65 103.41 0.25 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 126.357 1.863 . . . . 2.3399999999999999 111.575 -166.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.406 ' H ' ' ND2' ' B' ' 158' ' ' ASN . 0.9 OUTLIER -85.14 59.1 5.42 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.076 0.951 . . . . 4.5300000000000002 110.841 -172.995 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 155' ' ' ASP . . . . . 0.417 ' CG ' ' H ' ' B' ' 156' ' ' THR . 35.3 t70 50.19 -139.7 0.86 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 127.042 2.137 . . . . 4.8099999999999996 112.395 -176.486 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 156' ' ' THR . . . . . 0.417 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 18.9 p -77.34 -35.58 54.58 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 126.669 1.988 . . . . 2.9900000000000002 111.485 -167.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.3 -41.65 95.11 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 119.773 1.17 . . . . 1.72 111.509 176.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 158' ' ' ASN . . . . . 0.406 ' ND2' ' H ' ' B' ' 154' ' ' SER . 35.0 t-20 -66.62 -55.82 13.53 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.955 1.302 . . . . 3.0099999999999998 111.346 173.361 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -53.36 -39.36 64.12 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.573 1.323 . . . . 5.0 114.573 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -60.34 -33.6 72.63 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.603 1.547 . . . . 3.0800000000000001 113.511 177.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -56.21 -28.16 57.31 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 118.148 -0.929 . . . . 1.05 113.095 175.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.73 -48.68 63.19 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 118.757 0.708 . . . . 0.92000000000000004 111.657 169.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -65.88 -30.87 71.54 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.174 0.99 . . . . 2.2200000000000002 113.174 -173.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 23.5 mtmt -58.16 -30.38 66.34 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.19 0.905 . . . . 3.4500000000000002 113.351 171.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 5.9 mt -80.77 -42.51 21.65 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.145 0.978 . . . . 1.02 111.742 174.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 16.1 mm -58.12 -44.73 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 CA-C-N 118.556 0.617 . . . . 1.0800000000000001 110.701 -173.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -56.49 -42.23 77.94 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.655 0.613 . . . . 2.5800000000000001 112.655 177.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -65.57 -25.8 67.58 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.504 1.121 . . . . 2.79 113.275 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.24 -37.47 9.66 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.888 1.275 . . . . 2.6499999999999999 113.131 -177.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -65.69 -22.45 66.63 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 120.904 -1.122 . . . . 3.2400000000000002 112.418 165.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.57 -23.54 62.62 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.729 1.381 . . . . 2.0099999999999998 114.729 164.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -118.31 -9.86 10.33 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.853 1.797 . . . . 2.5299999999999998 115.853 -169.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -140.83 129.44 22.76 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 120.887 1.676 . . . . 3.9900000000000002 112.721 -171.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -64.09 70.41 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 126.993 2.117 . . . . 4.6299999999999999 112.986 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 57.05 -1.75 0.11 Allowed Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.467 1.508 . . . . 3.96 114.209 -167.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 176' ' ' ARG . . . . . 0.453 HH11 HG11 ' B' ' 132' ' ' VAL . 15.3 mmt85 -69.39 144.53 53.36 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 118.675 1.237 . . . . 4.7400000000000002 109.1 -172.067 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.7 mt -126.86 138.15 55.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 104.767 -2.309 . . . . 3.9300000000000002 104.767 156.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 178' ' ' SER . . . . . 0.41 ' C ' ' HE3' ' B' ' 133' ' ' LYS . 39.3 m -74.98 -100.31 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.663 -0.648 . . . . 2.21 110.086 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -151.85 -66.72 0.17 Allowed 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.278 -1.513 . . . . 2.4199999999999999 109.339 166.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -22.2 -46.91 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 130.486 3.515 . . . . 3.2200000000000002 114.808 149.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -48.63 -61.65 1.92 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.583 1.953 . . . . 4.7999999999999998 115.291 169.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -54.85 -42.54 72.11 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 119.759 -1.838 . . . . 1.8300000000000001 111.56 -178.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 18.6 t-105 -62.09 -44.75 95.98 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.959 0.903 . . . . 0.94999999999999996 111.509 178.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 90.6 m -61.26 -44.93 96.44 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.956 1.702 . . . . 2.4500000000000002 111.302 174.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.7 mt -62.28 -32.67 73.42 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 117.32 -1.324 . . . . 1.0800000000000001 112.794 177.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 26.4 mm -52.94 -42.13 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 121.556 1.98 . . . . 0.65000000000000002 110.684 173.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.82 -9.86 35.55 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 125.153 1.358 . . . . 0.68000000000000005 115.115 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -83.67 -21.67 57.49 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-N 119.023 1.412 . . . . 0.85999999999999999 113.528 169.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.7 mp -100.12 -52.1 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 118.771 1.285 . . . . 0.80000000000000004 109.187 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 18.2 m -75.46 58.89 1.05 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.395 2.278 . . . . 1.4099999999999999 109.269 166.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -141.94 -70.54 0.03 OUTLIER Glycine 0 CA--C 1.526 0.725 0 C-N-CA 126.183 1.849 . . . . 0.93000000000000005 110.15 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.23 -51.67 3.35 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.959 2.439 . . . . 1.1299999999999999 112.051 175.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 1.8 pp -81.64 -13.74 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 113.038 0.755 . . . . 1.3100000000000001 113.038 -174.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.26 -31.64 72.12 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.221 0.822 . . . . 1.0700000000000001 113.221 -170.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.62 -46.82 77.33 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.538 -0.726 . . . . 2.9300000000000002 112.558 167.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.9 tt -60.17 -34.62 73.83 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.588 -0.72 . . . . 1.3999999999999999 111.379 -172.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 62.3 mt -51.46 -61.91 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.65 1.18 . . . . 1.0700000000000001 109.853 171.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -59.47 -36.15 75.45 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.835 0.68 . . . . 1.97 112.835 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.345 3.1 pt-20 -80.19 -22.29 42.06 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 112.746 0.647 . . . . 2.9900000000000002 112.746 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -70.61 -39.87 73.5 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 125.003 1.321 . . . . 2.8199999999999998 113.617 167.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -53.54 -40.81 65.81 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.918 1.235 . . . . 2.52 110.506 175.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -48.13 76.62 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.267 1.027 . . . . 3.2400000000000002 110.936 177.11 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -69.43 -10.93 60.16 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.725 1.009 . . . . 5.7199999999999998 113.725 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 5.8 m -105.86 7.14 32.11 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.921 1.688 . . . . 6.6399999999999997 112.221 175.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 67.9 m -84.11 6.48 22.14 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 115.167 1.543 . . . . 9.3200000000000003 115.167 -172.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 92.7 p . . . . . 0 C--O 1.248 1.02 0 C-N-CA 125.13 1.372 . . . . 11.460000000000001 113.014 -173.926 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 CA--C 1.504 -0.808 0 N-CA-C 107.104 -1.443 . . . . 10.640000000000001 107.104 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -140.33 -13.28 1.03 Allowed 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.337 1.236 . . . . 9.1899999999999995 114.337 -148.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 33.1 t 135.07 -66.5 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.501 1 C-N-CA 132.02 4.128 . . . . 4.5700000000000003 104.505 -157.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -58.88 147.18 34.8 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 124.881 1.272 . . . . 2.1800000000000002 111.148 159.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.0 p -75.13 165.75 24.73 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.185 0.594 . . . . 1.05 111.962 -175.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -58.68 -44.98 90.39 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.445 0.698 . . . . 2.7000000000000002 110.643 173.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.87 -38.61 86.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.194 1.398 . . . . 0.93999999999999995 110.134 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -73.09 -53.79 10.16 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.085 -1.01 . . . . 2.9500000000000002 110.931 -177.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.0 mmtp -54.82 -33.32 61.45 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.777 -1.202 . . . . 4.8399999999999999 112.296 168.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.795 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.95 -45.09 83.03 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 117.955 -1.022 . . . . 0.75 112.425 169.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.6 t -58.53 -38.62 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-N 120.745 1.611 . . . . 0.89000000000000001 110.458 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.7 mt -56.34 -52.95 45.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 118.042 -0.98 . . . . 1.05 111.323 165.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -61.52 -33.93 59.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 120.759 1.618 . . . . 0.72999999999999998 114.094 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.19 -36.48 79.64 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 120.424 -1.422 . . . . 1.01 111.124 172.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 43.9 t -74.35 -34.94 38.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 123.707 0.803 . . . . 0.68000000000000005 110.855 178.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.55 -53.8 54.05 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.897 1.279 . . . . 3.4500000000000002 111.122 164.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.465 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 21.0 t-20 -52.93 -28.92 25.71 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.83 1.418 . . . . 3.5499999999999998 114.83 -178.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -81.33 -61.75 1.85 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.121 0.785 . . . . 2.2400000000000002 113.121 168.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -64.0 -29.12 70.3 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.736 0.643 . . . . 1.8100000000000001 112.736 -167.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.465 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 12.5 ptmt -51.36 -27.19 9.14 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.867 1.062 . . . . 2.3399999999999999 113.867 173.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -94.95 -8.97 35.44 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 115.362 1.616 . . . . 2.6800000000000002 115.362 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.7 m -99.68 -148.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 CA-C-N 120.312 1.415 . . . . 2.5 109.606 167.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.5 m -141.69 98.34 3.32 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 119.983 -1.698 . . . . 3.6299999999999999 110.38 165.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.528 ' HE3' ' CZ ' ' A' ' 26' ' ' TYR . 49.2 tttp 66.64 -70.74 0.1 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 128.304 2.641 . . . . 5.4500000000000002 115.154 167.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.528 ' CZ ' ' HE3' ' A' ' 25' ' ' LYS . 18.0 m-85 -114.71 -63.59 1.43 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.696 1.198 . . . . 6.5999999999999996 109.095 172.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.4 m 65.5 -57.99 0.3 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 127.71 2.404 . . . . 4.6900000000000004 114.867 176.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 64.1 mt 67.71 -38.85 0.37 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 130.311 3.445 . . . . 6.4800000000000004 115.6 162.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -152.74 -33.81 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 C-N-CA 127.872 2.469 . . . . 4.2999999999999998 110.655 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -82.0 53.01 2.09 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.258 1.023 . . . . 7.8399999999999999 111.131 167.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -74.86 138.79 42.72 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.761 1.023 . . . . 8.5399999999999991 113.761 -170.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.2 tttt -90.24 -5.15 56.67 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.132 0.79 . . . . 11.380000000000001 113.132 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 15.4 tt -91.87 138.55 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 123.776 0.831 . . . . 3.1899999999999999 109.115 171.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.8 t -113.36 163.53 14.73 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.729 0.776 . . . . 2.2999999999999998 110.623 167.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -53.63 -27.66 28.44 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.385 1.074 . . . . 4.6200000000000001 113.696 168.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.9 p -72.36 -25.81 61.67 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.695 0.998 . . . . 2.3599999999999999 113.695 172.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 m -78.08 -49.1 14.59 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.805 0.842 . . . . 1.54 111.257 -175.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -48.07 -57.61 5.58 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.798 1.239 . . . . 2.2400000000000002 112.024 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 13.4 ptt85 -59.23 -15.53 15.82 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.011 1.115 . . . . 4.29 114.011 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -109.66 -26.05 10.09 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 114.513 1.301 . . . . 3.3300000000000001 114.513 -176.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 10.5 tmm? -53.06 -45.48 68.13 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 109.003 -0.74 . . . . 1.7 109.003 151.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.8 mt -64.1 -11.77 33.04 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.114 1.524 . . . . 1.25 115.114 172.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -101.23 -23.3 14.45 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.1 0.96 . . . . 2.3799999999999999 113.582 172.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -99.71 -41.28 7.36 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.257 1.206 . . . . 1.71 114.257 178.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -100.95 -20.45 15.43 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.89 1.276 . . . . 3.1099999999999999 114.356 -168.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.5 mt -118.48 41.4 2.98 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.534 1.534 . . . . 2.48 111.406 165.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -70.72 -15.94 62.74 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.648 1.351 . . . . 1.46 114.648 -172.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -94.59 -15.44 24.06 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.547 1.067 . . . . 1.8300000000000001 112.542 -170.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.2 mmm -80.64 14.62 2.02 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 126.153 1.781 . . . . 1.9299999999999999 114.703 174.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.3 mp -99.01 128.37 45.13 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.758 2.023 . . . . 3.0099999999999998 111.914 -176.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -109.49 -1.94 17.98 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.722 1.209 . . . . 4.5800000000000001 112.78 169.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -177.5 170.06 2.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 129.758 3.223 . . . . 4.3200000000000003 106.387 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -31.83 -39.08 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 125.329 1.452 . . . . 2.3700000000000001 112.573 147.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.13 -41.08 52.88 Favored Glycine 0 N--CA 1.473 1.16 0 C-N-CA 128.806 3.098 . . . . 1.6799999999999999 115.608 -171.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -59.22 -41.17 88.03 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 117.874 0.837 . . . . 3.4700000000000002 110.563 172.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 74.8 mtm-85 -73.5 -36.58 65.78 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 118.169 -0.919 . . . . 4.8499999999999996 112.79 172.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.3 mtmm -54.88 -28.94 54.11 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 121.485 1.948 . . . . 5.0599999999999996 112.516 171.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.12 -19.16 60.67 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 115.592 1.701 . . . . 1.23 115.592 170.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.87 -52.67 9.84 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.565 1.146 . . . . 0.81000000000000005 110.191 161.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -66.42 -31.33 72.02 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.984 0.914 . . . . 2.1600000000000001 112.493 -170.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.8 ptmm? -55.76 -25.0 38.63 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.302 1.223 . . . . 3.54 114.302 166.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 12.0 mt -84.92 -43.09 14.37 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.31 1.044 . . . . 0.78000000000000003 111.379 172.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.7 mm -51.83 -39.74 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.102 1.361 . . . . 0.80000000000000004 112.12 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -69.91 -30.13 67.47 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.348 1.459 . . . . 1.9099999999999999 113.899 177.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -85.66 -23.75 27.34 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.09 1.756 . . . . 3.3399999999999999 112.742 175.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.14 -26.09 68.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.868 1.267 . . . . 4.0099999999999998 112.456 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -67.11 -13.25 61.76 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.485 1.914 . . . . 2.7999999999999998 114.499 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -78.69 -6.11 54.89 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.192 0.812 . . . . 4.0599999999999996 113.192 166.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -132.07 -34.54 1.26 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.78 1.232 . . . . 3.9199999999999999 114.192 -169.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.8 m170 -110.28 67.78 0.65 Allowed 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.345 -1.472 . . . . 4.3700000000000001 114.764 -165.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -74.44 67.17 1.44 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.564 1.545 . . . . 4.3200000000000003 111.996 173.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.67 -40.0 0.94 Allowed Glycine 0 CA--C 1.532 1.147 0 C-N-CA 126.285 1.898 . . . . 2.52 113.502 -177.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -68.14 76.51 0.24 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 127.924 2.489 . . . . 8.4700000000000006 110.369 173.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.7 mm -65.58 139.01 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 O-C-N 121.425 -0.797 . . . . 2.73 109.814 171.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 t -91.92 167.27 12.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.414 1.086 . . . . 1.6599999999999999 112.864 176.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -72.72 -57.8 3.83 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.752 0.787 . . . . 2.0800000000000001 109.731 160.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.09 -35.81 62.5 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.933 2.093 . . . . 3.3700000000000001 112.946 -167.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -73.23 -22.89 60.33 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 113.722 1.008 . . . . 5.9400000000000004 113.722 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -57.01 -48.81 77.59 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 119.552 -1.968 . . . . 2.0800000000000001 110.51 166.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.7 t-105 -67.2 -41.99 84.91 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.691 -0.671 . . . . 0.84999999999999998 111.502 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.62 -41.66 92.45 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 119.342 0.973 . . . . 2.7400000000000002 112.049 171.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.66 -37.48 78.84 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.524 1.056 . . . . 0.88 112.525 176.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 40.0 mm -55.06 -42.82 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 CA-C-N 120.7 1.591 . . . . 0.84999999999999998 111.802 173.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.97 -27.63 73.62 Favored Glycine 0 CA--C 1.531 1.063 0 CA-C-N 118.54 0.609 . . . . 1.05 112.588 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.25 -20.38 71.22 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 118.164 0.982 . . . . 0.72999999999999998 113.983 177.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 mp -91.74 -50.07 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.512 1.125 . . . . 0.84999999999999998 110.107 162.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.8 m -81.96 46.36 1.0 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.441 2.297 . . . . 1.6799999999999999 112.097 -171.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.59 -70.97 0.57 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 126.084 1.802 . . . . 1.0800000000000001 110.514 175.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -61.61 -45.28 18.18 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.012 2.475 . . . . 1.0600000000000001 112.82 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.3 pt -73.12 -14.91 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 114.435 1.272 . . . . 1.0600000000000001 114.435 177.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.6 -40.57 83.61 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.094 0.861 . . . . 1.0700000000000001 113.198 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -40.17 91.3 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 117.741 -1.584 . . . . 2.7999999999999998 111.663 171.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -39.07 91.59 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 124.053 0.941 . . . . 1.47 111.353 -175.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -53.9 -58.52 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 123.982 0.913 . . . . 1.0800000000000001 110.893 166.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -63.44 -36.68 84.53 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.946 -1.096 . . . . 1.8500000000000001 113.08 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.279 2.6 pt-20 -81.29 -13.02 58.89 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.822 0.849 . . . . 3.0800000000000001 112.222 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.44 ' C ' ' H ' ' A' ' 99' ' ' GLN . 8.0 mm-40 -72.82 -35.17 67.24 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 125.082 1.353 . . . . 2.1200000000000001 113.232 165.094 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -71.54 16.62 0.1 Allowed 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 123.935 1.826 . . . . 3.5600000000000001 111.505 168.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.44 ' H ' ' C ' ' A' ' 97' ' ' GLN . 4.2 mm-40 -130.23 -72.07 0.58 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.068 1.747 . . . . 2.5600000000000001 109.184 174.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 53.95 -2.72 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.284 1 C-N-CA 131.932 4.093 . . . . 4.6200000000000001 116.43 171.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.7 t -162.06 28.37 0.12 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.411 1.484 . . . . 6.96 110.81 -165.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 31.3 t -173.89 97.13 0.1 Allowed 'General case' 0 C--O 1.236 0.375 0 C-N-CA 126.844 2.057 . . . . 7.9800000000000004 106.019 -171.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--O 1.251 1.17 0 C-N-CA 127.875 2.47 . . . . 11.6 111.913 -178.292 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 8.2 m . . . . . 0 CA--C 1.5 -0.955 0 N-CA-C 108.412 -0.959 . . . . 10.699999999999999 108.412 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -136.88 -15.71 1.53 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 118.206 -1.398 . . . . 8.3499999999999996 113.828 -125.179 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 27.6 t 158.9 -55.93 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 130.189 3.396 . . . . 4.25 106.944 -168.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -54.51 137.6 42.54 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 115.459 -0.791 . . . . 2.2200000000000002 109.923 160.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.9 p -73.17 162.88 28.9 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.138 0.427 . . . . 0.88 110.994 -175.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -60.14 -43.93 95.32 Favored 'General case' 0 C--O 1.221 -0.431 0 O-C-N 121.359 -0.838 . . . . 2.1000000000000001 111.196 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.87 -41.75 71.2 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.48 1.512 . . . . 0.89000000000000001 110.694 175.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -72.91 -54.81 7.73 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.421 1.088 . . . . 3.04 112.249 -175.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -56.27 -26.9 53.44 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.89 1.276 . . . . 4.8700000000000001 112.239 168.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.795 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -76.73 -40.34 48.91 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 120.451 -1.406 . . . . 0.96999999999999997 112.608 169.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 37.3 t -58.81 -30.42 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 120.924 1.693 . . . . 0.91000000000000003 110.624 171.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 70.7 mt -58.22 -57.4 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 119.448 1.022 . . . . 1.1899999999999999 110.763 164.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 41.2 t -55.26 -38.56 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 125.656 1.582 . . . . 0.76000000000000001 114.617 177.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.7 mp -66.37 -33.96 76.88 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.408 -1.432 . . . . 1.1699999999999999 111.858 174.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 52.5 t -78.45 -33.59 17.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.157 0.583 . . . . 0.70999999999999996 110.768 -178.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -56.41 -51.58 67.85 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.797 0.839 . . . . 3.6000000000000001 111.563 164.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 121' ' ' ASN . . . . . 0.47 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 19.2 t-20 -52.65 -29.55 26.91 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.927 1.455 . . . . 3.6000000000000001 114.927 -177.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -82.37 -60.18 2.29 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.017 0.747 . . . . 2.0800000000000001 113.017 170.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -63.11 -29.3 70.69 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 119.01 -0.519 . . . . 1.8100000000000001 112.217 -166.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 124' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 10.7 ptmt -51.31 -25.44 5.88 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.931 1.292 . . . . 2.1400000000000001 114.137 172.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -98.24 -9.41 25.62 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 115.083 1.512 . . . . 2.7999999999999998 115.083 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 16.8 m -101.46 -150.16 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 CA-C-N 119.818 1.19 . . . . 2.4500000000000002 109.158 166.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 66.3 m -143.66 99.97 3.51 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 119.855 -1.778 . . . . 3.8100000000000001 111.261 168.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.514 ' HE3' ' CZ ' ' B' ' 129' ' ' TYR . 44.1 tttp 64.55 -80.2 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 127.461 2.305 . . . . 5.1600000000000001 114.323 168.305 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 129' ' ' TYR . . . . . 0.514 ' CZ ' ' HE3' ' B' ' 128' ' ' LYS . 19.3 m-85 -110.46 -49.74 3.03 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.074 0.949 . . . . 6.5800000000000001 111.287 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 63.4 m 63.23 -61.82 0.14 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 127.513 2.325 . . . . 4.6600000000000001 115.382 170.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 62.9 mt 69.26 -48.28 0.59 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 130.603 3.561 . . . . 6.8200000000000003 114.124 168.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 7.2 p -153.97 -32.36 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 127.882 2.473 . . . . 4.4500000000000002 110.971 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -77.39 67.83 3.39 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.922 0.889 . . . . 7.8399999999999999 110.887 163.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -79.26 162.98 25.31 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.16 0.984 . . . . 8.7200000000000006 112.736 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -122.6 -2.76 8.85 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.28 1.032 . . . . 11.0 112.994 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 19.9 tt -89.7 132.71 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.105 0.962 . . . . 3.27 109.754 176.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 30.2 t -94.04 149.15 21.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.6 0.714 . . . . 2.3999999999999999 110.677 166.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 57.9 pttt -52.43 -20.56 2.92 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.772 1.229 . . . . 4.3899999999999997 113.975 164.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 92.8 p -81.56 -21.31 38.55 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.354 1.242 . . . . 2.0699999999999998 114.354 169.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 14.0 m -78.06 -45.4 23.65 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.916 -1.115 . . . . 1.22 111.408 -175.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -47.07 -58.36 4.09 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.625 1.17 . . . . 2.3399999999999999 111.516 178.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 18.1 ptt85 -58.57 -14.98 9.44 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.438 1.495 . . . . 3.8300000000000001 113.652 -178.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -107.86 -31.01 8.19 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 114.706 1.373 . . . . 2.8399999999999999 114.706 -178.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 144' ' ' MET . . . . . 0.424 ' CG ' HD21 ' B' ' 121' ' ' ASN . 7.4 tmm? -52.52 -44.42 65.72 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.651 -0.499 . . . . 1.4299999999999999 109.651 156.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.5 mt -59.9 -22.34 62.25 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.931 1.692 . . . . 1.01 114.182 173.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -94.65 -15.2 24.18 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.411 1.084 . . . . 2.4199999999999999 112.979 177.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.17 -41.54 5.11 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.91 1.078 . . . . 1.6599999999999999 113.91 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -100.24 -15.99 17.89 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.369 1.468 . . . . 3.1099999999999999 113.899 -171.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 96.9 mt -125.38 38.33 4.2 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.296 1.839 . . . . 2.4399999999999999 111.966 166.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -69.57 -17.73 63.58 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.827 1.417 . . . . 1.3 114.827 -172.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -88.93 -0.79 57.7 Favored 'General case' 0 CA--C 1.555 1.153 0 O-C-N 120.565 -1.334 . . . . 1.6399999999999999 112.375 -171.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 4.5 mmm -101.71 12.97 36.23 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.273 2.229 . . . . 1.95 113.447 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 9.2 mp -96.71 128.64 43.85 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.734 2.014 . . . . 3.02 111.412 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 33.0 t -112.23 -1.75 15.1 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.117 1.367 . . . . 4.75 112.808 169.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -178.04 170.8 1.81 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 129.751 3.22 . . . . 4.5 106.917 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 m -33.24 -40.0 0.06 Allowed 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 125.133 1.373 . . . . 2.6800000000000002 111.915 148.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.09 -42.49 39.95 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 128.394 2.902 . . . . 1.73 115.389 -171.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -58.35 -43.56 88.38 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 117.642 0.721 . . . . 3.4500000000000002 110.78 172.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 83.2 mtm-85 -69.68 -39.52 76.92 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 118.244 -0.884 . . . . 4.9400000000000004 112.467 172.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 17.2 mtmm -54.16 -29.58 46.12 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 121.35 1.886 . . . . 4.9500000000000002 112.299 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -75.29 -19.37 59.72 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 115.282 1.586 . . . . 1.1799999999999999 115.282 171.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -76.37 -54.29 6.96 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.141 1.376 . . . . 0.76000000000000001 110.395 161.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -66.43 -31.82 72.8 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.87 0.868 . . . . 2.0099999999999998 112.394 -169.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 6.0 ptmm? -56.17 -25.56 47.22 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.774 1.028 . . . . 3.48 113.774 167.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.6 mt -84.54 -41.78 16.15 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.216 1.007 . . . . 0.75 111.391 174.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 20.3 mm -54.57 -43.1 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.385 1.074 . . . . 0.81000000000000005 111.233 -177.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -65.09 -27.87 69.06 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.861 1.264 . . . . 1.74 113.68 176.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -85.21 -24.22 27.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.956 1.303 . . . . 3.4100000000000001 112.782 174.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 14.2 tp -66.88 -23.85 66.05 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.596 1.158 . . . . 3.8300000000000001 112.355 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.46 -25.08 34.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.223 2.209 . . . . 3.1400000000000001 114.326 166.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.2 -9.08 59.04 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.601 0.963 . . . . 3.7400000000000002 113.601 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -130.61 -33.05 1.66 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.259 1.207 . . . . 3.46 114.259 -166.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 22.4 m170 -114.21 74.76 0.89 Allowed 'General case' 0 CA--C 1.548 0.88 0 O-C-N 120.463 -1.398 . . . . 4.1799999999999997 114.749 -168.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -82.67 76.76 9.51 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.002 0.921 . . . . 4.0599999999999996 110.824 166.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.61 -41.5 1.2 Allowed Glycine 0 N--CA 1.478 1.46 0 C-N-CA 126.518 2.009 . . . . 2.6699999999999999 114.598 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -68.52 82.83 0.27 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 128.064 2.546 . . . . 8.6400000000000006 109.967 171.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 26.6 mm -72.41 136.62 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 O-C-N 120.877 -1.14 . . . . 2.71 109.519 171.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 8.4 t -94.06 137.67 33.0 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.457 1.103 . . . . 1.79 111.275 170.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -50.14 -54.49 20.36 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.487 1.115 . . . . 2.2200000000000002 110.28 171.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.65 -30.67 65.59 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.813 2.045 . . . . 3.4900000000000002 112.278 -170.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -74.29 -22.93 59.06 Favored 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 113.049 0.759 . . . . 5.9100000000000001 113.049 -177.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -58.63 -47.32 84.8 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 119.503 -1.998 . . . . 2.1000000000000001 110.471 165.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 19.0 t-105 -68.59 -37.61 79.97 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.144 -0.931 . . . . 0.84999999999999998 111.724 -173.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 82.3 p -63.09 -47.09 84.35 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 119.649 1.113 . . . . 2.6000000000000001 110.689 171.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.29 -37.71 81.36 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.087 -0.959 . . . . 0.88 112.85 -178.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 39.6 mm -54.62 -41.89 57.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 CA-C-N 120.589 1.54 . . . . 0.82999999999999996 111.467 173.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.55 -26.31 73.69 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 123.684 0.659 . . . . 1.01 112.789 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -67.52 -19.99 71.38 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-N 118.097 0.949 . . . . 0.68999999999999995 113.326 177.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.8 mp -96.71 -46.47 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 CA-C-N 118.284 1.042 . . . . 0.84999999999999998 110.132 165.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 2.9 m -81.15 39.43 0.51 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.042 2.137 . . . . 1.7 112.351 -175.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -108.97 -70.62 0.68 Allowed Glycine 0 CA--C 1.529 0.96 0 C-N-CA 126.149 1.833 . . . . 0.98999999999999999 110.174 173.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -61.02 -43.39 30.36 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.057 2.505 . . . . 0.93999999999999995 113.029 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 11.1 pt -75.15 -17.56 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 114.454 1.279 . . . . 1.04 114.454 177.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -58.36 -42.51 87.12 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.548 1.067 . . . . 1.01 113.588 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.29 -41.62 89.41 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.979 1.263 . . . . 2.98 111.993 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -40.22 90.78 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 123.997 0.919 . . . . 1.72 111.714 -176.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 88.0 mt -52.85 -63.09 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.591 0.756 . . . . 1.02 110.041 168.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -59.09 -37.19 76.54 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.292 -0.88 . . . . 1.78 112.906 -175.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.295 2.5 pt-20 -78.02 -18.29 56.05 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 112.385 0.513 . . . . 3.21 112.385 178.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -75.99 -35.02 59.75 Favored 'General case' 0 C--N 1.344 0.334 0 C-N-CA 125.392 1.477 . . . . 2.1000000000000001 114.611 169.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -65.19 -1.13 2.03 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 122.801 1.286 . . . . 2.98 111.736 171.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -112.89 -70.16 0.82 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.001 1.721 . . . . 2.8300000000000001 109.597 177.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 50.18 1.63 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 131.695 3.998 . . . . 4.3300000000000001 116.413 177.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 44.5 t -150.47 31.08 0.66 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.297 1.839 . . . . 7.0499999999999998 110.247 -169.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 27.1 t -174.83 103.41 0.09 Allowed 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 126.68 1.992 . . . . 8.1300000000000008 105.758 -174.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 17.7 t . . . . . 0 C--O 1.249 1.068 0 C-N-CA 128.395 2.678 . . . . 11.789999999999999 111.082 172.565 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.3 m . . . . . 0 CA--C 1.502 -0.883 0 N-CA-C 108.841 -0.8 . . . . 10.19 108.841 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -130.19 -12.33 4.08 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 118.722 -1.191 . . . . 6.7800000000000002 113.669 -130.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.7 t 73.09 -18.25 0.37 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 127.825 2.45 . . . . 5.1900000000000004 115.858 166.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.481 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 50.8 m-85 -32.85 100.46 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 126.686 1.994 . . . . 2.0899999999999999 115.948 -172.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.6 p -65.5 158.27 27.37 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.164 0.585 . . . . 0.97999999999999998 109.975 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -60.5 -31.05 70.12 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 117.885 -1.055 . . . . 3.73 110.908 172.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.22 -41.3 85.94 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.057 1.299 . . . . 0.82999999999999996 111.278 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -55.99 9.87 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.886 0.874 . . . . 2.9199999999999999 110.722 178.011 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -45.05 -43.82 9.68 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.762 1.625 . . . . 4.7000000000000002 113.593 166.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.875 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.08 -45.86 83.54 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.553 1.141 . . . . 0.51000000000000001 113.088 173.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.99 -41.06 87.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 120.248 1.385 . . . . 0.66000000000000003 110.608 173.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.6 mt -53.28 -49.7 51.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-N 119.187 0.903 . . . . 0.80000000000000004 111.331 166.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.4 t -65.6 -35.86 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 119.707 1.139 . . . . 0.54000000000000004 112.783 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp -65.45 -41.78 93.09 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.862 -1.149 . . . . 0.96999999999999997 111.338 172.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.0 t -67.4 -43.34 87.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 125.455 1.502 . . . . 0.58999999999999997 111.917 176.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -53.69 -51.96 61.58 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 119.119 0.872 . . . . 3.23 109.835 168.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.503 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 54.4 t30 -64.13 -23.11 67.2 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.035 1.124 . . . . 2.0699999999999998 114.035 -169.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -76.24 -61.1 2.06 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.7 0.8 . . . . 2.3300000000000001 112.335 168.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -67.49 -21.84 65.49 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.984 1.105 . . . . 1.79 113.984 -170.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.503 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 1.6 ptmt -53.69 -21.94 8.01 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.342 1.428 . . . . 2.1499999999999999 112.975 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -89.98 8.14 33.93 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.453 1.901 . . . . 2.48 115.023 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.0 m -141.66 171.56 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.136 1.374 . . . . 2.3999999999999999 110.885 173.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.05 -8.53 58.65 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-O 115.547 -2.168 . . . . 3.8999999999999999 116.24 -177.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' B' ' 199' ' ' GLU . 2.3 ttpm? 123.09 -67.0 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 130.23 3.412 . . . . 5.3399999999999999 113.778 177.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -94.97 8.88 41.44 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.326 1.45 . . . . 8.5299999999999994 113.569 -176.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.2 p -115.4 37.95 3.39 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.054 -1.654 . . . . 4.5 115.099 -152.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.5 mt -25.36 -42.49 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 129.189 2.996 . . . . 6.6600000000000001 117.412 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.1 t -150.07 60.19 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 126.703 2.001 . . . . 4.7599999999999998 109.658 175.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -124.88 -0.49 7.93 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.272 1.429 . . . . 7.8899999999999997 114.634 175.058 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 141.96 132.71 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 1 C-N-CA 132.267 4.227 . . . . 8.3399999999999999 108.89 169.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.0 pttm -174.95 -172.54 0.62 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.312 1.445 . . . . 6.3300000000000001 111.176 -158.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 16.3 pt -86.7 -178.37 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.968 1.707 . . . . 3.3999999999999999 113.87 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.2 m -125.72 156.82 38.77 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.711 2.004 . . . . 2.5699999999999998 109.523 171.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -58.07 -21.8 47.43 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 115.343 1.609 . . . . 2.02 115.343 -164.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.4 m -47.85 -42.25 26.05 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 121.269 -0.894 . . . . 2.04 113.304 165.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 m -74.36 -11.6 60.3 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.534 1.309 . . . . 1.8899999999999999 114.534 -172.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -69.82 -56.71 6.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 121.045 1.748 . . . . 2.1400000000000001 111.444 165.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -61.78 -26.04 67.84 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.466 0.543 . . . . 2.2999999999999998 112.466 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -71.52 -50.59 29.86 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.671 1.189 . . . . 3.8799999999999999 110.625 170.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -59.96 -43.04 95.3 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.886 1.674 . . . . 1.3300000000000001 112.733 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 31.8 mt -50.69 -36.86 38.06 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.907 1.283 . . . . 1.48 112.434 168.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -83.88 -20.21 33.47 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 118.108 -0.949 . . . . 2.5600000000000001 112.771 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.52 -45.57 19.04 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.68 1.582 . . . . 2.8199999999999998 112.117 166.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -90.22 -41.07 11.8 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.926 1.084 . . . . 3.4700000000000002 113.926 -167.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.4 mt -107.0 28.68 7.78 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.216 1.007 . . . . 2.4399999999999999 112.803 -170.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -67.63 23.83 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 117.059 2.244 . . . . 1.99 117.059 -171.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.466 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 0.2 OUTLIER -127.65 -42.88 1.59 Allowed 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.267 -1.521 . . . . 2.0299999999999998 111.731 -178.372 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.9 ptp -77.54 -19.97 54.91 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.667 1.187 . . . . 2.77 113.555 164.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.1 tt -99.92 104.9 16.57 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.254 1.422 . . . . 2.9500000000000002 111.046 -175.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.3 t -71.63 109.28 5.45 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.581 -0.699 . . . . 5.2199999999999998 111.3 168.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 49.79 -88.39 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.68 1.992 . . . . 7.2599999999999998 114.062 136.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.3 p -130.89 -19.91 2.87 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.439 1.495 . . . . 3.4700000000000002 112.33 167.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.64 -41.44 99.59 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 119.976 1.262 . . . . 2.7000000000000002 112.081 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -82.88 -48.98 10.14 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 117.552 0.676 . . . . 3.5499999999999998 112.345 165.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -55.13 -37.13 66.52 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.901 1.445 . . . . 4.9699999999999998 114.901 -172.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -63.84 -31.58 72.81 Favored 'General case' 0 N--CA 1.479 1.024 0 O-C-N 120.883 -1.136 . . . . 3.3599999999999999 114.015 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.77 -40.19 96.08 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 122.96 0.504 . . . . 2.1000000000000001 111.653 168.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.86 98.68 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.131 0.572 . . . . 1.27 112.291 172.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -54.67 -29.66 53.27 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.256 1.022 . . . . 2.5800000000000001 112.626 174.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -24.72 59.92 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.177 -1.577 . . . . 6.0499999999999998 114.004 175.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 15.4 mt -65.82 -43.0 89.88 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 120.523 -0.471 . . . . 1.0900000000000001 110.973 163.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.5 mm -59.61 -48.32 87.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 123.205 0.602 . . . . 0.93999999999999995 110.739 -177.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -59.32 -38.13 79.53 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.092 0.473 . . . . 1.8 112.258 178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 -65.92 -30.46 71.05 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.782 0.833 . . . . 3.4900000000000002 113.071 175.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.16 -30.69 22.28 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.351 1.46 . . . . 1.95 111.827 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -64.87 -32.38 74.06 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.441 1.496 . . . . 3.1499999999999999 113.147 166.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.0 -23.31 66.55 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.122 1.156 . . . . 2.2000000000000002 114.122 170.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -122.71 -7.84 8.5 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.839 1.792 . . . . 2.4500000000000002 115.839 -167.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.35 117.97 13.05 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.302 1.865 . . . . 3.4399999999999999 112.757 -177.082 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -78.6 63.63 3.44 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.908 2.483 . . . . 4.04 111.926 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.78 7.87 62.6 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.344 0.974 . . . . 2.9900000000000002 114.228 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.8 mmt85 -70.12 175.16 4.72 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.268 1.427 . . . . 5.6299999999999999 111.957 176.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 25.0 mm -140.02 150.18 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 126.191 1.797 . . . . 2.3500000000000001 106.853 161.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.7 t -127.0 165.16 19.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.536 1.534 . . . . 1.52 111.902 169.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -67.62 -51.78 46.14 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 122.54 1.162 . . . . 2.02 111.93 175.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -25.02 67.39 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.422 2.289 . . . . 3.3999999999999999 113.914 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.6 -59.26 5.45 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.049 1.339 . . . . 3.46 111.888 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -58.06 -42.31 85.21 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.063 -1.023 . . . . 2.3300000000000001 111.466 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 20.9 t-105 -62.33 -48.27 80.55 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.922 -0.561 . . . . 0.62 111.767 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.1 t -69.82 -32.75 71.35 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 117.637 -1.173 . . . . 1.72 111.718 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.9 mt -66.93 -40.94 87.76 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 117.798 -1.096 . . . . 0.67000000000000004 112.553 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 12.1 mm -50.26 -44.58 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-N 120.174 1.352 . . . . 0.75 111.688 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.05 -19.13 50.3 Favored Glycine 0 CA--C 1.539 1.545 0 CA-C-O 119.459 -0.634 . . . . 0.63 114.579 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.45 -23.29 60.84 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 118.72 1.26 . . . . 0.59999999999999998 114.013 177.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -94.98 -44.97 13.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-N 119.446 1.623 . . . . 1.04 109.647 165.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.3 m -83.44 35.43 0.5 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.055 2.542 . . . . 1.48 112.035 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -93.59 -78.9 1.42 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 125.009 1.29 . . . . 1.0 110.761 172.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.2 -41.27 16.86 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.885 2.39 . . . . 1.1599999999999999 112.263 -176.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -70.17 -12.95 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 113.761 1.023 . . . . 1.2 113.761 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.78 -43.66 92.54 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.343 0.974 . . . . 0.93000000000000005 111.816 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -61.45 -34.23 75.07 Favored 'General case' 0 C--O 1.221 -0.397 0 O-C-N 120.442 -1.411 . . . . 2.6899999999999999 112.291 171.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 tt -66.88 -41.08 87.85 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.924 0.89 . . . . 1.24 111.271 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.2 mt -51.37 -62.58 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-O 121.642 0.734 . . . . 0.93000000000000005 109.541 162.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -60.41 -27.77 67.73 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.113 1.153 . . . . 1.9199999999999999 114.113 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.494 ' HA ' ' HE3' ' B' ' 128' ' ' LYS 0.305 3.9 pt-20 -89.45 -9.33 50.57 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.715 1.206 . . . . 3.1600000000000001 112.769 178.664 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.439 ' C ' ' H ' ' A' ' 99' ' ' GLN . 5.5 tp-100 -89.48 -30.51 18.23 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.882 1.673 . . . . 3.5099999999999998 111.826 169.365 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -63.99 6.27 0.18 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 126.849 2.059 . . . . 3.2999999999999998 113.314 165.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLN . . . . . 0.439 ' H ' ' C ' ' A' ' 97' ' ' GLN . 10.2 mm-40 -133.09 -77.32 0.49 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 126.153 1.781 . . . . 2.23 110.273 -173.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 58.2 -11.56 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.986 1 C-N-CA 131.934 4.094 . . . . 4.3300000000000001 116.253 167.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 27.7 t -111.36 5.01 19.45 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.469 1.108 . . . . 7.5300000000000002 113.656 -162.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 30.3 t -172.69 -15.73 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.793 1.637 . . . . 9.5399999999999991 114.0 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.47 ' OXT' ' HE2' ' B' ' 128' ' ' LYS . 4.7 t . . . . . 0 C--O 1.254 1.333 0 C-N-CA 129.236 3.015 . . . . 11.039999999999999 109.19 173.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 26.6 m . . . . . 0 CA--C 1.505 -0.757 0 N-CA-C 109.174 -0.676 . . . . 10.18 109.174 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -128.56 -12.28 4.94 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 118.54 -1.264 . . . . 6.6399999999999997 113.546 -131.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 7.1 t 71.45 -17.36 0.33 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.963 2.505 . . . . 4.9199999999999999 115.806 166.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.466 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 46.5 m-85 -32.21 96.54 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.416 1.886 . . . . 2.29 115.554 -171.112 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 36.0 p -64.27 157.79 25.03 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.069 0.947 . . . . 1.0600000000000001 109.871 178.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -59.59 -33.98 72.15 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-O 117.108 -1.425 . . . . 3.7200000000000002 110.952 173.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.27 -43.29 95.29 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 120.641 1.564 . . . . 0.82999999999999996 111.323 176.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -57.52 5.68 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.822 0.849 . . . . 2.9500000000000002 110.598 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -42.79 -44.25 4.34 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.37 1.868 . . . . 4.75 114.278 164.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.875 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -65.27 -44.75 87.03 Favored 'General case' 0 C--O 1.223 -0.337 0 O-C-N 120.821 -1.175 . . . . 0.52000000000000002 112.586 174.217 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.3 -42.66 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.936 1.244 . . . . 0.66000000000000003 110.506 172.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 71.0 mt -53.03 -48.03 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.344 1.058 . . . . 0.75 110.57 168.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.3 t -66.58 -35.09 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.396 1.078 . . . . 0.62 112.82 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -67.87 -40.0 83.66 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.567 -1.333 . . . . 1.0 111.222 173.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 29.7 t -67.91 -38.48 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 126.036 1.734 . . . . 0.60999999999999999 111.993 175.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.93 -53.05 62.57 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.153 0.981 . . . . 3.5699999999999998 110.294 167.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 121' ' ' ASN . . . . . 0.42 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 27.0 t30 -66.57 -7.34 19.52 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.214 1.561 . . . . 2.1099999999999999 115.214 -177.382 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -87.56 -65.43 1.02 Allowed 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.367 -0.833 . . . . 2.48 111.972 160.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -69.69 -22.31 63.43 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.921 1.452 . . . . 1.79 114.921 -166.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 124' ' ' LYS . . . . . 0.42 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 10.4 ptmt -53.78 -22.34 9.25 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 121.265 1.848 . . . . 2.1400000000000001 113.436 177.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -84.39 7.82 18.3 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.641 1.976 . . . . 2.5499999999999998 114.907 176.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 30.9 m -139.59 170.38 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.989 1.715 . . . . 2.5 110.161 170.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.77 -23.17 59.67 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 116.703 -1.617 . . . . 3.9199999999999999 114.89 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 96' ' ' GLU . 0.4 OUTLIER 148.38 -57.93 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.24 1 C-N-CA 132.059 4.144 . . . . 5.2599999999999998 112.515 -179.645 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -110.07 8.55 24.02 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.496 1.918 . . . . 8.5299999999999994 113.224 -172.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 4.8 m -82.96 30.97 0.43 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.607 1.706 . . . . 4.8099999999999996 115.607 -156.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 62.5 mt -35.97 -52.19 0.74 Allowed 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 128.064 2.546 . . . . 6.5599999999999996 115.792 -162.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 3.9 t -139.2 59.36 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-O 123.806 1.765 . . . . 4.75 109.175 165.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -134.11 -2.55 2.85 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.448 1.899 . . . . 7.71 114.727 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 143.02 123.81 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.844 1 C-N-CA 132.114 4.166 . . . . 8.2100000000000009 108.857 173.276 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -169.03 175.25 5.88 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.79 1.636 . . . . 6.3200000000000003 109.847 -164.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 18.9 pt -76.23 -178.39 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 N-CA-C 114.821 1.415 . . . . 3.1699999999999999 114.821 173.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 71.1 m -118.33 155.08 31.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.818 1.247 . . . . 2.6400000000000001 109.867 165.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -50.92 -36.01 36.25 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.17 1.388 . . . . 1.95 114.144 -171.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 4.9 m -52.34 -17.41 1.16 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.811 2.044 . . . . 1.8500000000000001 115.43 174.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 1.4 m -75.43 -37.33 60.48 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.502 1.121 . . . . 1.26 112.545 175.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -58.39 -49.74 76.16 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.277 1.031 . . . . 1.99 111.948 -175.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -55.82 -29.2 59.39 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.455 1.102 . . . . 2.23 113.77 175.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -86.69 -44.73 11.6 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.645 1.178 . . . . 3.8799999999999999 111.365 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 2.7 tmm? -52.67 -45.77 66.92 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.182 0.593 . . . . 1.1399999999999999 111.641 167.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 21.3 mt -55.51 -52.51 63.45 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.624 1.57 . . . . 1.5 112.869 170.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -61.09 -18.48 58.15 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.7 1.2 . . . . 2.2200000000000002 113.406 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.29 -44.14 5.25 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.848 1.055 . . . . 2.23 113.848 177.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -79.42 -38.14 35.45 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.715 1.206 . . . . 3.5899999999999999 113.626 -178.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.7 mt -111.81 28.08 9.08 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.421 0.897 . . . . 2.5099999999999998 113.421 -169.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -71.09 9.71 0.68 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 116.689 2.107 . . . . 1.51 116.689 -165.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 151' ' ' HIS . . . . . 0.481 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 0.5 OUTLIER -108.01 -32.13 7.68 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 120.041 -1.662 . . . . 2.0499999999999998 111.851 -173.933 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 21.1 ptp -83.01 -27.71 30.17 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.045 1.738 . . . . 2.79 112.473 159.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 5.5 tt -94.79 97.49 10.08 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.089 1.356 . . . . 3.2000000000000002 110.749 -176.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 30.3 t -74.64 104.36 5.29 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.99 0.9 . . . . 5.2000000000000002 110.416 167.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 54.75 -100.01 0.1 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.802 1.241 . . . . 7.8899999999999997 112.809 138.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 41.5 p -130.75 14.29 5.36 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.86 1.664 . . . . 4.1299999999999999 113.766 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -86.4 -64.7 1.44 Allowed Glycine 0 N--CA 1.466 0.663 0 N-CA-C 109.876 -1.29 . . . . 2.9100000000000001 109.876 160.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -67.2 -46.34 74.19 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 118.409 -0.805 . . . . 3.77 111.753 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -59.4 -22.91 62.11 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 120.691 1.587 . . . . 4.7199999999999998 114.95 -176.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp -52.28 -38.1 57.37 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.888 1.222 . . . . 4.3300000000000001 113.118 168.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -63.88 -48.03 78.27 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.824 0.45 . . . . 1.8700000000000001 110.91 172.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -56.62 -49.37 75.16 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.523 0.601 . . . . 1.03 111.693 176.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -66.31 -33.0 74.76 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.726 0.811 . . . . 2.3900000000000001 112.351 -175.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -47.25 82.04 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.004 -1.06 . . . . 6.7000000000000002 112.894 167.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.67 -47.8 76.12 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.044 0.84 . . . . 1.3200000000000001 111.019 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 38.9 mm -50.48 -51.64 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 123.404 0.682 . . . . 0.96999999999999997 110.493 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -73.73 -31.03 63.16 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.322 0.582 . . . . 3.02 112.265 -173.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 38.2 m-20 -62.42 -27.47 69.12 Favored 'General case' 0 CA--C 1.555 1.165 0 N-CA-C 112.548 0.573 . . . . 4.1799999999999997 112.548 169.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.47 -28.76 20.63 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.999 1.72 . . . . 2.1699999999999999 111.54 177.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -63.75 -28.97 70.24 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.741 -1.224 . . . . 2.98 113.309 164.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.27 -14.07 62.72 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 114.345 1.239 . . . . 2.29 114.345 166.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -125.71 -13.3 6.47 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 116.628 2.084 . . . . 2.4100000000000001 116.628 -170.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -139.88 122.35 16.15 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 122.057 2.208 . . . . 3.5800000000000001 113.233 -174.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -79.07 66.06 4.41 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 127.514 2.325 . . . . 4.0999999999999996 112.137 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.1 5.57 66.17 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.731 1.157 . . . . 3.2000000000000002 114.75 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt85 -68.43 178.21 2.08 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.154 1.782 . . . . 5.6900000000000004 112.415 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 21.5 mm -137.6 151.83 26.49 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 126.84 2.056 . . . . 2.6099999999999999 105.461 158.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 9.8 t -132.46 164.05 27.41 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.22 1.408 . . . . 1.5600000000000001 113.277 170.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -63.91 -55.46 22.52 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 122.881 1.324 . . . . 2.29 111.359 175.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -27.27 68.13 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.606 2.363 . . . . 3.5299999999999998 113.71 178.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -57.04 -60.39 3.65 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.995 1.318 . . . . 3.3900000000000001 111.153 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -55.42 -46.45 76.67 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.234 -0.916 . . . . 2.21 111.477 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 23.4 t-105 -62.64 -47.29 84.37 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.967 -0.54 . . . . 0.63 111.55 -177.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.5 t -70.7 -32.18 69.32 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 117.658 -1.163 . . . . 1.6399999999999999 111.664 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 46.1 mt -67.33 -40.51 85.9 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-O 117.24 -1.362 . . . . 0.62 112.105 175.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 13.1 mm -49.03 -46.13 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 CA-C-N 120.691 1.587 . . . . 0.66000000000000003 111.901 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -60.98 -19.6 56.77 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 123.997 0.808 . . . . 0.68999999999999995 114.381 178.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -78.12 -18.37 76.68 Favored Glycine 0 CA--C 1.531 1.077 0 CA-C-N 118.687 1.244 . . . . 0.77000000000000002 113.54 174.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -101.61 -48.17 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-N 119.482 1.641 . . . . 0.97999999999999998 109.976 166.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 25.7 m -80.45 68.58 6.68 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 127.038 2.135 . . . . 1.3899999999999999 109.45 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -129.67 -83.49 0.33 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.731 1.634 . . . . 0.91000000000000003 110.961 177.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -61.89 -39.29 52.54 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 122.479 2.119 . . . . 1.24 111.656 178.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.95 -11.31 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 113.461 0.911 . . . . 1.27 113.461 177.25 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.12 -42.87 83.78 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.534 1.061 . . . . 0.87 111.293 177.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -61.42 -35.42 77.5 Favored 'General case' 0 C--O 1.22 -0.475 0 O-C-N 120.508 -1.37 . . . . 2.9500000000000002 112.262 169.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.85 -43.7 95.34 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.149 0.98 . . . . 1.5 111.165 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 78.7 mt -50.17 -62.11 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-O 121.43 0.633 . . . . 0.94999999999999996 109.824 163.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -58.67 -31.06 67.84 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.865 1.061 . . . . 2.0899999999999999 113.865 -173.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 199' ' ' GLU . . . . . 0.434 ' HA ' ' HE3' ' A' ' 25' ' ' LYS 0.258 3.8 pt-20 -88.7 -12.28 42.79 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.691 1.196 . . . . 3.23 112.76 -179.416 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -84.28 -34.19 23.83 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.308 1.443 . . . . 3.77 111.252 169.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -63.19 2.93 0.31 Allowed 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 126.421 1.889 . . . . 3.25 113.222 166.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -128.21 -72.48 0.62 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.92 1.688 . . . . 2.5 111.21 -176.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 56.6 -8.68 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.867 1 C-N-CA 132.14 4.176 . . . . 4.1799999999999997 116.513 170.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 31.1 t -126.03 1.6 7.26 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.183 1.179 . . . . 7.8399999999999999 114.183 -162.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 38.8 t -152.58 10.88 0.5 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.919 1.288 . . . . 9.6400000000000006 112.538 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 206' ' ' SER . . . . . 0.404 ' OXT' ' HE2' ' A' ' 25' ' ' LYS . 14.0 t . . . . . 0 C--O 1.252 1.232 0 C-N-CA 130.994 3.718 . . . . 11.24 109.64 -159.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.8 m . . . . . 0 N--CA 1.472 0.655 0 CA-C-O 118.819 -0.61 . . . . 9.3900000000000006 110.228 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -63.38 -134.69 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.366 0 O-C-N 124.431 1.082 . . . . 5.7999999999999998 109.408 135.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 60.6 m -73.53 -33.96 64.99 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.245 -1.534 . . . . 3.8599999999999999 112.021 178.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -55.23 113.75 1.51 Allowed 'General case' 0 C--O 1.241 0.607 0 C-N-CA 123.747 0.819 . . . . 2.6699999999999999 112.861 -172.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.31 153.59 40.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.771 -0.826 . . . . 1.0700000000000001 108.771 -176.252 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -59.81 -43.31 94.56 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-O 119.125 -0.464 . . . . 2.0899999999999999 110.891 178.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.91 -44.44 94.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.086 1.754 . . . . 1.8100000000000001 111.639 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -71.15 -53.8 13.27 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 125.837 1.655 . . . . 3.1099999999999999 110.819 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -58.55 -27.5 64.63 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.107 -0.996 . . . . 5.3899999999999997 111.828 167.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.813 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -71.6 -37.39 70.97 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 119.474 -2.016 . . . . 0.56999999999999995 111.72 172.436 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 91.4 t -60.41 -37.46 74.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.84 1.655 . . . . 0.67000000000000004 110.504 167.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 13.3 mt -55.23 -54.1 28.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 CA-C-N 120.335 1.425 . . . . 0.77000000000000002 112.196 165.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.4 t -58.5 -44.36 88.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 119.633 1.106 . . . . 0.56999999999999995 112.951 -179.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.6 mp -63.2 -42.32 99.31 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.58 1.082 . . . . 0.91000000000000003 111.393 175.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.6 t -65.34 -41.3 90.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 123.819 0.848 . . . . 0.62 110.825 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.58 -43.08 99.51 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.396 0.544 . . . . 3.1499999999999999 112.161 166.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.57 -23.76 64.9 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.704 -1.247 . . . . 3.9100000000000001 113.556 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -75.43 -72.83 0.28 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.907 0.883 . . . . 1.8100000000000001 112.455 158.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -58.95 -26.65 64.6 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.39 1.626 . . . . 2.0899999999999999 115.39 -167.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -47.45 -32.66 5.3 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.986 1.266 . . . . 2.6000000000000001 112.555 173.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -93.11 -19.22 21.72 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.257 1.823 . . . . 2.3799999999999999 115.219 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.1 t -88.62 51.49 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 CA-C-N 120.455 1.479 . . . . 2.5899999999999999 110.109 -168.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.5 -69.62 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.665 1.986 . . . . 4.5800000000000001 111.197 -152.705 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tppm? 176.03 -47.43 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 129.362 3.065 . . . . 8.7100000000000009 111.495 176.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -111.87 10.51 20.72 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.043 1.337 . . . . 8.3200000000000003 113.105 -171.007 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.2 t -112.99 166.98 10.9 Favored 'General case' 0 N--CA 1.466 0.327 0 O-C-N 120.868 -1.145 . . . . 5.7300000000000004 112.684 -175.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.6 mt -122.23 -72.01 0.7 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 127.316 2.246 . . . . 7.9900000000000002 107.723 169.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.4 p -89.59 -38.43 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 N-CA-C 114.116 1.154 . . . . 4.8399999999999999 114.116 -164.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -92.96 121.57 34.44 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.504 -0.747 . . . . 8.0899999999999999 110.165 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.6 m120 78.93 40.39 0.11 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 125.343 1.457 . . . . 7.3499999999999996 112.01 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.6 175.12 10.67 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.0 1.72 . . . . 7.8399999999999999 114.259 -175.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.0 pt -79.18 166.07 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 N-CA-C 116.032 1.864 . . . . 2.1499999999999999 116.032 -174.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.4 t -77.67 137.51 38.56 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.41 -1.431 . . . . 2.7200000000000002 110.068 164.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mttp -60.7 -21.86 63.34 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 121.063 -1.023 . . . . 2.2999999999999998 112.161 172.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.4 p -67.66 -32.95 73.99 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 120.492 -1.38 . . . . 1.78 113.427 171.4 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.5 m -63.59 -39.68 94.99 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.593 1.088 . . . . 1.0900000000000001 111.543 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.463 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 25.9 t80 -52.1 -60.47 3.16 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.816 0.846 . . . . 2.1000000000000001 111.733 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -61.88 -28.68 69.67 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.458 0.54 . . . . 3.0099999999999998 112.458 -176.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -83.79 -42.01 16.95 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.288 0.566 . . . . 2.8399999999999999 112.098 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 15.7 tmm? -58.58 -37.48 75.87 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.681 -1.262 . . . . 1.54 111.099 170.496 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.6 mt -69.56 -8.03 43.65 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.302 1.593 . . . . 1.51 115.302 167.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -92.14 -7.72 47.69 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 120.932 -1.105 . . . . 3.1000000000000001 113.405 163.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -62.84 1.51 Allowed 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.404 1.261 . . . . 1.54 114.404 174.268 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -82.14 -4.61 57.32 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 119.338 -2.101 . . . . 2.6600000000000001 114.011 -168.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.86 24.81 5.0 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.802 2.041 . . . . 1.7 111.794 175.737 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -74.87 -26.76 59.91 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 115.418 1.636 . . . . 2.0899999999999999 115.418 -164.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 16.8 m80 -70.02 -20.54 63.26 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.472 1.487 . . . . 3.0699999999999998 111.072 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.5 tpp -70.72 3.98 2.81 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.28 1.432 . . . . 1.7 114.323 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.1 mp -85.35 119.37 25.64 Favored 'General case' 0 C--O 1.225 -0.23 0 O-C-N 120.734 -1.229 . . . . 3.1499999999999999 110.27 174.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.7 t -110.08 5.45 22.11 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 114.911 -1.041 . . . . 5.0499999999999998 112.552 175.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 t70 164.94 158.85 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 129.992 3.317 . . . . 4.9800000000000004 109.492 -177.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -25.08 -48.5 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 129.959 3.304 . . . . 3.5899999999999999 114.206 157.477 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.18 -33.61 75.88 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 125.545 1.545 . . . . 2.1000000000000001 113.515 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 -71.35 -23.71 61.97 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.074 0.937 . . . . 3.3799999999999999 112.929 177.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.46 ' CZ ' ' HA ' ' A' ' 56' ' ' ARG . 0.7 OUTLIER -81.39 -45.34 16.24 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-N 119.301 0.955 . . . . 6.7999999999999998 112.487 164.213 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.8 mmtm -55.24 -34.57 64.11 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.906 0.776 . . . . 3.21 112.892 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.27 -27.58 36.11 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.442 1.275 . . . . 1.0700000000000001 114.442 172.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.38 -43.41 50.37 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 119.149 0.886 . . . . 0.93999999999999995 111.62 171.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -60.45 -36.63 78.69 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.279 1.432 . . . . 2.8500000000000001 112.771 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -58.19 -30.21 66.26 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.514 0.931 . . . . 3.3500000000000001 113.514 173.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.9 mt -78.06 -42.18 33.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 118.415 -0.802 . . . . 1.0 111.425 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.7 mm -60.73 -43.65 95.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 118.951 0.796 . . . . 1.1599999999999999 110.373 -175.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -62.09 -28.72 69.81 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.536 0.939 . . . . 2.2400000000000002 113.536 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.6 m-20 -81.64 -44.63 16.92 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.283 1.433 . . . . 3.0099999999999998 113.01 175.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.87 -30.19 26.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.612 1.165 . . . . 2.3399999999999999 111.703 -171.07 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -71.5 -22.93 61.73 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.914 1.079 . . . . 2.77 113.914 -177.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.55 -2.4 3.4 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 113.88 1.067 . . . . 2.5299999999999998 113.88 164.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -138.4 -173.31 3.5 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 127.514 2.326 . . . . 3.8500000000000001 110.287 -176.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 7.2 m80 55.52 45.34 25.22 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.97 1.47 . . . . 4.2000000000000002 114.97 158.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.402 ' C ' ' H ' ' A' ' 73' ' ' ARG . 0.3 OUTLIER -134.09 155.46 50.01 Favored 'General case' 0 C--O 1.232 0.158 0 O-C-N 121.378 -0.826 . . . . 6.6799999999999997 112.592 166.657 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.56 -18.9 0.41 Allowed Glycine 0 CA--C 1.538 1.515 0 CA-C-O 118.918 -0.934 . . . . 4.96 113.392 -161.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.402 ' H ' ' C ' ' A' ' 71' ' ' ASP . 87.5 mmt-85 -141.38 149.83 41.61 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 128.359 2.664 . . . . 4.9000000000000004 110.42 172.435 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.4 mm -138.02 148.16 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.296 1.839 . . . . 3.0600000000000001 109.83 173.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.7 m -117.39 144.44 44.96 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.148 1.779 . . . . 1.96 108.681 177.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -59.37 -36.67 76.19 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.773 1.273 . . . . 1.9299999999999999 112.112 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.83 -20.54 65.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.512 2.725 . . . . 3.02 114.488 177.463 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -56.8 -58.91 6.05 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.888 1.222 . . . . 3.3199999999999998 109.888 171.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -58.79 -44.39 90.73 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.343 -0.848 . . . . 2.3799999999999999 112.035 -175.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.6 t-105 -62.07 -47.66 83.67 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 118.561 -0.733 . . . . 0.66000000000000003 112.138 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.2 t -70.3 -28.14 64.95 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.446 1.021 . . . . 1.8400000000000001 112.124 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.463 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 57.9 mt -68.04 -40.96 82.75 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 117.631 -1.176 . . . . 0.64000000000000001 111.75 172.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 25.6 mm -54.76 -42.03 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 CA-C-N 121.545 1.975 . . . . 0.56999999999999995 111.977 176.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -65.38 -19.39 66.49 Favored Glycine 0 N--CA 1.472 1.041 0 C-N-CA 124.111 0.862 . . . . 0.66000000000000003 114.149 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.09 -22.29 63.62 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-N 118.307 1.054 . . . . 0.66000000000000003 113.706 177.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.1 mp -90.42 -40.82 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 118.829 1.314 . . . . 0.81999999999999995 109.955 163.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.3 m -80.75 80.61 7.19 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.452 1.501 . . . . 1.3500000000000001 109.074 -175.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -153.98 -75.61 0.02 OUTLIER Glycine 0 CA--C 1.532 1.132 0 C-N-CA 125.752 1.644 . . . . 0.76000000000000001 112.861 -174.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -62.37 -45.77 14.03 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.74 2.293 . . . . 0.97999999999999998 111.641 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 pt -72.87 -16.37 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 114.839 1.422 . . . . 1.2 114.839 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -50.51 -58.53 5.56 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.792 1.633 . . . . 1.1100000000000001 112.715 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -60.69 -40.23 91.4 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.112 -0.992 . . . . 2.9100000000000001 112.466 176.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.3 tt -58.63 -47.15 85.35 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 124.424 1.09 . . . . 1.1499999999999999 110.579 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 42.4 mt -47.7 -58.49 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.792 1.237 . . . . 1.1399999999999999 111.117 174.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -70.55 -34.65 72.49 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.57 -0.706 . . . . 2.5600000000000001 112.099 -175.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.284 4.3 pt-20 -77.15 -24.19 51.57 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.636 -0.665 . . . . 2.9100000000000001 111.876 -175.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -59.0 -58.35 9.04 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.262 1.825 . . . . 2.1200000000000001 112.438 164.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -71.62 -12.54 61.4 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.024 0.829 . . . . 3.52 112.431 -171.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -79.4 -54.3 6.07 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.209 -0.932 . . . . 1.8700000000000001 111.146 163.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.76 -16.18 37.43 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.027 1.121 . . . . 4.75 114.027 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 29.0 t -125.06 31.29 5.65 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.594 2.357 . . . . 7.1299999999999999 111.625 171.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.7 t -71.0 0.56 7.2 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 115.255 1.576 . . . . 10.369999999999999 115.255 -176.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 41.9 t . . . . . 0 C--O 1.25 1.122 0 C-N-CA 128.866 2.866 . . . . 13.06 109.842 -174.078 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 68.9 m . . . . . 0 N--CA 1.472 0.67 0 CA-C-O 118.455 -0.783 . . . . 9.5500000000000007 110.049 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -71.56 -129.61 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.259 0 O-C-N 124.815 1.322 . . . . 5.96 108.729 137.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 74.7 m -70.99 -42.69 69.32 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.222 1.374 . . . . 4.0 114.328 -173.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -57.88 123.62 16.43 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.023 -1.048 . . . . 2.23 112.664 -174.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.17 156.61 37.18 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.712 0.805 . . . . 1.3200000000000001 109.774 -173.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -63.03 -39.85 95.98 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-O 117.78 -1.105 . . . . 2.4900000000000002 111.341 175.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.16 -47.37 81.35 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.784 1.278 . . . . 1.01 109.895 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.08 -56.1 7.78 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 126.57 1.948 . . . . 2.8399999999999999 111.593 -173.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -57.92 -29.87 65.47 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 120.75 -1.219 . . . . 4.71 112.238 169.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.813 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.43 -40.81 77.01 Favored 'General case' 0 C--O 1.224 -0.251 0 O-C-N 119.826 -1.796 . . . . 0.48999999999999999 111.992 169.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 53.2 t -59.65 -31.93 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.762 1.619 . . . . 0.72999999999999998 111.162 171.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 35.2 mt -60.78 -54.37 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 CA-C-N 119.859 1.209 . . . . 0.75 110.872 166.174 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.24 -36.92 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.479 1.112 . . . . 0.5 113.268 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.83 -44.76 76.48 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.474 1.034 . . . . 0.93999999999999995 111.39 173.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.4 t -64.12 -39.44 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.947 0.899 . . . . 0.57999999999999996 111.406 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -69.9 -38.15 76.21 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.112 0.782 . . . . 3.3700000000000001 113.112 170.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -59.31 -23.07 62.14 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.582 -1.324 . . . . 3.6000000000000001 113.017 173.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -81.44 -68.82 0.66 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.671 0.788 . . . . 1.9199999999999999 112.704 163.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -60.24 -25.75 65.9 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.892 1.441 . . . . 2.0299999999999998 114.892 -168.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -47.87 -33.19 7.13 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.922 1.237 . . . . 2.6099999999999999 112.925 172.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -89.47 -16.82 29.94 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.862 1.43 . . . . 2.1600000000000001 114.862 177.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 5.5 t -90.25 51.25 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-O 123.235 1.493 . . . . 2.4500000000000002 109.914 -167.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.3 t 65.22 -68.0 0.12 Allowed 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 128.25 2.62 . . . . 4.7999999999999998 111.87 -164.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -178.41 -43.54 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 127.185 2.194 . . . . 8.5600000000000005 113.449 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -132.59 14.74 4.45 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.877 1.271 . . . . 8.0800000000000001 112.878 -171.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 3.1 t -108.79 175.69 5.37 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 120.693 -1.254 . . . . 5.8399999999999999 113.867 -170.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 18.5 mt -134.25 -72.17 0.49 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 127.68 2.392 . . . . 8.0600000000000005 107.095 171.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 5.2 p -94.74 -37.85 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 113.889 1.07 . . . . 4.79 113.889 -163.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 27.9 ttpt -89.94 119.46 30.33 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.577 -0.702 . . . . 8.1300000000000008 109.494 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 14.0 m120 76.77 43.89 0.12 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.348 1.459 . . . . 7.3300000000000001 111.914 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.84 176.47 7.05 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 125.707 1.603 . . . . 7.7199999999999998 114.537 -177.329 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 19.7 pt -83.99 175.96 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 115.292 1.59 . . . . 2.1800000000000002 115.292 -173.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 29.8 t -94.29 137.88 32.93 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.469 -1.395 . . . . 2.73 109.97 164.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 138' ' ' LYS . . . . . 0.405 ' HE2' HD12 ' B' ' 169' ' ' LEU . 23.0 mttp -68.78 -17.07 63.97 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.732 -1.23 . . . . 2.6099999999999999 111.469 171.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 10.0 p -65.53 -27.68 68.63 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.589 -1.319 . . . . 1.6799999999999999 113.116 165.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 12.6 m -77.94 -39.29 43.2 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.364 0.984 . . . . 1.1799999999999999 111.545 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.476 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 47.7 t80 -47.58 -57.48 5.39 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.008 0.923 . . . . 2.1000000000000001 111.171 173.125 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.3 ptt180 -62.12 -26.73 68.47 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.361 0.874 . . . . 2.9100000000000001 113.361 -176.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -87.82 -43.68 11.66 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.425 1.09 . . . . 2.4399999999999999 111.941 -176.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.46 -41.41 69.45 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.393 1.477 . . . . 1.27 111.245 170.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 71.2 mt -71.02 -4.3 24.17 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.54 1.936 . . . . 1.6000000000000001 115.183 171.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -98.92 -10.09 23.27 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.325 1.45 . . . . 2.96 112.725 165.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.19 -57.31 2.09 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.867 1.267 . . . . 1.3799999999999999 113.658 174.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -86.76 -6.03 58.94 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.505 -1.372 . . . . 2.7799999999999998 114.044 -169.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.35 14.85 8.3 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.784 2.034 . . . . 1.75 112.618 176.029 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -66.87 -26.87 67.1 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.264 1.579 . . . . 1.9199999999999999 115.264 -163.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -70.86 -14.21 62.32 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.182 1.355 . . . . 2.9500000000000002 112.304 178.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.6 tpp -80.25 5.37 14.82 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.339 1.455 . . . . 1.76 113.731 174.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.9 mp -91.49 132.04 36.53 Favored 'General case' 0 C--O 1.227 -0.122 0 O-C-N 120.678 -1.264 . . . . 3.1800000000000002 109.404 177.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 20.1 m -140.4 16.88 2.39 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.165 -0.959 . . . . 5.21 112.118 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 18.7 t70 172.13 158.57 0.1 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 129.4 3.08 . . . . 5.4199999999999999 109.762 173.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 3.7 m -25.2 -52.87 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 129.498 3.119 . . . . 4.2400000000000002 113.326 156.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.0 -33.5 69.25 Favored Glycine 0 CA--C 1.525 0.674 0 C-N-CA 124.817 1.199 . . . . 2.4199999999999999 113.262 -175.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -70.92 -23.83 62.33 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 118.516 1.158 . . . . 3.3300000000000001 113.516 -178.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -84.4 -50.05 8.14 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.084 0.857 . . . . 7.2800000000000002 112.62 164.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -54.33 -34.46 61.1 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 119.007 0.821 . . . . 3.2599999999999998 112.552 -178.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -53.62 -29.44 37.95 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.41 1.263 . . . . 1.0700000000000001 114.41 173.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -74.12 -40.34 62.72 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.224 0.92 . . . . 0.88 112.274 171.159 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -70.13 -27.63 64.71 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.292 1.037 . . . . 1.9199999999999999 112.876 -177.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 23.4 mtmt -60.05 -27.82 67.26 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 121.138 -0.976 . . . . 3.4100000000000001 113.274 168.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 6.5 mt -78.14 -40.89 36.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.702 -0.681 . . . . 0.95999999999999996 110.998 173.058 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 19.1 mm -61.06 -44.69 98.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 118.393 0.542 . . . . 1.29 110.926 -178.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -61.94 -27.66 68.99 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.491 0.923 . . . . 2.6000000000000001 113.491 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 m-20 -83.2 -45.23 14.12 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.158 1.383 . . . . 3.0600000000000001 113.092 174.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 169' ' ' LEU . . . . . 0.405 HD12 ' HE2' ' B' ' 138' ' ' LYS . 0.1 OUTLIER -96.72 -31.34 12.72 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.311 1.044 . . . . 2.96 112.673 -166.086 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -79.83 -8.4 59.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.703 1.201 . . . . 3.4300000000000002 112.966 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -74.97 -7.13 52.73 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.894 1.278 . . . . 2.9199999999999999 113.484 159.323 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -134.48 -173.41 3.28 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.439 2.296 . . . . 4.0099999999999998 110.514 -178.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 57.6 73.08 0.48 Allowed 'General case' 0 CA--C 1.552 1.034 0 CA-C-O 122.809 1.29 . . . . 4.0 113.269 164.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -155.81 159.23 39.23 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.791 1.237 . . . . 6.0999999999999996 110.899 172.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 69.01 -27.43 0.3 Allowed Glycine 0 CA--C 1.534 1.221 0 C-N-CA 124.381 0.991 . . . . 5.3799999999999999 112.337 -160.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 81.9 mmt-85 -134.58 149.65 50.63 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.027 2.531 . . . . 5.1799999999999997 110.302 167.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 26.2 mm -140.3 152.24 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.893 2.077 . . . . 3.4500000000000002 107.315 172.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.4 m -117.38 144.01 45.39 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.503 1.521 . . . . 1.99 109.501 -177.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -58.91 -38.93 80.02 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 122.986 1.374 . . . . 1.8400000000000001 111.937 177.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -63.5 -20.98 66.05 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.305 2.642 . . . . 2.96 114.346 175.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -57.5 -55.48 34.21 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.919 1.236 . . . . 2.9700000000000002 109.713 171.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -55.39 -51.24 67.47 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.838 -0.539 . . . . 2.3999999999999999 111.507 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.3 t-105 -61.05 -45.58 94.19 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 118.927 -0.559 . . . . 0.66000000000000003 112.351 -178.289 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.7 t -72.12 -27.53 62.68 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 117.81 -1.091 . . . . 1.6899999999999999 112.343 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.476 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 74.4 mt -65.21 -44.71 87.46 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.769 1.168 . . . . 0.78000000000000003 111.535 168.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 36.8 mm -52.89 -38.55 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 CA-C-N 121.578 1.99 . . . . 0.94999999999999996 113.417 -177.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.2 -18.96 67.77 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 123.928 0.775 . . . . 0.72999999999999998 113.924 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -77.7 -25.16 63.31 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 118.522 1.161 . . . . 0.81000000000000005 113.321 176.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -87.55 -43.06 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 118.44 1.12 . . . . 0.94999999999999996 110.238 164.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 8.0 m -86.41 86.04 7.33 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.912 1.285 . . . . 1.51 109.177 -170.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -160.07 -74.37 0.02 OUTLIER Glycine 0 CA--C 1.533 1.206 0 C-N-CA 126.259 1.885 . . . . 0.72999999999999998 113.18 -171.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.59 -45.59 17.19 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.917 2.411 . . . . 0.95999999999999996 111.751 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.5 pt -71.82 -19.31 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 116.874 -1.536 . . . . 1.25 114.533 172.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -46.79 -58.91 3.43 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 121.71 2.05 . . . . 1.1100000000000001 112.902 178.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.13 -40.96 87.08 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.42 -1.425 . . . . 3.2799999999999998 112.583 177.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.2 tt -61.01 -46.67 89.8 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 118.465 0.575 . . . . 1.46 110.334 -178.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 49.7 mt -49.36 -48.21 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 126.141 1.776 . . . . 1.3400000000000001 111.903 175.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -76.72 -42.78 40.02 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.254 -0.579 . . . . 2.52 111.601 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -76.13 -21.64 56.38 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.888 -0.508 . . . . 2.8900000000000001 111.896 -169.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -50.74 -59.76 3.75 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 126.516 1.926 . . . . 2.1400000000000001 112.888 162.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -75.56 0.75 16.3 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 122.196 0.998 . . . . 3.4199999999999999 111.631 -170.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -98.09 -53.91 3.23 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.715 1.606 . . . . 2.3900000000000001 110.257 165.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.93 -14.28 45.08 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.563 0.949 . . . . 5.1299999999999999 113.563 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 34.5 t -125.24 28.67 6.28 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 127.713 2.405 . . . . 6.8600000000000003 112.079 171.477 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 26.2 t -73.76 -2.88 25.25 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 115.4 1.63 . . . . 10.19 115.4 -176.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 44.7 t . . . . . 0 C--O 1.254 1.322 0 C-N-CA 128.751 2.82 . . . . 12.720000000000001 110.946 -176.649 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 p . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 118.968 -0.539 . . . . 12.0 110.343 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -91.4 -43.2 9.88 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.989 1.716 . . . . 8.1600000000000001 111.911 167.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.9 t 177.42 -38.35 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 129.21 3.004 . . . . 4.6200000000000001 109.577 -165.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -68.48 119.28 12.7 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 108.121 -1.066 . . . . 2.6200000000000001 108.121 162.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 70.0 p -59.6 141.18 55.5 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 118.956 0.798 . . . . 1.2 110.751 -170.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.404 ' HG2' HG21 ' B' ' 117' ' ' VAL . 6.6 tt0 -65.39 -21.76 66.71 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 117.992 -1.004 . . . . 3.3799999999999999 112.33 -175.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -47.92 64.69 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.019 0.827 . . . . 0.80000000000000004 110.912 169.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -69.64 -52.21 27.9 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.863 0.756 . . . . 3.1299999999999999 110.783 -178.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -44.57 -45.94 9.71 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.193 1.397 . . . . 4.4900000000000002 114.01 164.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.911 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -63.0 -48.07 80.4 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 118.05 -0.976 . . . . 0.5 112.321 174.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 93.8 t -58.93 -35.52 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 120.061 1.3 . . . . 0.65000000000000002 111.296 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.0 mt -54.13 -46.77 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 CA-C-N 120.066 1.303 . . . . 0.79000000000000004 112.312 165.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 53.9 t -71.62 -42.01 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 120.459 -1.4 . . . . 0.68000000000000005 112.938 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.19 -30.49 68.25 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.886 -1.134 . . . . 1.0 111.052 174.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.3 t -73.49 -48.74 40.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-O 117.038 -1.458 . . . . 0.57999999999999996 111.799 172.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -38.54 81.97 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 121.416 1.916 . . . . 3.4100000000000001 112.949 176.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -64.88 -32.64 74.44 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.786 1.032 . . . . 2.1299999999999999 113.786 -176.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.461 ' CZ ' HG21 ' A' ' 23' ' ' VAL . 36.0 t80 -65.63 -57.51 7.94 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.69 -0.631 . . . . 2.2799999999999998 110.713 167.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.479 ' HA ' HG22 ' A' ' 23' ' ' VAL . 55.4 m-85 -68.97 -24.7 64.28 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.927 1.084 . . . . 1.78 113.927 -170.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.5 pttt -66.71 -24.8 66.29 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 121.27 1.85 . . . . 2.54 112.661 168.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -100.33 10.7 40.85 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.053 1.741 . . . . 2.8599999999999999 114.433 172.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.479 HG22 ' HA ' ' A' ' 20' ' ' TYR . 34.1 m -140.9 -148.55 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 125.626 1.57 . . . . 2.8100000000000001 108.207 164.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.5 t 74.99 154.56 0.15 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.058 1.743 . . . . 5.4199999999999999 111.011 169.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 11.7 ttmm 72.42 -51.77 0.7 Allowed 'General case' 0 CA--C 1.557 1.228 0 N-CA-C 115.259 1.577 . . . . 7.4000000000000004 115.259 160.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -76.1 73.62 2.96 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 127.87 2.468 . . . . 13.17 111.737 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.1 t 83.61 170.19 0.09 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.352 2.261 . . . . 7.6900000000000004 112.924 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.91 -35.61 75.24 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.366 1.066 . . . . 9.2799999999999994 112.514 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.3 p -165.18 -54.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 125.278 1.431 . . . . 3.8199999999999998 112.072 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.8 mmmt -58.31 -19.65 36.58 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 117.031 2.234 . . . . 13.31 117.031 -163.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -117.6 12.47 14.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.48 1.112 . . . . 7.4699999999999998 113.548 -173.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -73.11 -39.23 65.95 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.506 1.299 . . . . 10.279999999999999 114.506 -172.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.5 tt -152.3 170.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 125.162 1.385 . . . . 3.3599999999999999 108.986 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.0 m -114.27 142.15 46.66 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 107.77 -1.196 . . . . 2.8399999999999999 107.77 148.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.5 mttp -63.31 -19.58 64.73 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.614 -1.304 . . . . 2.7599999999999998 113.143 -168.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 5.3 p -49.97 -20.15 0.87 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.442 2.297 . . . . 2.1800000000000002 115.877 163.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 m -92.48 -18.34 23.33 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.565 1.691 . . . . 1.6100000000000001 115.565 170.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.412 ' CE1' HD11 ' A' ' 42' ' ' LEU . 27.7 t80 -60.47 -47.16 87.36 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 118.592 -2.567 . . . . 2.3100000000000001 111.296 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -58.04 -20.77 41.64 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.91 1.684 . . . . 2.5499999999999998 114.344 170.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.65 -49.13 6.25 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 126.591 1.956 . . . . 3.7999999999999998 108.853 -171.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 1.2 tmm? -48.67 -49.89 35.56 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.413 1.485 . . . . 1.49 111.295 163.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.412 HD11 ' CE1' ' A' ' 38' ' ' PHE . 38.4 mt -59.98 -9.96 3.64 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 115.627 1.714 . . . . 1.1899999999999999 115.627 172.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -112.23 -16.87 12.9 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.551 1.54 . . . . 2.0 112.589 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.8 -42.61 11.8 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.999 0.818 . . . . 2.9399999999999999 112.837 166.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -84.76 -53.16 5.54 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.099 1.36 . . . . 3.0 111.746 -174.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.3 mt -96.14 39.82 1.14 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.769 1.228 . . . . 2.54 112.334 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -76.41 -12.15 60.01 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.838 1.421 . . . . 1.5800000000000001 114.838 -169.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -88.19 -22.45 24.01 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.814 1.188 . . . . 1.6599999999999999 111.318 178.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.3 tpp -63.81 -6.87 6.44 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 128.054 2.541 . . . . 2.3799999999999999 114.336 172.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.2 mp -100.55 -179.9 4.23 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 128.393 2.677 . . . . 2.8300000000000001 113.754 -168.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.8 m -177.28 -101.19 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 129.086 2.954 . . . . 4.5999999999999996 107.148 175.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.59 17.3 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 128.202 2.601 . . . . 4.5199999999999996 115.066 -171.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.6 m 68.53 -1.85 1.8 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.425 2.29 . . . . 3.8900000000000001 111.316 -152.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.36 -47.26 69.51 Favored Glycine 0 N--CA 1.471 0.972 0 C-N-CA 125.119 1.342 . . . . 2.5099999999999998 113.874 -165.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -59.58 -51.83 68.14 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 117.699 0.749 . . . . 4.71 112.17 174.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -55.34 -28.9 56.83 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.584 1.327 . . . . 5.0800000000000001 114.584 171.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -55.18 -39.46 69.59 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 122.567 2.439 . . . . 3.6800000000000002 111.984 173.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.34 -12.06 60.97 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.078 1.51 . . . . 1.53 115.078 174.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.26 -52.25 6.38 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.598 1.159 . . . . 1.3100000000000001 112.284 163.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.92 -30.87 71.88 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.685 0.794 . . . . 2.71 111.758 -175.475 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.0 ptmm? -60.91 -27.4 68.16 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.999 1.111 . . . . 3.3900000000000001 113.999 171.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.3 mt -83.39 -32.49 26.15 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.227 0.611 . . . . 1.3799999999999999 112.297 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.1 mm -53.6 -55.54 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.719 1.207 . . . . 1.48 110.334 178.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -62.69 -39.4 93.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.227 1.011 . . . . 3.5800000000000001 112.531 -177.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.24 -28.97 56.99 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.775 1.23 . . . . 3.5600000000000001 113.767 171.361 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.5 mt -104.27 -26.4 12.5 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.763 1.394 . . . . 2.6600000000000001 114.763 177.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -66.39 -15.25 63.15 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.55 1.068 . . . . 3.6200000000000001 111.821 165.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.32 -27.32 59.22 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 115.07 1.507 . . . . 2.6299999999999999 115.07 160.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -109.62 -20.39 12.86 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.625 1.713 . . . . 2.4300000000000002 115.625 -168.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -139.15 124.84 19.54 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.584 -1.322 . . . . 4.4299999999999997 113.541 -166.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -77.59 17.96 0.48 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.202 1.801 . . . . 4.7300000000000004 115.422 -170.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.76 5.28 66.69 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 124.08 0.848 . . . . 2.4700000000000002 112.658 -159.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.23 134.73 57.34 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.408 1.104 . . . . 4.8499999999999996 109.204 146.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 34.8 mm -150.39 115.69 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 127.375 2.27 . . . . 2.1600000000000001 107.97 -176.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.8 t -95.8 -172.38 2.58 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.731 1.612 . . . . 2.6499999999999999 111.609 167.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -78.24 -40.45 37.23 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.474 1.11 . . . . 2.0899999999999999 112.034 170.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.75 -32.28 73.73 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.847 2.459 . . . . 3.1899999999999999 112.981 -168.338 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -58.59 -50.97 71.85 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 124.786 1.235 . . . . 4.0800000000000001 110.49 176.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -57.41 -49.66 75.48 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.588 -0.695 . . . . 2.6099999999999999 112.489 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 14.0 t-105 -61.83 -39.73 92.82 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 118.779 0.718 . . . . 0.85999999999999999 111.778 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.0 m -59.64 -47.12 86.86 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.283 1.433 . . . . 2.1899999999999999 111.082 174.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.86 -48.57 79.92 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.123 -0.941 . . . . 0.87 111.976 178.078 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.3 mm -55.09 -34.68 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 120.506 1.503 . . . . 1.02 112.84 -170.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -69.6 -21.21 76.2 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.072 0.844 . . . . 0.70999999999999996 113.753 177.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.47 -23.74 77.33 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.394 0.997 . . . . 0.73999999999999999 113.081 173.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.1 mp -89.74 -48.5 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.219 1.01 . . . . 1.1599999999999999 110.344 163.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.9 m -82.7 67.2 8.66 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 126.096 1.758 . . . . 1.3200000000000001 108.974 -173.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -146.69 -77.33 0.02 OUTLIER Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.596 1.569 . . . . 1.01 112.103 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -60.99 -40.66 50.43 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.545 2.83 . . . . 1.24 114.181 -170.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.7 pt -86.57 -14.91 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 119.455 1.025 . . . . 1.6399999999999999 113.146 173.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.48 -35.77 80.39 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.352 0.978 . . . . 1.29 113.155 -172.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -55.33 -44.69 76.09 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.094 -1.004 . . . . 2.6200000000000001 112.75 167.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.6 tt -60.7 -36.57 79.13 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.247 1.019 . . . . 1.2 111.222 -178.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.2 mt -50.39 -61.09 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 123.79 0.836 . . . . 0.89000000000000001 110.151 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.1 t60 -62.16 -35.36 78.55 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.245 -0.91 . . . . 1.8999999999999999 112.846 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -70.11 -23.07 62.97 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 122.986 0.514 . . . . 3.23 111.018 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 67.3 mm-40 -81.05 -30.28 34.84 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.228 1.411 . . . . 2.71 113.944 171.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -67.8 3.89 1.32 Allowed 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 120.292 1.405 . . . . 2.8300000000000001 112.182 166.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -118.58 -79.89 0.6 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.705 1.602 . . . . 2.1699999999999999 111.08 170.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 56.65 3.97 0.14 Allowed 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 129.864 3.266 . . . . 4.3499999999999996 115.536 172.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 58.0 m -165.26 49.63 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.933 2.093 . . . . 6.7699999999999996 108.385 -172.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 58.5 m -141.66 8.5 1.95 Allowed 'General case' 0 N--CA 1.482 1.15 0 O-C-N 120.022 -1.674 . . . . 9.2400000000000002 114.992 173.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 C--O 1.246 0.913 0 C-N-CA 131.067 3.747 . . . . 10.81 107.963 176.844 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 72.6 m . . . . . 0 N--CA 1.474 0.734 0 CA-C-O 118.741 -0.647 . . . . 11.369999999999999 110.594 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -66.97 -133.06 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 O-C-N 124.659 1.224 . . . . 7.9400000000000004 109.743 138.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 42.2 t -77.49 -38.93 48.01 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.215 -1.553 . . . . 3.73 112.313 -172.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.65 111.66 1.34 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.162 0.985 . . . . 2.7200000000000002 110.989 178.288 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 77.4 p -54.01 139.85 33.2 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.863 1.21 . . . . 1.1699999999999999 110.018 -171.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -60.41 -36.67 78.68 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-O 116.433 -1.746 . . . . 3.73 109.514 -176.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.92 -50.56 66.13 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.61 1.55 . . . . 0.72999999999999998 111.364 174.269 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -68.02 -50.56 54.66 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.856 0.753 . . . . 3.0 111.737 -177.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -49.72 -40.93 42.31 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.705 -1.247 . . . . 4.7000000000000002 113.831 168.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.911 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.91 -40.53 75.53 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 124.971 1.308 . . . . 0.56000000000000005 111.766 177.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 95.6 t -60.79 -42.56 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 120.018 1.281 . . . . 0.79000000000000004 110.719 168.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 21.0 mt -52.46 -45.38 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 CA-C-N 120.436 1.471 . . . . 0.77000000000000002 111.934 168.117 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.404 HG21 ' HG2' ' A' ' 7' ' ' GLU . 22.4 t -68.62 -38.63 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 O-C-N 120.885 -1.134 . . . . 0.55000000000000004 113.232 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -58.02 -35.41 71.23 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.979 -1.076 . . . . 1.0900000000000001 111.536 170.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 93.9 t -74.71 -44.67 46.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 117.575 -1.203 . . . . 0.66000000000000003 111.042 -178.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.51 -37.94 85.55 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 120.551 1.523 . . . . 3.71 112.719 174.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -65.28 -33.24 75.52 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.833 1.049 . . . . 2.1699999999999999 113.833 -176.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -66.77 -55.57 14.37 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 121.266 -0.896 . . . . 2.1299999999999999 110.843 168.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 123' ' ' TYR . . . . . 0.437 ' HA ' HG22 ' B' ' 126' ' ' VAL . 51.4 m-85 -68.55 -24.21 64.6 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.791 1.034 . . . . 1.79 113.791 -171.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 36.7 pttt -69.18 -20.77 64.0 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.925 1.693 . . . . 2.4199999999999999 113.264 168.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -98.75 -0.02 43.57 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.828 1.651 . . . . 2.6099999999999999 115.001 170.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.437 HG22 ' HA ' ' B' ' 123' ' ' TYR . 27.7 m -135.25 -145.3 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 126.118 1.767 . . . . 2.7000000000000002 109.45 171.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 3.7 t 71.63 162.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.892 1.677 . . . . 5.5499999999999998 112.413 172.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.9 ttmm 68.13 -55.6 0.5 Allowed 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 116.989 2.218 . . . . 7.0899999999999999 116.989 158.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -75.59 87.75 2.7 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.916 2.487 . . . . 13.039999999999999 111.955 -174.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 9.3 t 75.62 -179.32 0.16 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.524 1.53 . . . . 7.7599999999999998 112.52 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 97.5 mt -63.75 -40.03 95.71 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.03 -1.044 . . . . 9.3699999999999992 111.082 175.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 5.9 p -168.4 -55.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.503 1.297 . . . . 3.98 114.503 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -62.05 -14.19 33.62 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.709 2.114 . . . . 13.19 116.709 -165.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -101.64 -0.81 34.07 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.442 1.497 . . . . 7.7999999999999998 112.863 -178.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -78.7 -46.32 19.3 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.997 1.48 . . . . 10.220000000000001 114.997 -164.16 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.3 tt -151.04 143.69 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 CA-C-N 119.113 0.87 . . . . 3.3199999999999998 110.928 -173.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 60.3 m -92.08 138.54 31.45 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.679 -0.859 . . . . 3.3100000000000001 108.679 167.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -53.86 -26.02 22.6 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 120.532 -1.355 . . . . 2.75 114.259 -175.026 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 20.0 p -71.23 -8.65 55.0 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.811 2.044 . . . . 2.0600000000000001 116.057 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 2.2 m -80.59 -42.7 21.83 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.988 1.267 . . . . 1.48 112.459 -172.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.513 ' CE1' HD11 ' B' ' 145' ' ' LEU . 3.5 t80 -57.91 -49.06 78.03 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.661 1.184 . . . . 1.9399999999999999 112.011 -176.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -54.39 -20.69 7.88 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.162 1.171 . . . . 2.2400000000000002 114.162 173.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -105.39 -34.56 7.8 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.981 0.912 . . . . 2.4500000000000002 113.261 -173.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.6 tmm? -49.91 -49.96 47.96 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.554 1.142 . . . . 1.3500000000000001 110.697 158.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 145' ' ' LEU . . . . . 0.513 HD11 ' CE1' ' B' ' 141' ' ' PHE . 77.1 mt -57.05 -11.24 1.44 Allowed 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.813 1.783 . . . . 1.1000000000000001 115.813 168.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -106.35 -14.62 15.05 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 120.351 1.432 . . . . 2.1400000000000001 112.42 177.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.96 -38.27 6.67 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.201 1.4 . . . . 1.6899999999999999 113.387 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -77.68 -57.3 3.89 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.677 1.191 . . . . 3.2200000000000002 109.65 173.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.6 mt -91.95 42.3 1.1 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.26 1.024 . . . . 2.4500000000000002 111.643 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -71.76 -9.36 58.17 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.198 1.184 . . . . 2.0699999999999998 114.198 -172.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -92.98 -31.76 14.78 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.541 1.064 . . . . 1.6000000000000001 111.491 179.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 22.2 tpp -56.76 -1.73 0.07 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 128.897 2.879 . . . . 2.3399999999999999 115.933 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.7 mp -100.43 -173.98 2.54 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.638 2.375 . . . . 2.8399999999999999 114.427 -166.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 16.6 m -176.25 -104.98 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 129.824 3.25 . . . . 4.5099999999999998 107.393 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.44 12.73 0.06 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 128.068 2.547 . . . . 4.8899999999999997 115.511 -171.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 67.64 13.81 9.36 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.992 1.717 . . . . 4.5099999999999998 110.444 -134.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.19 -48.01 85.88 Favored Glycine 0 N--CA 1.473 1.155 0 C-N-CA 126.089 1.804 . . . . 3.04 115.854 -161.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -66.33 -48.65 69.59 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.611 1.205 . . . . 4.5899999999999999 111.42 174.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.0 ttt-85 -53.54 -28.22 30.32 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.664 1.357 . . . . 4.8200000000000003 114.664 175.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 55.9 mmtt -53.78 -36.17 62.11 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 122.247 2.294 . . . . 5.2300000000000004 111.535 173.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.44 -11.59 59.86 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.284 1.587 . . . . 1.3500000000000001 115.284 175.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -81.14 -51.58 8.3 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.274 1.03 . . . . 1.1399999999999999 111.616 164.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.18 -33.76 75.14 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.816 0.446 . . . . 2.6299999999999999 111.737 -173.226 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 7.6 ptmm? -58.11 -28.38 64.58 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.386 1.254 . . . . 3.4199999999999999 114.386 172.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 30.0 mt -79.09 -33.04 44.79 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.875 -0.516 . . . . 1.1599999999999999 112.163 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.4 mm -64.0 -52.19 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 123.686 0.794 . . . . 1.3999999999999999 109.372 -174.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -60.45 -38.01 82.8 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.828 1.251 . . . . 3.4300000000000002 112.251 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.02 -33.69 72.34 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.434 1.094 . . . . 3.2200000000000002 112.774 172.411 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.02 -21.57 19.66 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.193 -0.942 . . . . 3.52 112.401 -177.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -65.21 -19.62 66.06 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.16 1.384 . . . . 2.7400000000000002 113.519 166.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -73.06 -24.17 60.65 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.012 1.115 . . . . 2.1600000000000001 114.012 162.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 -116.71 -10.37 11.13 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.88 1.808 . . . . 2.2799999999999998 115.88 -165.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.51 138.11 24.58 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 121.326 1.876 . . . . 4.25 114.76 -173.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -87.4 1.15 54.2 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.416 1.635 . . . . 4.3899999999999997 115.416 -172.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 97.27 9.84 54.99 Favored Glycine 0 CA--C 1.533 1.194 0 O-C-N 121.201 -0.937 . . . . 2.52 112.907 -161.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.4 153.81 42.82 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 119.064 -1.054 . . . . 4.71 109.044 131.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 36.2 mm -152.74 140.58 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 128.814 2.846 . . . . 2.5299999999999998 106.32 178.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 3.7 t -106.2 167.51 9.76 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 119.849 1.204 . . . . 2.6000000000000001 112.431 163.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -57.51 -44.35 84.96 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.502 1.144 . . . . 2.1099999999999999 112.144 172.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -29.72 70.68 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.448 2.699 . . . . 3.52 112.248 -171.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.98 -46.38 81.73 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.024 0.93 . . . . 3.8300000000000001 111.024 178.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -57.57 -47.62 81.59 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.256 0.935 . . . . 2.4199999999999999 111.859 175.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.4 t-105 -60.06 -46.12 90.6 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.541 0.609 . . . . 0.85999999999999999 111.354 178.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 89.9 m -57.07 -46.09 82.76 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.968 1.307 . . . . 2.4500000000000002 110.766 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 71.9 mt -65.86 -40.67 91.89 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 117.056 -1.449 . . . . 1.0 112.603 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 25.3 mm -53.23 -39.24 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 CA-C-N 121.02 1.736 . . . . 0.88 112.261 -177.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.77 -18.63 62.04 Favored Glycine 0 CA--C 1.535 1.332 0 CA-C-N 119.446 1.021 . . . . 0.60999999999999999 114.034 176.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -77.78 -20.75 73.14 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-N 118.721 1.26 . . . . 0.84999999999999998 113.623 175.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.1 mp -94.44 -45.29 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.394 1.078 . . . . 1.49 110.666 166.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 23.8 m -82.16 80.01 8.5 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 125.937 1.695 . . . . 1.3999999999999999 107.727 -177.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -155.9 -78.98 0.02 OUTLIER Glycine 0 CA--C 1.531 1.067 0 CA-C-O 118.656 -1.08 . . . . 1.04 113.138 -174.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.09 -40.08 35.7 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.337 2.691 . . . . 1.0900000000000001 113.268 -172.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 18.9 pt -88.25 -14.69 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 N-CA-C 113.62 0.97 . . . . 1.6599999999999999 113.62 171.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -58.07 -39.56 78.81 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.926 1.239 . . . . 1.2 113.19 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -57.81 -45.61 85.85 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 120.617 -1.302 . . . . 2.8799999999999999 112.631 168.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.8 tt -59.2 -38.25 79.44 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 124.186 0.994 . . . . 1.4299999999999999 111.337 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 76.9 mt -49.59 -61.71 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 118.742 0.701 . . . . 1.02 110.281 167.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -59.02 -34.95 72.48 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 120.928 -1.108 . . . . 2.1000000000000001 113.331 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -70.24 -26.34 63.79 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.529 0.732 . . . . 3.3100000000000001 111.204 177.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -77.4 -32.48 54.82 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 117.569 -1.205 . . . . 2.6000000000000001 113.596 172.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -70.58 5.59 1.79 Allowed 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 120.288 1.404 . . . . 2.6899999999999999 112.391 169.25 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -114.08 -74.48 0.62 Allowed 'General case' 0 CA--C 1.534 0.335 0 O-C-N 120.223 -1.548 . . . . 2.4500000000000002 110.741 166.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.89 1.47 0.2 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 129.981 3.313 . . . . 4.6399999999999997 115.759 168.04 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 28.7 m -165.86 60.15 0.11 Allowed 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 129.173 2.989 . . . . 6.8499999999999996 107.243 178.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 33.5 m -141.61 22.07 2.16 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 120.249 -1.532 . . . . 9.3100000000000005 112.751 174.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 47.1 m . . . . . 0 N--CA 1.476 0.846 1 C-N-CA 134.608 5.163 . . . . 10.859999999999999 107.127 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 106.512 -1.662 . . . . 10.77 106.512 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.22 -58.45 3.76 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 128.92 2.888 . . . . 10.039999999999999 111.199 -176.567 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 20.2 m 76.99 3.14 3.32 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 127.03 2.132 . . . . 3.5800000000000001 115.477 163.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 109.21 100.09 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.308 1 C-N-CA 131.911 4.084 . . . . 2.5099999999999998 106.967 -163.315 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.6 p -67.4 148.3 51.77 Favored 'General case' 0 N--CA 1.481 1.125 0 O-C-N 121.539 -0.726 . . . . 1.01 109.804 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -64.82 -19.26 65.76 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-O 118.015 -0.993 . . . . 2.6400000000000001 113.251 176.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.39 -53.96 35.68 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 121.439 1.927 . . . . 1.0600000000000001 109.011 172.012 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -63.65 -52.91 58.67 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.36 1.064 . . . . 3.2799999999999998 109.666 -179.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.3 tptt -60.54 -30.64 69.88 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 120.756 -1.215 . . . . 6.0499999999999998 113.497 174.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.841 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.02 -37.81 78.86 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 119.758 -1.839 . . . . 0.67000000000000004 113.076 170.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 71.8 t -56.03 -46.76 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.688 1.131 . . . . 0.62 110.062 164.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.8 mt -54.14 -52.25 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.977 1.262 . . . . 0.80000000000000004 111.683 172.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.5 t -60.36 -39.16 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.764 1.166 . . . . 0.64000000000000001 112.262 -177.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mp -68.76 -34.1 75.02 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.328 -0.857 . . . . 1.1499999999999999 113.058 173.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.3 t -75.25 -42.24 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.156 0.982 . . . . 0.67000000000000004 111.391 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -63.32 -37.73 88.38 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.893 0.769 . . . . 3.7200000000000002 111.572 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -55.26 -26.73 41.81 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 114.223 1.194 . . . . 1.97 114.223 175.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -87.87 -60.14 2.05 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.292 1.037 . . . . 2.2400000000000002 112.282 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -60.5 -28.45 68.38 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-O 118.824 -0.608 . . . . 1.72 112.442 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -54.86 -19.67 7.06 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 119.888 -1.758 . . . . 2.7400000000000002 114.465 172.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -93.31 10.08 33.56 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 114.933 1.457 . . . . 2.3599999999999999 114.933 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.48 ' CG1' ' H ' ' A' ' 32' ' ' LYS . 30.7 m -113.46 135.03 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 120.482 1.492 . . . . 2.8900000000000001 109.526 162.158 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.1 m -75.08 -42.39 56.85 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.984 1.476 . . . . 4.9900000000000002 114.984 -156.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -174.16 -26.83 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.979 1.712 . . . . 6.6200000000000001 113.205 -178.302 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -136.73 142.72 43.08 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.405 1.482 . . . . 10.17 110.643 175.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 65.7 m -120.23 135.58 54.94 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.888 0.875 . . . . 4.5199999999999996 111.204 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.3 mt -88.89 32.75 0.8 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.402 1.881 . . . . 9.8300000000000001 112.987 -174.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 160.34 -163.51 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.115 1 C-N-CA 135.316 5.446 . . . . 6.4199999999999999 105.623 -164.382 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.527 ' HE3' ' HB2' ' A' ' 76' ' ' PHE . 2.5 mmmt -58.75 -44.08 90.46 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 119.738 -1.851 . . . . 16.370000000000001 112.479 166.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -151.03 168.31 24.98 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.995 1.725 . . . . 11.98 115.421 -175.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.48 ' H ' ' CG1' ' A' ' 23' ' ' VAL . 32.2 tttm -150.81 44.94 0.84 Allowed 'General case' 0 CA--C 1.549 0.938 0 O-C-N 120.604 -1.31 . . . . 6.4199999999999999 114.213 175.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 7.0 pt -64.7 173.24 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.722 0.809 . . . . 3.29 111.448 165.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.0 p -111.86 148.99 32.47 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.588 -1.32 . . . . 3.96 113.337 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.419 ' HE3' ' CG ' ' A' ' 70' ' ' HIS . 21.1 mttp -64.3 -32.24 73.76 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.624 -0.672 . . . . 2.4900000000000002 111.998 174.037 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 p -69.84 -38.84 76.64 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.508 1.123 . . . . 2.2999999999999998 113.417 179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.4 m -76.23 -34.71 59.22 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 117.831 -1.081 . . . . 1.51 113.064 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -53.97 -52.75 59.69 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.881 1.673 . . . . 2.04 112.448 -177.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -61.42 -25.33 67.13 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.274 0.842 . . . . 2.1400000000000001 113.274 177.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -89.37 -51.2 5.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.419 1.487 . . . . 3.1800000000000002 110.293 -170.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 11.2 tmm? -48.39 -41.13 28.08 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.352 1.461 . . . . 1.71 111.965 163.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.9 mt -58.54 -32.05 68.52 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.788 1.403 . . . . 1.05 114.788 173.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -92.02 -3.34 55.95 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.587 1.54 . . . . 2.0299999999999998 113.418 177.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.96 -65.22 0.99 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.356 1.063 . . . . 1.75 111.614 164.43 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -75.29 -18.53 60.03 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.849 -1.157 . . . . 2.5099999999999998 112.78 -169.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.93 16.8 19.32 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.906 1.282 . . . . 2.1099999999999999 113.605 177.176 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -49.95 -34.49 20.87 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 114.642 1.349 . . . . 1.77 114.642 -175.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.413 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 53.9 m-70 -69.16 -21.17 64.01 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.848 1.425 . . . . 1.5600000000000001 114.848 -175.566 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 52.1 mtm -114.44 -15.44 12.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.91 0.884 . . . . 2.0699999999999998 112.981 169.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 tt -74.61 68.49 1.65 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 123.294 1.521 . . . . 2.7000000000000002 110.361 163.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.4 t -94.83 -70.5 0.71 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 126.052 1.741 . . . . 3.6200000000000001 108.767 171.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -77.23 138.51 39.47 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.5 0.667 . . . . 7.0300000000000002 112.019 -165.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.2 m -50.06 -29.61 9.19 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.968 1.307 . . . . 4.1900000000000004 112.776 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.64 -48.2 85.86 Favored Glycine 0 CA--C 1.532 1.101 0 CA-C-O 118.648 -1.084 . . . . 3.0499999999999998 113.087 175.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -51.31 -60.5 3.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.559 1.143 . . . . 3.79 110.062 172.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -67.1 -37.74 84.47 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 113.57 0.952 . . . . 4.5599999999999996 113.57 -171.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.74 -40.01 88.15 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 117.581 -1.199 . . . . 4.5499999999999998 113.541 176.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -53.48 -49.4 67.56 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 127.093 2.746 . . . . 1.3300000000000001 110.76 174.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.66 -54.45 33.18 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.786 1.634 . . . . 0.94999999999999996 113.15 171.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.81 -29.0 69.87 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-O 118.493 -0.765 . . . . 2.0899999999999999 112.799 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt -61.0 -33.26 72.97 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-N 121.113 1.779 . . . . 3.0800000000000001 112.742 171.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.4 mt -68.78 -38.03 79.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.55 -0.295 . . . . 1.1399999999999999 110.682 -178.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 23.3 mm -56.44 -53.61 38.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 125.326 1.45 . . . . 1.21 111.76 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -67.34 -37.23 82.94 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.157 0.983 . . . . 1.8500000000000001 111.678 178.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -63.29 -33.73 76.14 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.025 0.379 . . . . 3.2999999999999998 112.025 173.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 14.0 tp -78.37 -20.57 50.97 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 120.867 -1.146 . . . . 3.8199999999999998 112.1 -177.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -56.56 -25.68 52.9 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.922 0.889 . . . . 3.4300000000000002 113.127 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.91 -2.96 49.72 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 115.656 1.724 . . . . 2.6400000000000001 115.656 172.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -130.03 19.9 5.44 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.956 1.253 . . . . 2.9399999999999999 114.154 -166.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.419 ' CG ' ' HE3' ' A' ' 35' ' ' LYS . 42.3 t-80 -146.25 92.21 2.15 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.235 -1.541 . . . . 6.9699999999999998 113.643 -157.415 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -73.54 36.0 0.09 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 127.026 2.13 . . . . 5.0700000000000003 113.089 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.79 10.2 84.95 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 126.569 2.033 . . . . 2.5699999999999998 113.672 -169.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -107.03 158.88 16.71 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.805 2.442 . . . . 4.7300000000000004 111.12 -172.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.4 mm -130.95 138.16 54.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 108.473 -0.936 . . . . 2.2200000000000002 108.473 161.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.2 t -73.46 -129.05 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 127.68 2.392 . . . . 2.8700000000000001 109.999 170.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.527 ' HB2' ' HE3' ' A' ' 30' ' ' LYS . 84.8 t80 -133.19 -44.15 0.85 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 120.143 -1.598 . . . . 2.04 110.242 164.347 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -64.76 -20.14 66.19 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.95 1.093 . . . . 4.54 113.95 -176.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -53.2 -56.28 17.65 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.642 1.177 . . . . 3.73 112.043 173.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -58.12 -45.79 86.71 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.283 0.947 . . . . 2.25 112.151 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.5 t-105 -65.3 -40.9 94.41 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.613 0.765 . . . . 0.71999999999999997 111.981 -178.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.8 m -59.71 -46.02 90.36 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.577 1.951 . . . . 1.97 111.676 171.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.5 mt -56.8 -42.82 80.17 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.751 0.705 . . . . 1.03 111.639 176.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.8 mm -52.67 -40.65 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 CA-C-N 119.749 1.159 . . . . 0.64000000000000001 112.582 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.54 -24.96 72.65 Favored Glycine 0 N--CA 1.476 1.329 0 C-N-CA 124.557 1.075 . . . . 0.58999999999999997 113.559 177.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -71.34 -23.22 78.31 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 121.445 -1.032 . . . . 0.57999999999999996 113.447 176.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -90.13 -45.04 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 118.616 1.208 . . . . 0.84999999999999998 110.568 162.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.6 m -85.72 64.67 8.75 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 127.821 2.448 . . . . 1.3 108.883 -172.128 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -144.02 -60.73 0.02 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.201 1.382 . . . . 1.25 111.742 -177.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -66.21 -72.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.991 3.127 . . . . 1.1000000000000001 110.647 165.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.4 pp -66.91 -14.11 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.483 1.038 . . . . 1.3700000000000001 113.666 -170.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.0 -33.94 74.03 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.67 0.989 . . . . 1.1299999999999999 113.67 -177.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -42.15 95.09 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.871 -1.143 . . . . 2.98 112.523 170.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.2 tt -56.52 -39.21 72.95 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 124.456 1.102 . . . . 1.3899999999999999 110.516 -173.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 22.2 mt -45.39 -62.8 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.675 1.59 . . . . 0.90000000000000002 111.837 169.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -69.31 -29.38 67.21 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.687 0.795 . . . . 1.76 112.515 -175.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.264 2.5 pt-20 -83.35 -16.89 44.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.112 0.869 . . . . 2.96 112.421 177.155 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 -83.32 -42.11 17.49 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 115.205 1.557 . . . . 2.3599999999999999 115.205 173.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -69.83 4.28 2.09 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 123.512 1.625 . . . . 2.3999999999999999 112.028 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -125.09 -70.2 0.76 Allowed 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 127.722 2.409 . . . . 2.6499999999999999 109.7 176.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 54.33 -6.32 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.13 1 C-N-CA 132.227 4.211 . . . . 3.98 116.055 176.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.6 t -132.04 11.19 4.65 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.936 0.894 . . . . 6.8300000000000001 113.253 -161.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.0 t -79.31 -42.36 25.92 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.417 0.895 . . . . 8.8399999999999999 113.417 176.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 17.1 t . . . . . 0 C--O 1.253 1.24 0 C-N-CA 124.298 1.039 . . . . 11.44 112.386 -149.24 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 106.431 -1.692 . . . . 10.93 106.431 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.61 -58.87 3.11 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.493 2.717 . . . . 9.8900000000000006 111.24 -174.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 15.3 m 75.72 7.82 3.76 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.848 2.059 . . . . 3.6499999999999999 115.226 163.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.413 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 17.4 m-85 102.64 101.4 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.401 1 C-N-CA 131.869 4.068 . . . . 2.5499999999999998 107.826 -162.662 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.8 p -70.2 147.62 49.6 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 118.833 0.742 . . . . 1.01 109.478 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -64.8 -18.77 65.39 Favored 'General case' 0 C--O 1.213 -0.831 0 N-CA-C 113.549 0.944 . . . . 2.9500000000000002 113.549 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.94 -54.36 27.34 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 121.072 1.76 . . . . 1.0800000000000001 108.843 172.245 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -62.84 -52.15 64.25 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.801 1.241 . . . . 3.2200000000000002 110.429 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 25.2 tptt -60.79 -29.93 69.74 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.543 0.942 . . . . 6.8300000000000001 113.543 173.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.841 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.3 -37.5 77.82 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.045 -1.659 . . . . 0.71999999999999997 112.858 170.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 91.3 t -57.61 -45.37 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-N 119.964 1.256 . . . . 0.67000000000000004 109.58 166.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 6.9 mt -53.84 -53.86 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.252 0.933 . . . . 0.93000000000000005 111.455 171.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 18.4 t -58.21 -42.85 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 119.532 1.06 . . . . 0.67000000000000004 111.864 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 4.4 mp -66.25 -41.82 89.42 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.296 -0.877 . . . . 1.1299999999999999 112.731 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 50.2 t -67.43 -40.88 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.85 0.86 . . . . 0.76000000000000001 111.328 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 59.9 tt0 -65.44 -39.79 92.48 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 118.718 0.69 . . . . 3.7000000000000002 112.42 171.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -60.25 -19.45 54.75 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.173 1.351 . . . . 2.4399999999999999 114.123 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -91.2 -60.66 1.84 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.989 1.316 . . . . 2.0800000000000001 112.522 170.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -59.13 -27.5 65.66 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.104 0.866 . . . . 1.8 113.135 -176.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -49.11 -19.37 0.43 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.383 1.623 . . . . 2.7000000000000002 115.383 177.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -83.55 -13.29 54.79 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 116.077 1.88 . . . . 2.3100000000000001 116.077 174.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 6.9 m -75.62 131.78 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 121.187 1.812 . . . . 4.2300000000000004 109.527 174.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 3.0 m -82.47 -32.88 28.66 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.216 1.561 . . . . 5.3300000000000001 115.216 -158.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? 169.4 -25.77 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 130.778 3.631 . . . . 7.4800000000000004 112.029 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -135.08 156.59 48.76 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.953 2.101 . . . . 11.029999999999999 110.808 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 20.2 m -140.56 128.64 22.15 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.782 -0.574 . . . . 4.5800000000000001 110.723 -165.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 36.1 mt -94.86 4.37 53.9 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.046 1.338 . . . . 9.6699999999999999 113.788 -171.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 176.42 179.26 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.721 1 C-N-CA 133.015 4.526 . . . . 6.0700000000000003 106.723 -166.494 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 133' ' ' LYS . . . . . 0.421 ' HE3' ' HB2' ' B' ' 179' ' ' PHE . 7.0 mmmt -55.04 -38.73 68.36 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 116.868 -1.539 . . . . 16.289999999999999 113.891 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -148.73 175.09 11.51 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.328 1.451 . . . . 12.210000000000001 111.333 166.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 51.7 tttm -154.31 61.55 0.69 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.366 -1.458 . . . . 6.2300000000000004 112.717 169.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 10.0 pt -76.59 -177.24 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.098 0.559 . . . . 3.0699999999999998 110.818 167.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 79.5 p -116.42 141.23 48.44 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.012 -1.055 . . . . 3.9700000000000002 113.08 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 11.9 mttp -53.7 -28.42 33.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.133 1.373 . . . . 2.3500000000000001 112.925 173.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 9.5 p -72.94 -34.3 66.47 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.937 1.295 . . . . 2.6000000000000001 113.982 176.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 45.4 t -82.43 -43.23 17.55 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 117.799 -1.096 . . . . 2.9900000000000002 113.335 -169.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.471 ' CE1' HD11 ' B' ' 145' ' ' LEU . 12.3 t80 -54.72 -48.42 72.55 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.939 1.699 . . . . 1.99 112.566 -176.554 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -60.36 -27.21 67.21 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.504 0.927 . . . . 2.3300000000000001 113.504 176.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -92.94 -50.28 5.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.836 1.654 . . . . 3.1299999999999999 111.266 -170.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 10.7 tmm? -51.27 -39.84 57.61 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.724 1.21 . . . . 1.79 111.575 167.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 145' ' ' LEU . . . . . 0.471 HD11 ' CE1' ' B' ' 141' ' ' PHE . 14.0 mt -54.47 -36.99 64.7 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.481 1.289 . . . . 1.25 114.481 174.024 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.84 -4.8 59.22 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.926 1.239 . . . . 2.0099999999999998 113.467 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.28 -61.21 1.56 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.227 1.011 . . . . 1.6399999999999999 111.505 163.362 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.27 -18.22 46.68 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.878 1.671 . . . . 2.5 112.775 -164.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.25 20.56 13.1 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 126.319 1.848 . . . . 2.1000000000000001 113.147 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -51.8 -33.04 33.82 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.946 1.462 . . . . 1.6599999999999999 114.946 -173.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -69.24 -26.34 64.74 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.826 1.047 . . . . 1.47 113.826 -174.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 53.3 mtm -109.71 -14.47 14.33 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.026 0.93 . . . . 2.27 112.702 171.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.09 65.0 1.09 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 122.919 1.342 . . . . 2.71 111.037 163.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 3.5 t -88.63 -67.47 0.83 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.245 -1.343 . . . . 3.5 108.853 170.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -80.79 139.23 36.15 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.61 0.719 . . . . 7.2599999999999998 112.185 -161.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 51.1 m -49.13 -31.99 9.16 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.867 1.267 . . . . 4.2199999999999998 112.303 173.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.58 -50.72 64.45 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.855 -0.97 . . . . 3.0800000000000001 112.802 176.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -49.31 -60.92 2.4 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.539 1.136 . . . . 3.75 110.634 171.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -69.58 -35.74 75.63 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.716 1.006 . . . . 4.4500000000000002 113.716 -170.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.0 -40.17 90.9 Favored 'General case' 0 CA--C 1.511 -0.542 0 O-C-N 120.454 -1.404 . . . . 4.5700000000000003 112.946 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -50.47 -51.45 46.9 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 126.593 2.433 . . . . 1.5600000000000001 110.551 174.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -48.9 -56.43 8.82 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.144 0.978 . . . . 0.70999999999999996 112.554 173.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.48 -34.61 71.09 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.868 0.867 . . . . 1.8999999999999999 112.738 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -59.82 -34.13 72.67 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 120.628 1.558 . . . . 3.1699999999999999 113.231 172.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.2 mt -68.93 -34.0 74.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.35 -0.387 . . . . 0.87 111.55 -178.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 23.3 mm -64.31 -48.7 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 123.515 0.726 . . . . 0.96999999999999997 110.876 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -68.77 -34.83 76.23 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.413 1.085 . . . . 1.8700000000000001 112.059 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 28.8 m-20 -62.33 -43.19 99.41 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 120.569 0.223 . . . . 3.1800000000000002 111.343 169.248 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 12.4 tp -67.34 -19.97 65.52 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 120.865 -1.147 . . . . 3.52 112.671 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.35 -26.3 64.94 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.77 0.656 . . . . 3.7400000000000002 112.77 176.382 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.76 -5.11 56.7 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.318 1.599 . . . . 2.6099999999999999 115.318 171.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -120.39 12.88 11.76 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.049 1.34 . . . . 3.0699999999999998 114.103 -167.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -143.35 90.57 2.18 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 120.377 -1.452 . . . . 6.8899999999999997 114.196 -153.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -72.58 39.39 0.08 Allowed 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 126.446 1.898 . . . . 5.2800000000000002 113.207 173.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 69.73 6.34 55.07 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 125.99 1.757 . . . . 2.4500000000000002 114.103 -171.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -96.64 163.23 13.11 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.602 1.961 . . . . 4.46 110.875 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 19.2 mm -129.32 143.82 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 107.769 -1.197 . . . . 2.4399999999999999 107.769 157.18 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 22.1 t -75.2 -138.18 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.953 2.101 . . . . 2.54 110.728 171.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 179' ' ' PHE . . . . . 0.421 ' HB2' ' HE3' ' B' ' 133' ' ' LYS . 81.5 t80 -125.14 -46.26 1.81 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 119.865 -1.772 . . . . 1.99 110.514 161.08 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -62.04 -19.89 63.37 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.44 1.274 . . . . 4.46 114.44 -178.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -52.15 -52.86 49.14 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.275 1.03 . . . . 3.4199999999999999 111.996 172.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -62.62 -45.53 92.44 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.917 -1.114 . . . . 2.98 111.554 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.0 t-105 -62.43 -44.64 95.94 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.517 0.727 . . . . 0.76000000000000001 112.306 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 58.4 m -55.68 -50.9 69.03 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.778 1.631 . . . . 1.97 110.956 170.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 81.9 mt -60.35 -33.23 72.12 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.194 -0.908 . . . . 0.69999999999999996 112.967 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 29.3 mm -55.49 -42.47 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 CA-C-N 120.564 1.529 . . . . 0.73999999999999999 111.807 174.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.37 -24.72 73.68 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.745 1.164 . . . . 0.64000000000000001 113.651 178.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.02 -19.77 77.38 Favored Glycine 0 CA--C 1.536 1.353 0 O-C-N 121.269 -1.136 . . . . 0.68999999999999995 113.566 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 5.0 mp -93.74 -47.37 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 118.421 1.111 . . . . 0.80000000000000004 110.63 160.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.4 m -83.63 62.73 7.02 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 128.425 2.69 . . . . 1.3700000000000001 109.174 -173.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -142.29 -60.77 0.03 OUTLIER Glycine 0 CA--C 1.528 0.9 0 C-N-CA 125.695 1.617 . . . . 1.23 111.301 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -64.3 -73.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 124.146 3.23 . . . . 1.2 111.048 165.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.4 pp -66.37 -14.58 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 119.708 1.14 . . . . 1.3400000000000001 113.805 -169.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.63 -32.49 73.53 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.639 1.176 . . . . 1.2 114.08 -176.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -44.93 91.43 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.603 -1.311 . . . . 3.0800000000000001 112.537 168.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.1 tt -57.48 -36.51 71.58 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.414 1.086 . . . . 1.54 111.325 -172.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 29.2 mt -45.44 -63.05 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.872 1.669 . . . . 0.87 110.997 170.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -65.63 -35.4 80.7 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.607 0.763 . . . . 1.8100000000000001 111.91 -176.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.297 2.2 pt-20 -76.91 -20.25 56.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.544 1.066 . . . . 3.0800000000000001 112.51 177.706 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 5.2 mm100 -80.76 -42.75 21.28 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 115.329 1.604 . . . . 2.4700000000000002 115.329 174.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -70.44 6.18 1.49 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 123.609 1.671 . . . . 2.5 112.385 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -125.36 -68.44 0.84 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.506 2.322 . . . . 2.48 110.407 176.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.295 11.3 pt20 53.34 -4.41 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.879 1 C-N-CA 131.944 4.097 . . . . 3.8700000000000001 115.681 -177.79 . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 28.0 t -112.79 18.21 18.41 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.508 1.923 . . . . 7.5899999999999999 112.657 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 3.9 t -70.61 -35.93 73.25 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.955 1.465 . . . . 9.3399999999999999 114.955 -173.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 36.5 t . . . . . 0 C--O 1.249 1.074 0 C-N-CA 122.569 0.348 . . . . 12.109999999999999 110.687 -148.621 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.474 0.769 0 N-CA-C 108.999 -0.741 . . . . 9.5899999999999999 108.999 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.03 -14.44 1.57 Allowed 'General case' 0 N--CA 1.471 0.618 0 O-C-N 124.841 1.338 . . . . 6.0599999999999996 113.944 -133.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 73.2 m 72.67 0.98 3.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 127.956 2.503 . . . . 4.75 115.687 168.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -36.5 109.96 0.1 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 127.738 2.415 . . . . 2.4700000000000002 113.946 -177.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.8 p -73.14 154.23 40.42 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.107 0.563 . . . . 1.29 111.451 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.34 2.11 8.21 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.259 1.023 . . . . 2.6200000000000001 113.1 169.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.11 -56.33 4.16 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.598 -1.314 . . . . 1.1499999999999999 109.306 158.309 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -76.94 -50.51 13.07 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 120.854 -1.154 . . . . 2.73 112.837 -168.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.0 tmtt? -58.38 -24.86 61.17 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.209 -0.932 . . . . 5.2300000000000004 111.494 169.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -74.31 -43.23 57.58 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 119.662 -1.899 . . . . 0.68999999999999995 112.721 168.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 77.0 t -55.29 -35.65 37.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 CA-C-N 120.612 1.551 . . . . 0.68000000000000005 111.258 169.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 38.2 mt -53.88 -58.9 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.026 0.83 . . . . 1.02 111.081 165.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 49.2 t -61.37 -40.16 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.28 1.032 . . . . 0.92000000000000004 113.424 -177.053 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.7 mp -65.26 -40.06 93.46 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.522 1.056 . . . . 1.04 111.843 177.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.0 t -63.84 -43.8 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-O 118.747 -0.644 . . . . 0.59999999999999998 110.605 171.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.46 -43.53 75.57 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.695 0.68 . . . . 3.6499999999999999 111.51 173.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.75 -15.87 63.85 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.979 1.474 . . . . 2.3900000000000001 114.979 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -86.3 -53.41 5.04 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.109 -0.994 . . . . 2.1699999999999999 111.306 167.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -60.61 -39.41 88.05 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.804 0.668 . . . . 1.9299999999999999 112.804 -175.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -19.76 65.06 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 114.981 1.475 . . . . 3.5899999999999999 114.981 173.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -95.44 -28.98 14.65 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.695 1.198 . . . . 2.6800000000000002 112.603 172.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.6 t -61.26 -39.13 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 118.974 0.806 . . . . 3.27 110.771 165.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.2 p 153.96 -96.29 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 130.597 3.559 . . . . 5.1600000000000001 108.727 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -165.78 26.03 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.427 1.091 . . . . 6.8899999999999997 113.128 -173.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -149.46 -118.03 0.05 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.717 1.207 . . . . 8.8399999999999999 110.969 -165.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.7 t -173.15 -164.74 0.25 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.521 1.928 . . . . 7.5099999999999998 108.945 178.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 60.3 mt 66.09 -26.71 0.11 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 129.118 2.967 . . . . 6.96 114.396 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 91.6 t 110.57 -59.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.211 1 C-N-CA 133.878 4.871 . . . . 5.5 108.698 168.281 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt 67.83 -21.61 0.12 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 126.934 2.094 . . . . 8.0 115.578 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -140.73 135.62 31.74 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.673 1.189 . . . . 6.3499999999999996 110.7 177.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -76.74 73.23 3.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.729 0.812 . . . . 9.8599999999999994 111.67 173.191 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.4 pt -59.62 128.26 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 O-C-N 121.264 -0.898 . . . . 2.9199999999999999 108.995 177.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.7 m -60.14 136.64 58.08 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.24 0.829 . . . . 2.48 113.24 -166.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.463 ' HB3' HG23 ' A' ' 63' ' ' ILE . 10.9 mtpp -55.75 -31.85 62.9 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 120.877 -1.14 . . . . 4.7199999999999998 113.518 176.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.72 -30.86 14.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.774 1.63 . . . . 2.6899999999999999 113.151 169.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.9 m -77.58 -36.29 52.12 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.985 -1.072 . . . . 1.79 112.622 -174.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 12.5 t80 -53.01 -56.19 17.95 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.283 0.947 . . . . 1.8799999999999999 111.023 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.402 ' HG3' HH11 ' A' ' 39' ' ' ARG . 13.9 ptt85 -61.62 -8.39 4.42 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.844 1.258 . . . . 3.04 113.966 -178.443 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -117.0 -32.79 4.94 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.943 1.297 . . . . 4.2199999999999998 113.715 -174.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 5.6 tmm? -50.97 -42.98 60.41 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.873 0.76 . . . . 1.4199999999999999 109.399 150.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.1 mt -62.68 -19.02 63.44 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 115.502 1.668 . . . . 1.3 115.502 169.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -91.57 -35.5 14.23 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 119.714 1.143 . . . . 2.6499999999999999 112.106 172.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -81.27 -50.98 8.88 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.042 0.837 . . . . 1.8799999999999999 112.271 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -78.46 -30.58 47.49 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.907 0.776 . . . . 2.6800000000000002 111.769 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.16 19.41 20.64 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.055 1.342 . . . . 1.5700000000000001 113.763 -177.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -48.09 -35.38 11.25 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.143 1.777 . . . . 1.4299999999999999 115.228 -173.275 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.474 ' H ' ' CD2' ' A' ' 48' ' ' HIS . 7.4 m-70 -65.21 -21.11 66.71 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.437 1.495 . . . . 1.79 114.588 -178.258 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 39.4 ttm -95.22 10.52 35.71 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.462 1.505 . . . . 2.7000000000000002 114.325 -169.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.7 mp -81.11 169.81 16.96 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.818 1.247 . . . . 3.54 112.489 178.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.3 m -157.12 36.35 0.29 Allowed 'General case' 0 N--CA 1.476 0.838 0 O-C-N 119.843 -1.786 . . . . 4.3600000000000003 110.386 -164.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.6 t70 92.71 -175.06 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 129.592 3.157 . . . . 4.0599999999999996 107.865 -146.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 52.8 p -66.38 -12.76 58.69 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.971 1.708 . . . . 2.8799999999999999 114.764 170.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.46 -30.72 42.12 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 125.668 1.604 . . . . 1.6200000000000001 114.644 -171.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -69.24 -45.55 69.52 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.483 1.513 . . . . 3.23 110.65 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.9 ttt-85 -65.74 -47.33 75.66 Favored 'General case' 0 C--N 1.346 0.448 0 O-C-N 121.461 -0.774 . . . . 5.1900000000000004 110.039 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.8 mmtt -55.94 -29.04 59.51 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.09 0.774 . . . . 4.1299999999999999 113.09 175.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.86 -39.27 69.79 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 117.759 -1.115 . . . . 1.5800000000000001 112.305 171.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.62 -44.37 93.48 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.386 1.075 . . . . 1.0 111.969 172.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -53.01 -37.57 61.6 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.376 1.07 . . . . 2.2599999999999998 112.731 175.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -61.3 -34.53 75.37 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 120.195 -1.565 . . . . 3.6699999999999999 112.797 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.4 mt -74.5 -38.2 62.93 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.04 1.336 . . . . 1.1399999999999999 111.852 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.463 HG23 ' HB3' ' A' ' 35' ' ' LYS . 17.8 mm -49.56 -59.18 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 117.726 -1.13 . . . . 1.25 109.595 170.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -62.51 -36.15 81.66 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 119.603 1.092 . . . . 2.8900000000000001 113.091 -174.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -62.71 -34.48 77.23 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.859 1.263 . . . . 2.6699999999999999 113.009 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -86.36 -44.85 11.74 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.368 1.067 . . . . 3.29 112.266 176.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -62.43 -38.76 90.97 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.281 1.433 . . . . 2.54 111.724 -168.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.78 -18.72 13.71 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.66 1.184 . . . . 2.3199999999999998 114.117 171.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -113.43 -0.54 14.44 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.082 1.753 . . . . 3.1099999999999999 113.099 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -135.24 128.77 32.54 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 120.964 1.711 . . . . 3.9100000000000001 112.042 -163.702 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -79.49 46.56 0.76 Allowed 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 122.599 1.19 . . . . 4.8200000000000003 112.042 -175.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 59.45 2.24 1.5 Allowed Glycine 0 CA--C 1.538 1.489 0 C-N-CA 125.24 1.4 . . . . 4.0599999999999996 113.043 -157.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -79.06 100.63 7.44 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 120.609 -1.524 . . . . 7.8799999999999999 110.977 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.5 pt -69.58 166.4 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.965 1.706 . . . . 3.4100000000000001 112.976 162.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 64.2 m -141.87 169.36 17.74 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.451 1.5 . . . . 2.1699999999999999 110.973 166.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -52.62 -55.74 20.25 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.31 1.053 . . . . 2.0499999999999998 111.927 179.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.02 -37.82 64.49 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 128.733 2.813 . . . . 2.98 111.785 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -74.77 -46.98 33.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.588 1.155 . . . . 3.6800000000000002 110.603 -171.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -51.12 -54.09 28.28 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.725 0.693 . . . . 1.8300000000000001 111.002 167.023 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 22.6 t-105 -62.78 -46.87 86.01 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 118.375 0.534 . . . . 0.56999999999999995 111.873 -171.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 39.1 p -61.31 -43.49 98.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 117.785 -1.102 . . . . 2.8399999999999999 111.549 178.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 23.8 mt -56.44 -36.88 69.51 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.173 -0.918 . . . . 0.98999999999999999 113.231 175.717 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.1 mm -51.07 -36.52 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-N 120.127 1.33 . . . . 0.84999999999999998 111.232 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.49 -19.65 76.42 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.479 1.037 . . . . 0.68000000000000005 114.646 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.11 -11.84 84.96 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 119.083 1.441 . . . . 0.64000000000000001 113.44 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.8 mp -105.0 -45.71 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.041 1.336 . . . . 0.80000000000000004 110.263 165.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.7 m -80.71 88.18 5.79 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 126.582 1.953 . . . . 1.26 107.782 178.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -172.22 -77.6 0.05 OUTLIER Glycine 0 CA--C 1.528 0.856 0 CA-C-O 118.384 -1.231 . . . . 0.85999999999999999 112.602 -170.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -59.71 -41.53 54.61 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.417 2.745 . . . . 1.0800000000000001 112.756 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.8 pt -77.39 -11.39 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 114.216 1.191 . . . . 1.1499999999999999 114.216 174.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.16 -32.63 74.07 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 113.936 1.087 . . . . 1.05 113.936 -166.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -43.68 97.57 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.856 -1.153 . . . . 3.4100000000000001 111.963 169.571 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.5 tt -61.43 -37.82 84.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.892 1.277 . . . . 1.4199999999999999 110.875 -169.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 97.3 mt -50.06 -67.14 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.29 1.436 . . . . 1.0900000000000001 110.97 168.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -59.7 -29.83 68.38 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.598 -1.314 . . . . 1.78 112.998 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.24 -29.68 65.41 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.944 0.898 . . . . 2.9100000000000001 111.781 174.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -77.81 -37.96 47.48 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.782 2.033 . . . . 4.9400000000000004 110.984 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -63.01 4.1 0.2 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 123.483 1.611 . . . . 2.5899999999999999 113.331 171.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -115.91 -70.19 0.81 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.301 1.44 . . . . 3.0 110.925 169.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -75.22 -5.23 43.43 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 114.848 -1.069 . . . . 6.2300000000000004 112.868 -163.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.2 m 58.16 23.93 10.78 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 127.39 2.276 . . . . 8.5800000000000001 112.621 166.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.3 t 82.64 14.53 0.43 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 128.392 2.677 . . . . 13.09 115.797 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.6 t . . . . . 0 C--O 1.25 1.108 0 CA-C-O 116.987 -1.482 . . . . 10.699999999999999 110.977 145.4 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 CA--C 1.505 -0.781 0 N-CA-C 109.16 -0.681 . . . . 9.8000000000000007 109.16 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -134.54 -14.9 2.18 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 124.781 1.301 . . . . 5.8700000000000001 113.675 -133.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 73.2 m 70.46 2.25 3.98 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.689 2.396 . . . . 4.2699999999999996 116.425 165.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -32.19 101.57 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 127.922 2.489 . . . . 2.3199999999999998 113.555 -177.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 20.7 p -67.98 154.8 40.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 122.608 0.363 . . . . 1.0900000000000001 110.105 -175.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -57.92 -38.39 75.81 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-O 118.322 -0.846 . . . . 2.4900000000000002 111.471 174.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.1 -53.52 49.18 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.523 1.056 . . . . 0.79000000000000004 110.67 173.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 12.1 tm-20 -74.64 -47.4 32.28 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.613 -0.68 . . . . 2.8399999999999999 111.769 -170.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -60.95 -28.1 68.72 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.873 0.869 . . . . 4.8799999999999999 111.908 171.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -70.38 -41.43 73.07 Favored 'General case' 0 C--O 1.222 -0.39 0 O-C-N 119.559 -1.963 . . . . 0.48999999999999999 112.565 166.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 64.3 t -59.71 -37.04 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 120.572 1.533 . . . . 0.67000000000000004 110.698 171.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 26.2 mt -53.41 -59.17 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 118.913 0.778 . . . . 0.82999999999999996 111.166 164.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 44.3 t -61.45 -40.83 87.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-N 119.342 0.973 . . . . 0.69999999999999996 113.307 -175.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.7 mp -63.18 -45.47 91.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.593 1.157 . . . . 1.0600000000000001 111.68 174.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 44.5 t -57.16 -46.45 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-O 118.794 -0.622 . . . . 0.67000000000000004 110.302 173.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.1 -44.77 75.23 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 118.849 0.749 . . . . 3.46 111.391 173.365 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -67.36 -15.67 63.81 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.933 1.457 . . . . 2.25 114.933 -179.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -85.04 -58.19 2.79 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.442 -0.786 . . . . 2.4300000000000002 111.151 166.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -57.74 -38.47 75.39 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.133 0.79 . . . . 1.8799999999999999 113.133 -175.219 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -19.59 65.98 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.534 1.309 . . . . 3.5099999999999998 114.534 175.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -92.86 -32.58 14.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.509 1.123 . . . . 2.4900000000000002 112.337 169.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 97.7 t -55.98 -38.47 52.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 CA-C-N 119.348 0.976 . . . . 3.2000000000000002 111.043 167.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 14.8 p 150.26 -94.43 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 131.0 3.72 . . . . 5.1500000000000004 108.537 176.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 9.0 tttt -166.25 30.41 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.889 1.676 . . . . 6.3399999999999999 111.911 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -150.03 -114.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.125 1.37 . . . . 8.5500000000000007 111.461 -164.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 15.8 t -176.02 -164.26 0.12 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.675 1.99 . . . . 7.8300000000000001 109.429 -177.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 78.9 mt 65.18 -28.4 0.11 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 129.592 3.157 . . . . 6.9400000000000004 115.582 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 73.3 t 111.53 -65.74 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.182 1 C-N-CA 133.833 4.853 . . . . 5.5499999999999998 107.835 177.19 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt 72.35 -38.07 0.41 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.716 2.406 . . . . 8.1199999999999992 114.542 173.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -121.74 134.48 54.94 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.709 1.603 . . . . 6.3700000000000001 109.577 172.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -74.7 67.09 1.54 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.067 0.947 . . . . 9.8399999999999999 112.203 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 3.8 pt -59.55 127.25 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.752 -0.592 . . . . 3.02 109.56 -175.601 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 2.9 m -59.53 138.86 57.56 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.995 1.109 . . . . 2.23 113.995 -164.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -56.89 -37.75 71.81 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 120.426 -1.421 . . . . 4.7000000000000002 110.48 169.144 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 66.0 m -55.94 -13.36 1.82 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.803 2.041 . . . . 3.46 116.093 167.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 74.5 m -88.76 -39.19 14.11 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.42 1.463 . . . . 1.75 111.975 169.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -52.54 -48.23 66.22 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 120.242 1.383 . . . . 2.2000000000000002 111.819 -179.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 19.6 ptt85 -55.23 -18.76 6.59 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.776 1.399 . . . . 3.3500000000000001 114.776 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -114.8 -32.12 5.91 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.759 1.223 . . . . 3.3999999999999999 113.659 -172.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 6.3 tmm? -50.67 -46.46 58.63 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.725 -0.472 . . . . 1.48 109.725 153.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 4.4 mt -63.87 -27.63 69.29 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 114.923 1.453 . . . . 1.3300000000000001 114.923 170.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -77.35 -33.46 55.34 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 120.258 1.39 . . . . 2.5299999999999998 112.177 175.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -84.77 -55.33 4.15 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.392 0.677 . . . . 1.54 112.801 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -77.0 -19.52 57.17 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.639 0.654 . . . . 2.71 112.589 -174.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.52 20.02 12.51 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.464 1.506 . . . . 1.8600000000000001 113.294 -177.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -52.13 -26.0 10.24 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 116.159 1.911 . . . . 1.3899999999999999 116.159 -172.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 151' ' ' HIS . . . . . 0.403 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 6.6 m-70 -77.47 -25.19 50.29 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.87 -1.144 . . . . 1.8400000000000001 113.576 -175.219 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 32.1 ttm -80.01 27.81 0.3 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.338 1.455 . . . . 2.8799999999999999 113.973 -171.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.6 mp -102.71 173.69 6.22 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.437 1.895 . . . . 4.0199999999999996 113.289 -171.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 62.5 m -162.22 43.53 0.14 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 126.032 1.733 . . . . 4.5599999999999996 109.469 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 7.5 t70 82.82 -175.98 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.575 2.35 . . . . 4.4900000000000002 108.498 -144.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 70.7 p -66.46 -15.82 63.64 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 128.468 2.707 . . . . 2.9199999999999999 114.87 -178.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.71 -37.27 67.98 Favored Glycine 0 N--CA 1.476 1.309 0 CA-C-N 120.622 1.555 . . . . 1.7 113.328 -173.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.97 -39.62 94.55 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.387 1.475 . . . . 3.52 110.79 176.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 43.2 ttt-85 -71.59 -38.81 70.84 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.327 -0.858 . . . . 4.71 112.942 167.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -57.48 -33.44 68.0 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.237 -1.539 . . . . 3.1400000000000001 111.175 178.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 161' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' B' ' 164' ' ' LYS . . . -65.28 -13.95 59.6 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 115.973 1.842 . . . . 1.27 115.973 171.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.01 -49.53 10.14 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.822 1.249 . . . . 0.92000000000000004 110.817 164.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -59.48 -34.53 72.7 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 125.047 1.339 . . . . 2.8500000000000001 111.686 -176.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 164' ' ' LYS . . . . . 0.497 ' HG2' ' HA ' ' B' ' 161' ' ' ALA . 1.9 ptmm? -55.55 -31.1 61.86 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 120.861 -1.149 . . . . 3.98 113.684 169.696 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 23.4 mt -82.8 -37.33 24.65 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.332 -0.855 . . . . 1.1599999999999999 112.391 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 26.8 mm -47.89 -60.61 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.098 0.959 . . . . 0.97999999999999998 109.299 173.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -58.25 -39.26 78.71 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.37 0.878 . . . . 1.9199999999999999 113.37 -174.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -62.69 -29.6 70.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.594 1.558 . . . . 2.8399999999999999 112.637 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -99.69 -47.2 5.16 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.308 1.443 . . . . 3.5899999999999999 110.839 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -53.61 -48.03 69.67 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 128.863 2.865 . . . . 2.6200000000000001 111.533 -178.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.52 -15.1 15.76 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 115.009 1.485 . . . . 3.2000000000000002 115.009 175.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -118.28 5.74 11.89 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.982 1.713 . . . . 4.0599999999999996 112.852 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.02 134.18 42.12 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 119.749 -1.844 . . . . 4.2699999999999996 113.627 -164.004 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -79.83 58.86 2.96 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 122.422 1.106 . . . . 4.6399999999999997 111.604 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 62.8 19.54 60.96 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.169 1.842 . . . . 4.1900000000000004 113.451 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -88.67 153.34 21.19 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 122.835 1.302 . . . . 7.7800000000000002 114.06 -163.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 5.3 pt -132.15 169.65 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 128.022 2.529 . . . . 3.8700000000000001 109.784 170.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 58.6 m -142.09 176.66 8.79 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.019 1.328 . . . . 1.71 109.562 165.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -59.15 -52.58 65.11 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 122.371 1.081 . . . . 2.1899999999999999 110.083 168.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -43.71 87.17 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 129.053 2.941 . . . . 3.0600000000000001 111.128 -178.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -72.64 -47.43 47.65 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.454 1.102 . . . . 3.6000000000000001 110.691 -174.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -51.33 -51.53 53.56 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.931 1.241 . . . . 1.9199999999999999 111.598 168.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -65.25 -41.79 93.94 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.394 0.516 . . . . 0.69999999999999996 112.394 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 41.7 p -65.5 -37.21 86.13 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 117.908 -1.044 . . . . 2.6499999999999999 111.777 176.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 76.3 mt -57.33 -39.91 76.88 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.973 0.806 . . . . 0.57999999999999996 112.549 172.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 42.2 mm -54.07 -44.79 64.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 119.773 1.17 . . . . 0.91000000000000003 111.596 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -70.15 -5.63 54.3 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 125.081 1.324 . . . . 1.03 114.266 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -93.3 -11.97 57.86 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-O 118.495 -1.169 . . . . 0.67000000000000004 113.775 170.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.9 mp -95.35 -56.21 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 119.036 1.418 . . . . 1.1699999999999999 107.895 164.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 42.1 m -74.65 98.01 3.33 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 126.252 1.821 . . . . 1.4199999999999999 108.119 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -170.45 -80.18 0.05 OUTLIER Glycine 0 CA--C 1.532 1.143 0 C-N-CA 124.985 1.279 . . . . 1.01 112.787 -172.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -62.53 -43.38 22.21 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.126 2.551 . . . . 1.4299999999999999 112.125 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 10.4 pt -72.49 -10.35 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 114.313 1.227 . . . . 1.3799999999999999 114.313 173.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 194' ' ' ALA . . . . . 0.44 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -60.92 -35.18 76.03 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.109 1.152 . . . . 1.23 114.109 -174.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -48.82 80.06 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.471 -1.393 . . . . 3.7400000000000002 111.734 166.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.14 -37.83 78.21 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.183 1.393 . . . . 1.5700000000000001 111.917 -174.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 197' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' B' ' 194' ' ' ALA . 96.5 mt -53.29 -60.7 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.441 1.496 . . . . 1.22 111.935 168.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -63.74 -30.67 71.74 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.381 -0.824 . . . . 1.8 112.094 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -71.72 -27.28 62.9 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.4 -0.812 . . . . 2.96 111.86 175.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 41.5 tp60 -73.98 -39.67 63.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.821 1.248 . . . . 5.3499999999999996 110.248 179.028 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.6 1.81 0.53 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 125.408 1.483 . . . . 3.1000000000000001 112.905 172.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -109.73 -71.35 0.77 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 120.427 -1.42 . . . . 2.8999999999999999 111.579 167.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -73.35 -7.2 50.64 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 114.92 -1.037 . . . . 5.9800000000000004 112.414 -164.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 70.2 m 60.55 21.53 11.3 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 127.896 2.478 . . . . 8.7400000000000002 112.021 165.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 7.3 t 82.42 16.93 0.37 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.955 2.502 . . . . 13.19 116.013 -179.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 32.7 t . . . . . 0 C--O 1.25 1.115 0 CA-C-O 116.604 -1.665 . . . . 10.609999999999999 111.146 139.835 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.0 m . . . . . 0 CA--C 1.51 -0.593 0 CA-C-O 118.751 -0.642 . . . . 8.5700000000000003 109.98 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -71.57 -129.28 0.0 OUTLIER 'General case' 0 CA--C 1.559 1.303 0 O-C-N 125.191 1.557 . . . . 7.1900000000000004 108.224 139.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 52.5 t -91.96 -41.21 10.69 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.218 1.407 . . . . 4.6900000000000004 112.714 175.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 75.13 98.79 0.07 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 128.647 2.779 . . . . 2.4100000000000001 111.22 -169.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 70.5 p -57.53 148.21 24.53 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.84 0.856 . . . . 1.0700000000000001 109.634 176.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.618 ' HG2' HG21 ' B' ' 117' ' ' VAL . 4.1 tp10 -59.17 -31.42 68.97 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 118.554 0.615 . . . . 2.2799999999999998 111.445 175.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.87 -41.75 98.23 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.681 -0.637 . . . . 1.1100000000000001 111.0 177.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -53.09 13.17 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 118.407 -0.806 . . . . 3.3700000000000001 110.495 175.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -42.32 -43.09 3.36 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.343 1.057 . . . . 4.9000000000000004 112.5 170.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.17 -42.09 76.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 125.054 1.342 . . . . 0.54000000000000004 112.668 -178.211 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 54.3 t -56.52 -46.41 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.99 0.814 . . . . 0.90000000000000002 109.762 167.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 16.3 mt -54.77 -49.15 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-N 118.413 0.551 . . . . 0.90000000000000002 111.432 174.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.615 HG21 ' HG2' ' B' ' 110' ' ' GLU . 32.7 t -65.07 -41.71 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 118.997 0.817 . . . . 0.59999999999999998 112.341 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.56 -41.38 97.29 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.251 -0.905 . . . . 0.93999999999999995 111.233 176.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 80.1 t -72.66 -37.33 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.275 1.43 . . . . 0.83999999999999997 112.486 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -55.51 -54.75 40.01 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.312 1.045 . . . . 3.04 110.142 170.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -71.12 -9.57 58.28 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.198 1.184 . . . . 2.7400000000000002 114.198 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.431 ' HB2' ' CE2' ' A' ' 79' ' ' TYR . 60.0 t80 -79.95 -65.62 0.98 Allowed 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.853 -1.154 . . . . 2.48 112.22 167.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -63.69 -28.63 70.03 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 118.934 -0.555 . . . . 2.25 112.053 -170.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.0 mtpt -46.35 -38.59 9.01 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.354 1.462 . . . . 2.6499999999999999 114.44 168.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -92.41 -26.09 18.18 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.808 -0.557 . . . . 2.3300000000000001 111.325 -176.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.8 t -72.32 -55.2 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 126.243 1.817 . . . . 3.0699999999999998 112.881 176.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.8 p 167.05 -97.77 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 127.284 2.234 . . . . 3.7799999999999998 112.704 -177.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.405 ' HE3' ' OE1' ' B' ' 202' ' ' GLN . 74.3 tttt -170.12 -12.17 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.551 1.941 . . . . 6.4299999999999997 113.303 -166.068 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -167.54 -38.44 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.777 1.631 . . . . 6.75 113.779 -175.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.1 t -115.35 131.24 56.99 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.616 -1.302 . . . . 4.8300000000000001 114.16 -171.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.04 -61.4 2.06 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.385 1.874 . . . . 8.25 113.22 -177.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . 0.278 6.0 m -85.63 65.08 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-O 124.409 2.052 . . . . 4.1900000000000004 112.117 -178.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.408 ' HA ' ' HE2' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -82.04 -5.0 58.03 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 111.516 -2.583 . . . . 7.5300000000000002 113.627 162.786 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 36.67 67.3 0.34 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.864 2.466 . . . . 8.9299999999999997 113.102 -178.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.8 tptt -163.69 -16.33 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.46 1.652 . . . . 9.0299999999999994 115.46 175.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.3 tt -76.65 162.11 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 119.746 1.157 . . . . 2.9300000000000002 108.379 133.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.8 m -163.9 163.29 23.71 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 127.081 2.152 . . . . 3.7599999999999998 109.433 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.4 pttt -47.15 -13.3 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.273 0 N-CA-C 118.011 2.597 . . . . 2.79 118.011 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.3 m -78.98 -28.02 43.5 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 119.912 -1.743 . . . . 2.3799999999999999 114.501 169.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.8 m -77.66 -48.76 16.02 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.624 1.102 . . . . 1.53 111.477 -171.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.431 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 9.8 t80 -49.13 -49.6 41.38 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.166 0.986 . . . . 2.0099999999999998 112.032 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -58.3 -30.24 66.5 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 118.23 -0.891 . . . . 3.79 113.16 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -96.58 -40.93 8.79 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.172 1.389 . . . . 2.8799999999999999 113.533 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 43.3 ttp -49.43 -42.1 41.83 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.863 1.665 . . . . 2.5899999999999999 112.044 163.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.431 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 12.0 mt -55.01 -19.99 8.18 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 114.398 1.258 . . . . 0.96999999999999997 114.398 170.465 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -98.75 -11.23 22.09 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.447 1.499 . . . . 2.6499999999999999 113.009 177.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 -59.5 1.77 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.275 1.03 . . . . 1.6100000000000001 112.118 170.597 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -76.9 -26.42 54.13 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.708 1.203 . . . . 3.5899999999999999 113.156 -172.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.15 43.91 2.34 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.006 1.722 . . . . 1.6200000000000001 111.745 -179.001 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -84.24 -17.86 38.38 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 116.566 2.061 . . . . 1.3400000000000001 116.566 -171.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.523 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 10.5 m-70 -80.92 -25.99 37.08 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 120.917 1.69 . . . . 1.7 113.244 -168.051 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 76.0 mtm -97.59 15.5 23.21 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.182 1.393 . . . . 2.5499999999999998 113.257 164.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.26 -152.56 0.29 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.194 1.798 . . . . 2.6299999999999999 110.853 174.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.1 t 69.11 -35.91 0.32 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.849 2.059 . . . . 6.6100000000000003 113.78 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -35.03 18.26 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 127.3 2.24 . . . . 6.3499999999999996 113.075 174.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 95.1 m 74.41 -23.45 0.23 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 127.329 2.252 . . . . 2.7999999999999998 114.123 169.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.26 -48.97 76.15 Favored Glycine 0 CA--C 1.532 1.154 0 CA-C-N 120.549 1.522 . . . . 2.25 110.244 160.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -37.47 -65.2 0.33 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.073 2.549 . . . . 4.1699999999999999 111.254 159.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.9 tpm_? -56.77 -46.52 81.41 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 114.613 1.338 . . . . 5.8099999999999996 114.613 -175.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -66.28 -35.86 81.49 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.534 0.733 . . . . 3.02 111.586 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.19 -32.87 66.89 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 118.086 -0.959 . . . . 1.1200000000000001 112.885 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.56 -44.12 95.05 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.422 1.089 . . . . 0.93999999999999995 112.78 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.99 -22.73 59.5 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.172 0.804 . . . . 3.4900000000000002 113.172 -175.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -54.88 -37.79 66.73 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 121.552 -0.718 . . . . 3.1099999999999999 112.167 164.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 12.6 mt -74.63 -43.7 54.13 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.159 -0.928 . . . . 1.1499999999999999 111.175 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.0 mm -60.22 -39.04 79.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 118.408 -0.806 . . . . 1.3500000000000001 111.384 -175.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -72.32 -37.58 68.88 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.889 0.876 . . . . 2.3999999999999999 113.297 176.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -62.82 -34.9 78.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.902 1.281 . . . . 3.3799999999999999 112.552 171.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.1 tp -82.27 -36.64 26.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.259 1.424 . . . . 2.5800000000000001 111.454 178.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -43.71 -57.13 3.37 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.8 2.04 . . . . 4.4199999999999999 113.024 -169.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.42 -16.34 3.56 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.702 2.001 . . . . 2.3199999999999998 114.844 -177.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -110.89 -1.62 16.4 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.918 1.287 . . . . 2.3300000000000001 113.059 -173.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 30.6 m80 -138.06 101.21 4.36 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.024 -1.047 . . . . 3.4500000000000002 112.755 -166.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.13 27.4 0.14 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.942 2.097 . . . . 4.6600000000000001 114.349 -171.097 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.77 32.8 58.72 Favored Glycine 0 CA--C 1.533 1.161 0 O-C-N 120.112 -1.618 . . . . 2.4300000000000002 110.643 -150.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.8 mmt-85 -95.34 159.17 15.13 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.051 1.34 . . . . 5.9100000000000001 108.615 162.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.4 mm -145.26 140.66 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 126.454 1.902 . . . . 2.23 107.895 -173.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 t -116.97 173.47 6.63 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.671 0.748 . . . . 1.9199999999999999 112.15 166.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -78.19 -47.47 17.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.355 1.062 . . . . 2.3300000000000001 111.988 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -73.3 -23.86 60.33 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.092 2.157 . . . . 2.77 113.372 -178.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -48.07 -61.19 2.1 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.807 2.043 . . . . 3.27 111.075 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.431 ' CE2' ' HB2' ' A' ' 19' ' ' PHE . 6.8 t80 -54.98 -49.29 71.81 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.312 -0.868 . . . . 1.95 111.485 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.486 ' CZ2' HG21 ' B' ' 186' ' ' ILE . 19.6 t-105 -61.0 -48.18 83.01 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.239 0.615 . . . . 1.0600000000000001 111.881 -178.25 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.5 t -73.28 -25.15 60.56 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.752 -1.118 . . . . 2.1099999999999999 112.647 -178.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.7 mt -69.45 -36.11 76.3 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.562 1.073 . . . . 0.92000000000000004 112.274 170.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.449 HG21 ' CZ2' ' B' ' 183' ' ' TRP . 21.4 mm -48.23 -44.11 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 CA-C-N 120.336 1.425 . . . . 0.79000000000000004 111.408 177.285 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.45 -15.1 44.72 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 124.159 0.885 . . . . 0.73999999999999999 114.998 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.86 -19.81 60.71 Favored Glycine 0 CA--C 1.533 1.161 0 CA-C-N 118.741 1.27 . . . . 0.71999999999999997 114.077 172.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.0 mp -99.13 -52.49 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-N 119.139 1.47 . . . . 0.92000000000000004 109.24 170.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.1 m -73.91 59.23 0.69 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 128.225 2.61 . . . . 1.45 108.387 167.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -146.11 -69.63 0.01 OUTLIER Glycine 0 CA--C 1.525 0.692 0 C-N-CA 126.711 2.1 . . . . 1.0700000000000001 109.299 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -58.0 -50.88 9.0 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.273 2.649 . . . . 1.52 112.742 173.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.9 pp -90.8 -11.82 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 113.827 1.047 . . . . 1.46 113.827 -175.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.58 -29.99 70.66 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 120.842 -1.161 . . . . 1.74 113.448 -174.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -37.74 67.42 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.036 -1.04 . . . . 3.6299999999999999 113.792 168.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.6 tt -56.58 -40.35 75.09 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.829 1.252 . . . . 2.02 110.807 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 57.0 mt -47.92 -62.8 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.059 1.344 . . . . 1.3799999999999999 110.1 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -73.24 -24.82 60.52 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.966 -1.084 . . . . 1.8100000000000001 112.794 -174.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -67.65 -27.89 67.24 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-O 118.489 -0.767 . . . . 3.6400000000000001 110.136 168.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -90.27 -38.59 13.31 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.328 1.851 . . . . 2.3199999999999998 115.745 178.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -61.37 -2.66 0.74 Allowed 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 121.47 1.941 . . . . 2.2000000000000002 112.054 167.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -112.0 -88.56 0.53 Allowed 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.129 1.771 . . . . 1.9199999999999999 111.838 165.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.13 18.91 0.09 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.117 2.967 . . . . 3.8999999999999999 115.24 -176.407 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.1 m -141.27 16.76 2.24 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.778 2.031 . . . . 6.7599999999999998 110.074 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 9.9 m -178.39 86.09 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 128.361 2.664 . . . . 8.0899999999999999 105.74 -174.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 67.3 m . . . . . 0 C--O 1.25 1.129 0 C-N-CA 126.341 1.856 . . . . 10.23 109.626 -137.265 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 67.3 m . . . . . 0 N--CA 1.473 0.719 0 CA-C-O 118.319 -0.848 . . . . 8.4700000000000006 109.343 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -71.75 -128.23 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 107.912 -1.144 . . . . 6.9000000000000004 107.912 137.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 41.8 t -104.0 -49.13 3.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.065 1.346 . . . . 4.8399999999999999 111.141 172.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.523 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 85.8 m-85 79.06 120.69 0.05 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 129.059 2.944 . . . . 2.6699999999999999 110.168 -156.412 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 81.3 p -64.14 156.8 27.32 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 121.372 -0.83 . . . . 1.22 110.373 171.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 110' ' ' GLU . . . . . 0.615 ' HG2' HG21 ' A' ' 14' ' ' VAL . 1.5 tp10 -60.38 -19.52 56.08 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.219 0.463 . . . . 2.71 111.49 171.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -44.9 66.07 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.599 1.56 . . . . 1.01 111.369 172.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.37 -44.57 62.38 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 117.69 -1.147 . . . . 2.9399999999999999 111.634 173.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 113' ' ' LYS . . . . . 0.407 ' O ' HG23 ' B' ' 117' ' ' VAL . 1.7 mmmp? -43.83 -48.05 8.23 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.621 1.555 . . . . 4.6600000000000001 111.088 165.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -66.21 -53.36 38.18 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 118.045 -0.978 . . . . 0.81000000000000005 113.606 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 42.6 t -52.84 -46.61 52.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 CA-C-N 119.707 1.14 . . . . 0.92000000000000004 111.131 174.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 93.8 mt -53.16 -52.35 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.846 1.258 . . . . 1.3799999999999999 110.926 170.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 117' ' ' VAL . . . . . 0.618 HG21 ' HG2' ' A' ' 7' ' ' GLU . 21.8 t -67.62 -37.96 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-N 119.97 1.259 . . . . 0.56000000000000005 112.543 -175.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -61.78 -41.86 98.26 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.062 0.945 . . . . 0.98999999999999999 111.055 175.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 72.9 t -75.07 -40.44 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.886 1.274 . . . . 0.81999999999999995 112.302 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -51.93 -56.42 14.24 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.724 1.21 . . . . 3.0800000000000001 110.086 170.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -69.78 -15.08 63.06 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.811 1.041 . . . . 3.0099999999999998 113.811 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -83.79 -60.85 1.99 Allowed 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.406 -0.809 . . . . 2.02 113.103 172.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -58.34 -32.9 68.96 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.66 -0.65 . . . . 2.3399999999999999 112.16 -174.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -41.24 -44.54 2.67 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.102 1.761 . . . . 2.6699999999999999 114.293 169.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -89.16 -29.52 19.26 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.46 0.704 . . . . 2.2599999999999998 112.282 -176.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 56.1 t -66.89 -47.4 82.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.217 1.807 . . . . 3.3900000000000001 111.991 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 63.9 p 153.27 -77.81 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 130.064 3.346 . . . . 3.77 109.836 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 14.9 tttp -179.06 -71.55 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.881 2.072 . . . . 5.2599999999999998 110.09 -167.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -120.16 -7.98 9.78 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 115.186 1.55 . . . . 6.7999999999999998 115.186 -169.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 29.0 t -128.83 135.87 49.71 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 119.869 -1.769 . . . . 5.0099999999999998 112.39 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 85.9 mt -81.18 -53.68 6.17 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.922 1.289 . . . . 8.3800000000000008 112.998 -172.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 132' ' ' VAL . . . . . 0.441 HG12 ' H ' ' B' ' 177' ' ' ILE 0.28 29.1 m -85.8 54.17 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 CA-C-O 124.634 2.159 . . . . 4.3399999999999999 112.574 -178.749 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.18 -2.84 39.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 111.158 -2.746 . . . . 7.4800000000000004 113.789 166.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 60.5 t30 35.19 64.36 0.45 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.478 2.711 . . . . 8.8699999999999992 114.197 172.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 20.8 tptt -165.77 -19.04 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.855 1.262 . . . . 8.8800000000000008 114.373 177.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.7 tt -69.68 157.28 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 N-CA-C 107.544 -1.28 . . . . 3.0899999999999999 107.544 136.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 6.2 m -161.79 162.82 29.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 124.354 1.062 . . . . 3.5299999999999998 110.273 173.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 30.3 pttt -50.98 -11.06 0.08 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 128.301 2.64 . . . . 2.6600000000000001 117.066 -179.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.0 m -80.99 -27.9 35.73 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 119.706 -1.872 . . . . 2.1299999999999999 114.418 166.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 26.8 m -76.86 -46.4 24.81 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.572 -1.33 . . . . 1.3200000000000001 112.058 -169.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -51.23 -50.16 59.68 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.513 1.125 . . . . 2.4199999999999999 112.438 175.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -65.01 -12.28 48.57 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.979 1.103 . . . . 3.5299999999999998 113.979 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -98.37 -43.67 6.83 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 120.171 1.351 . . . . 2.48 111.225 170.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 63.2 ttp -54.04 -41.85 68.54 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.279 1.831 . . . . 2.9100000000000001 112.479 177.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 11.7 mt -59.86 -29.3 68.2 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.913 -1.117 . . . . 1.53 113.625 172.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -80.48 -9.82 59.76 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.901 1.281 . . . . 2.6099999999999999 112.885 176.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.99 -64.72 1.01 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.551 1.14 . . . . 1.55 111.366 167.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -75.85 -13.71 60.28 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.557 -1.339 . . . . 3.1899999999999999 114.279 -172.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.2 18.13 9.12 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.104 1.362 . . . . 1.6699999999999999 112.748 177.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -53.75 -28.45 34.58 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 115.365 1.617 . . . . 1.26 115.365 -171.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -66.98 -25.89 66.54 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 114.128 1.159 . . . . 1.6200000000000001 114.128 -169.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 68.1 mtm -105.14 11.59 32.99 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.407 1.083 . . . . 2.5 112.598 171.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 153' ' ' LEU . . . . . 0.453 HD23 ' H ' ' B' ' 154' ' ' SER . 0.2 OUTLIER -99.21 -163.76 1.07 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.448 1.899 . . . . 2.3999999999999999 110.398 -178.701 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.453 ' H ' HD23 ' B' ' 153' ' ' LEU . 5.3 t 70.53 -23.16 0.17 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.235 1.814 . . . . 7.0899999999999999 113.988 -177.576 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -65.54 16.67 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 128.309 2.644 . . . . 7.0099999999999998 114.638 177.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 98.8 m 62.41 -65.83 0.09 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 128.853 2.861 . . . . 4.1900000000000004 113.548 -179.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -54.01 -40.52 66.15 Favored Glycine 0 N--CA 1.468 0.825 0 C-N-CA 125.543 1.544 . . . . 2.4399999999999999 112.692 -172.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -43.74 -67.5 0.27 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.77 1.628 . . . . 4.1600000000000001 112.232 168.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 25.0 ttt-85 -73.79 -29.58 62.26 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.105 -0.997 . . . . 5.04 112.528 -173.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -61.19 -42.42 98.55 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.574 -1.328 . . . . 3.1400000000000001 112.137 171.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.12 -37.61 74.91 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.55 0.944 . . . . 1.23 113.55 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -58.02 -47.18 83.84 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.851 1.26 . . . . 0.95999999999999996 112.856 173.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.06 -23.59 60.58 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.438 -0.789 . . . . 3.3999999999999999 112.906 -173.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -54.5 -36.64 64.4 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.683 -0.635 . . . . 3.02 112.058 164.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 7.4 mt -73.76 -46.04 48.11 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.523 -0.762 . . . . 1.04 110.712 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 7.1 mm -60.31 -42.73 91.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.691 0.678 . . . . 1.26 112.002 -175.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -68.65 -36.46 78.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.486 1.114 . . . . 1.98 113.223 177.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -70.24 -37.62 75.01 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.06 1.344 . . . . 2.8399999999999999 111.57 174.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 10.5 tp -74.48 -32.74 62.65 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.62 1.168 . . . . 2.5800000000000001 111.506 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -46.4 -54.58 8.83 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 125.822 1.649 . . . . 4.0300000000000002 112.808 -172.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -61.53 -4.95 1.52 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.337 1.855 . . . . 2.27 115.771 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -121.35 -2.76 9.49 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.526 1.13 . . . . 2.27 113.423 -176.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 66.7 m80 -137.15 89.61 2.45 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.889 -1.132 . . . . 3.6099999999999999 111.978 -167.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.78 29.32 0.09 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.581 2.752 . . . . 4.75 114.564 -167.051 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.35 32.23 58.22 Favored Glycine 0 CA--C 1.534 1.24 0 O-C-N 120.268 -1.52 . . . . 2.5699999999999998 110.557 -149.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 47.1 mmt-85 -103.23 151.32 22.79 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.231 1.812 . . . . 5.9100000000000001 107.388 161.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 177' ' ' ILE . . . . . 0.441 ' H ' HG12 ' B' ' 132' ' ' VAL . 33.2 mm -144.49 140.78 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 127.281 2.232 . . . . 2.2400000000000002 106.713 -172.241 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.1 t -119.81 171.3 8.51 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.754 0.788 . . . . 1.97 112.559 171.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -77.99 -46.46 21.0 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.062 0.945 . . . . 2.4300000000000002 112.327 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -71.2 -23.6 62.06 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.473 1.909 . . . . 2.7799999999999998 113.213 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -48.51 -60.5 2.64 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 127.083 2.153 . . . . 3.1800000000000002 111.061 175.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -57.17 -46.21 83.01 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.299 -0.876 . . . . 1.95 111.602 -179.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 183' ' ' TRP . . . . . 0.449 ' CZ2' HG21 ' A' ' 83' ' ' ILE . 19.9 t-105 -61.86 -46.19 90.52 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.366 0.666 . . . . 1.0600000000000001 112.395 -178.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 6.5 t -69.05 -36.75 78.04 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.803 0.729 . . . . 1.76 111.299 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 81.6 mt -61.18 -37.22 82.15 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.458 1.026 . . . . 0.71999999999999997 113.288 174.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 186' ' ' ILE . . . . . 0.486 HG21 ' CZ2' ' A' ' 80' ' ' TRP . 15.3 mm -49.51 -44.85 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 120.049 1.295 . . . . 0.91000000000000003 110.795 176.147 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -64.67 -13.13 55.23 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.607 1.098 . . . . 0.63 114.601 -177.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -83.41 -20.64 59.95 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-N 118.7 1.25 . . . . 0.79000000000000004 113.906 170.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 5.1 mp -96.06 -55.56 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 119.429 1.615 . . . . 1.0900000000000001 108.797 171.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 27.6 m -73.11 59.17 0.52 Allowed 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 128.638 2.775 . . . . 1.48 108.555 169.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -142.84 -72.11 0.03 OUTLIER Glycine 0 CA--C 1.525 0.717 0 C-N-CA 126.882 2.182 . . . . 1.05 108.458 175.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -58.94 -51.27 7.17 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.208 2.605 . . . . 1.4399999999999999 113.169 174.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.0 pp -87.18 -10.77 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.5 1.046 . . . . 1.5800000000000001 113.087 -175.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.06 -31.04 70.41 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 120.975 -1.078 . . . . 1.71 113.054 -173.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 195' ' ' LYS . . . . . 0.411 ' HB2' ' HE3' ' B' ' 195' ' ' LYS . 0.0 OUTLIER -56.59 -36.75 69.72 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 117.815 -1.088 . . . . 3.3900000000000001 113.048 172.588 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.7 tt -55.98 -40.15 72.86 Favored 'General case' 0 C--O 1.217 -0.605 0 C-N-CA 124.342 1.057 . . . . 2.4100000000000001 110.671 -177.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 88.2 mt -48.4 -61.71 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.63 1.172 . . . . 1.25 110.869 171.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -65.54 -34.97 79.5 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 121.595 -0.691 . . . . 1.8100000000000001 111.729 -176.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -68.49 -21.3 64.62 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 118.728 -0.653 . . . . 3.5499999999999998 110.769 176.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -91.85 -38.77 12.13 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.063 1.745 . . . . 2.2799999999999998 114.751 173.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -59.98 -6.69 1.41 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 121.229 1.831 . . . . 2.3999999999999999 112.208 164.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 202' ' ' GLN . . . . . 0.405 ' OE1' ' HE3' ' A' ' 25' ' ' LYS . 45.6 mm-40 -104.65 -93.32 0.35 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.453 1.501 . . . . 2.1899999999999999 112.105 162.527 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.3 24.09 0.26 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 128.424 2.689 . . . . 3.98 113.934 -172.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 15.1 m -139.94 22.86 2.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 127.853 2.461 . . . . 6.9400000000000004 109.454 -170.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 21.4 m -175.23 71.42 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.984 2.114 . . . . 8.5399999999999991 107.916 -175.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 33.2 m . . . . . 0 C--O 1.252 1.2 0 C-N-CA 125.837 1.655 . . . . 10.050000000000001 111.197 -150.0 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 N--CA 1.473 0.691 0 N-CA-C 106.294 -1.743 . . . . 10.4 106.294 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.76 -116.52 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 107.744 -1.206 . . . . 6.8399999999999999 107.744 127.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 85.0 m -75.62 -113.52 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.849 0 O-C-N 120.325 -1.485 . . . . 4.3600000000000003 108.723 159.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.5 m-30 123.97 155.03 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.162 1 C-N-CA 132.886 4.474 . . . . 2.1200000000000001 111.747 -174.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.8 p -73.68 159.19 33.38 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.807 0.843 . . . . 1.25 110.351 169.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -64.95 -20.52 66.51 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.702 -0.624 . . . . 2.54 111.661 170.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.89 -45.76 77.02 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 118.749 -0.643 . . . . 0.93999999999999995 109.926 173.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.16 -49.68 66.56 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 117.331 -1.318 . . . . 3.4700000000000002 112.187 172.143 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -41.6 -48.46 4.03 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 121.045 1.748 . . . . 5.04 112.273 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.787 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -72.71 -47.31 48.15 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-O 117.306 -1.33 . . . . 0.64000000000000001 112.727 -177.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.64 -40.42 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 CA-C-N 121.14 1.791 . . . . 0.63 110.619 173.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 88.4 mt -54.17 -58.46 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.207 1.003 . . . . 1.0700000000000001 110.696 168.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.9 t -61.58 -35.15 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 125.542 1.537 . . . . 0.68999999999999995 112.964 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -69.71 -39.17 77.03 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.85 0.86 . . . . 1.02 110.515 175.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 68.6 t -75.56 -34.41 29.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.024 0.929 . . . . 0.71999999999999997 111.339 178.098 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -61.64 -45.5 93.76 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 124.916 1.286 . . . . 3.0499999999999998 111.262 168.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -58.56 -23.54 58.71 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.612 0.967 . . . . 2.1499999999999999 113.612 174.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -82.98 -60.87 2.02 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.822 -1.174 . . . . 2.1499999999999999 112.489 170.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -69.07 -13.74 62.61 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.761 1.023 . . . . 2.0 113.761 -174.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.5 mttp -31.83 -48.24 0.15 Allowed 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 127.872 2.469 . . . . 2.2799999999999998 112.851 162.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -98.38 6.22 47.48 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.543 1.137 . . . . 2.3599999999999999 112.664 -171.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.2 t -112.41 131.61 63.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.552 1.141 . . . . 2.8900000000000001 110.189 -170.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -47.83 -45.71 30.18 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.13 1.372 . . . . 3.4900000000000002 112.279 -178.171 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.74 -45.9 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.701 1.601 . . . . 5.25 110.669 163.27 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -144.02 -50.89 0.31 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.31 0.644 . . . . 7.4699999999999998 111.375 174.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.3 m 65.54 -2.33 0.85 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 126.72 2.008 . . . . 4.29 115.091 168.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.1 mt 56.12 -78.74 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 128.986 2.915 . . . . 6.8099999999999996 111.95 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.8 p -177.63 21.13 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.006 0 C-N-CA 128.747 2.819 . . . . 5.3499999999999996 111.919 -157.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -77.1 -22.28 52.99 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 119.526 -1.984 . . . . 9.8000000000000007 115.399 -174.044 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 164.27 -59.31 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 129.657 3.183 . . . . 8.9900000000000002 107.237 -168.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 44.8 tttt 67.66 -101.1 0.06 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.918 1.287 . . . . 10.4 111.823 160.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 42.6 pt -133.4 130.82 57.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 120.764 1.62 . . . . 2.46 110.109 174.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.5 m -66.14 140.66 58.23 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.561 -1.337 . . . . 2.4399999999999999 111.549 178.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -61.95 -17.74 57.95 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.342 1.238 . . . . 2.7999999999999998 114.342 -169.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.0 p -54.37 -33.34 58.96 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.802 -1.186 . . . . 2.1200000000000001 112.231 168.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.1 m -60.05 -25.59 65.47 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.644 -1.285 . . . . 1.55 113.737 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 54.7 t80 -65.5 -62.51 1.48 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.308 1.413 . . . . 2.0899999999999999 111.441 175.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -58.26 -21.92 50.41 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.202 1.001 . . . . 2.25 112.653 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.405 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 25.5 mt-10 -93.23 -44.74 8.18 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 124.662 1.185 . . . . 3.8399999999999999 113.459 -174.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -32.1 68.04 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.593 1.088 . . . . 1.55 111.137 163.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.6 mt -66.24 -19.23 65.76 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 115.576 1.695 . . . . 1.04 115.576 169.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.41 -24.4 13.48 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.963 1.256 . . . . 3.1299999999999999 113.475 171.329 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 1.6 mppt? -86.07 -48.2 8.85 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.78 1.232 . . . . 2.6200000000000001 110.639 -178.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -86.77 -36.97 18.28 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.235 1.014 . . . . 2.9300000000000002 112.238 -178.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.3 mt -103.75 50.04 0.81 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.035 0.934 . . . . 2.5699999999999998 111.883 173.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -68.17 36.3 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 125.575 1.55 . . . . 2.1000000000000001 113.61 175.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -136.42 -96.03 0.23 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.577 1.951 . . . . 1.9399999999999999 110.745 -159.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.1 ptp -56.57 -20.23 19.77 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.638 1.563 . . . . 2.6299999999999999 114.436 174.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.2 mp -80.65 64.23 5.36 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 123.801 1.762 . . . . 3.5299999999999998 110.25 162.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.1 m -79.83 -10.74 59.82 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 113.036 -1.893 . . . . 3.9199999999999999 114.425 -158.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -151.96 164.77 36.47 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.659 1.584 . . . . 4.5999999999999996 109.639 160.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.5 m -34.47 -44.15 0.19 Allowed 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 129.443 3.097 . . . . 2.6400000000000001 112.805 160.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.34 -32.09 79.62 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 117.653 -1.637 . . . . 2.2400000000000002 114.39 -179.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -78.6 -47.67 16.67 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.214 1.507 . . . . 2.9100000000000001 109.679 170.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -48.73 -29.62 4.68 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.421 1.889 . . . . 5.3799999999999999 115.571 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.7 mtmt -48.36 -34.42 10.68 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.933 -1.104 . . . . 4.6900000000000004 113.838 168.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.59 -16.49 63.41 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.54 1.311 . . . . 1.0700000000000001 114.54 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.07 -49.01 8.64 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.719 0.808 . . . . 0.89000000000000001 111.67 168.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.0 -31.5 72.43 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 112.916 0.709 . . . . 2.4399999999999999 112.916 -179.135 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -57.31 -28.84 63.42 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.105 -0.997 . . . . 2.5800000000000001 112.703 174.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 45.9 mt -78.32 -30.52 48.31 Favored 'General case' 0 C--O 1.224 -0.238 0 O-C-N 121.637 -0.664 . . . . 0.91000000000000003 111.404 -178.252 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.5 mm -66.25 -49.02 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 123.94 0.896 . . . . 0.91000000000000003 110.13 -178.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.57 -37.22 85.32 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.94 1.296 . . . . 2.9900000000000002 113.061 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -65.88 -25.05 67.0 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.382 1.473 . . . . 2.5600000000000001 113.979 171.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -87.94 -80.06 0.28 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 117.715 -1.136 . . . . 2.4100000000000001 109.842 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -50.64 -34.7 27.24 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.437 1.471 . . . . 3.5899999999999999 114.771 -158.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -54.37 -18.86 4.57 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 115.249 1.574 . . . . 3.75 115.249 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -132.48 5.48 4.04 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.541 1.936 . . . . 3.73 113.866 168.105 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -141.4 9.79 2.06 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 116.144 1.905 . . . . 4.6799999999999997 116.144 -164.325 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -51.76 145.34 9.65 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.504 1.521 . . . . 7.1799999999999997 112.869 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 71.47 -22.91 0.64 Allowed Glycine 0 CA--C 1.535 1.334 0 C-N-CA 126.333 1.92 . . . . 2.6400000000000001 114.795 -173.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -94.39 135.11 36.17 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.294 1.437 . . . . 5.4900000000000002 110.893 -178.145 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.2 mm -147.07 111.98 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.975 1.71 . . . . 2.46 107.446 177.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.4 m -85.3 -158.87 0.4 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.302 1.441 . . . . 2.3700000000000001 111.334 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -109.03 -57.18 2.19 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 119.685 -1.884 . . . . 2.1499999999999999 109.988 170.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -52.32 -25.77 10.47 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 131.407 3.883 . . . . 3.0800000000000001 114.269 170.057 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -51.21 -59.21 4.44 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.422 1.489 . . . . 3.04 111.444 170.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -51.04 -44.71 61.11 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.6 -0.688 . . . . 2.3799999999999999 111.623 176.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 28.4 t-105 -64.52 -46.8 81.36 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.485 -0.769 . . . . 0.57999999999999996 111.996 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.9 t -74.47 -22.88 58.87 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 117.683 -1.151 . . . . 1.79 113.407 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.41 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 84.5 mt -65.68 -44.83 85.01 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.931 1.241 . . . . 0.62 110.331 169.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 27.4 mm -48.96 -43.87 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 CA-C-N 119.94 1.245 . . . . 0.70999999999999996 112.667 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.77 -19.51 43.55 Favored Glycine 0 CA--C 1.537 1.449 0 CA-C-N 119.468 1.031 . . . . 0.68000000000000005 114.07 177.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.11 -19.19 71.79 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 118.885 1.342 . . . . 0.64000000000000001 114.188 172.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -118.41 -43.1 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 CA-C-N 119.117 1.459 . . . . 0.96999999999999997 110.325 175.721 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 17.6 m -77.26 52.67 0.94 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.223 1.809 . . . . 1.4399999999999999 109.749 166.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.68 -64.39 0.03 OUTLIER Glycine 0 CA--C 1.528 0.862 0 C-N-CA 126.955 2.216 . . . . 1.1299999999999999 109.912 179.167 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -63.28 -59.15 0.24 Allowed 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.204 2.603 . . . . 1.23 112.624 173.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.1 pt -78.04 -17.55 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 114.028 1.121 . . . . 1.1799999999999999 114.028 -173.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.55 -37.46 75.74 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.308 -0.87 . . . . 1.01 112.505 -173.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt -60.91 -29.42 69.58 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 120.639 -1.288 . . . . 5.0999999999999996 113.238 176.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.8 tt -77.85 -23.05 49.04 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.444 1.498 . . . . 1.6000000000000001 112.963 178.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.3 mt -51.75 -48.64 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 118.955 0.798 . . . . 0.95999999999999996 110.466 168.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.41 -33.86 73.1 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 114.194 1.183 . . . . 3.9700000000000002 114.194 -179.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.83 -55.65 24.37 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.328 1.051 . . . . 5.6799999999999997 111.71 172.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -56.56 -46.05 80.95 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.865 0.866 . . . . 2.6400000000000001 113.299 -175.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -80.29 2.41 24.73 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.677 0.791 . . . . 2.9100000000000001 111.797 -175.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.85 -51.03 3.52 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.734 0.813 . . . . 1.95 111.041 162.389 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -58.06 -22.29 49.53 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.642 0.978 . . . . 4.6500000000000004 113.642 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.6 t -115.29 22.92 12.87 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.905 1.682 . . . . 8.3699999999999992 112.72 173.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.1 t -76.64 8.64 3.4 Favored 'General case' 0 CA--C 1.55 0.955 0 O-C-N 120.197 -1.564 . . . . 11.039999999999999 115.051 -176.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.254 1.308 0 C-N-CA 129.57 3.148 . . . . 13.81 110.106 -178.952 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 106.298 -1.741 . . . . 10.27 106.298 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -58.42 -118.03 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 108.086 -1.079 . . . . 6.8200000000000003 108.086 127.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 61.0 m -76.79 -116.17 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.545 1.538 . . . . 4.3200000000000003 108.753 157.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 132.76 155.77 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.174 1 C-N-CA 132.917 4.487 . . . . 2.21 112.695 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 66.1 p -71.66 150.57 44.45 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.312 0.645 . . . . 1.21 110.006 164.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -53.47 -36.9 62.15 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.312 1.045 . . . . 2.3399999999999999 111.097 175.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.61 -42.88 93.64 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.719 1.608 . . . . 0.84999999999999998 111.726 178.573 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -51.47 24.93 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 121.401 -0.812 . . . . 3.3500000000000001 110.323 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -55.14 -30.36 59.64 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.423 1.089 . . . . 5.1100000000000003 112.125 172.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.787 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -72.65 -44.26 62.1 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.563 -1.335 . . . . 0.55000000000000004 113.221 170.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 54.0 t -59.18 -39.33 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 120.877 1.671 . . . . 0.62 109.834 172.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 63.1 mt -54.77 -57.79 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.853 -1.07 . . . . 0.84999999999999998 110.824 167.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 5.6 t -56.55 -39.35 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 CA-C-N 120.502 1.501 . . . . 0.65000000000000002 113.035 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.67 -40.42 84.46 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.359 -0.838 . . . . 1.03 111.953 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 68.7 t -72.74 -34.51 47.35 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.635 0 C-N-CA 123.51 0.724 . . . . 0.65000000000000002 110.987 177.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -65.22 -41.82 94.04 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.523 1.129 . . . . 3.0600000000000001 112.281 172.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 121' ' ' ASN . . . . . 0.421 HD21 ' CG ' ' B' ' 144' ' ' MET . 40.0 t30 -58.67 -24.03 60.48 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.961 -1.087 . . . . 2.1600000000000001 113.603 173.418 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -84.67 -61.12 1.87 Allowed 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.13 -0.981 . . . . 2.1499999999999999 112.674 172.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -68.1 -14.67 63.15 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.44 0.904 . . . . 2.0699999999999998 113.44 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mttp -32.61 -48.14 0.18 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 127.156 2.182 . . . . 2.23 113.349 164.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -97.64 6.78 47.53 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.371 1.468 . . . . 2.1899999999999999 113.235 -172.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 45.9 t -109.63 135.29 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.238 1.015 . . . . 2.7999999999999998 109.982 -171.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.3 m -48.7 -44.32 37.92 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.672 1.189 . . . . 3.52 112.286 -178.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.01 -42.42 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.599 1.96 . . . . 5.25 111.235 166.434 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -145.8 -53.85 0.27 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.871 0.869 . . . . 7.29 111.223 171.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 22.5 m 65.11 -9.44 0.2 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 127.046 2.138 . . . . 4.3899999999999997 115.667 170.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 77.9 mt 59.25 -73.75 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 129.713 3.205 . . . . 6.7400000000000002 112.349 179.069 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 3.8 p -177.06 7.95 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.072 0 C-N-CA 127.835 2.454 . . . . 5.4400000000000004 113.112 -153.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -72.62 -21.58 61.09 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 119.742 -1.849 . . . . 9.4000000000000004 115.898 -173.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 169.42 -60.28 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 128.975 2.91 . . . . 8.8499999999999996 107.713 -170.455 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 37.9 tttt 65.03 -107.95 0.16 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 117.633 -1.175 . . . . 10.300000000000001 110.807 162.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 31.6 pt -131.37 131.76 63.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-N 120.717 1.599 . . . . 2.4500000000000002 109.375 176.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 15.2 m -64.47 140.76 58.9 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.171 -0.956 . . . . 2.3999999999999999 112.212 178.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -60.71 -16.73 42.73 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.606 1.335 . . . . 2.6099999999999999 114.606 -169.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 14.3 p -56.76 -33.95 67.11 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.583 -1.323 . . . . 2.0299999999999998 112.48 168.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 63.9 m -57.93 -28.47 64.31 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.862 -1.149 . . . . 1.46 113.293 174.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.449 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 73.8 t80 -62.14 -63.15 1.34 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.295 1.407 . . . . 1.98 111.735 175.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -60.1 -20.8 60.02 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.585 0.754 . . . . 2.0299999999999998 112.02 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 143' ' ' GLU . . . . . 0.424 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 26.7 mt-10 -90.24 -50.26 6.08 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 117.8 -1.095 . . . . 3.6200000000000001 112.482 -175.193 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 144' ' ' MET . . . . . 0.421 ' CG ' HD21 ' B' ' 121' ' ' ASN . 0.0 OUTLIER -55.06 -32.07 61.63 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.092 0.86 . . . . 1.3700000000000001 111.54 164.248 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 10.0 mt -61.05 -52.26 65.69 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.247 -0.908 . . . . 1.0900000000000001 112.039 168.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.03 -18.95 60.78 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.643 1.11 . . . . 3.1200000000000001 113.242 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 147' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 2.0 mppt? -92.02 -48.66 6.63 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.972 1.309 . . . . 2.46 111.232 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -93.57 -28.39 16.07 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.518 1.508 . . . . 2.9900000000000002 114.901 -175.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 60.0 mt -104.79 25.07 10.85 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.66 1.184 . . . . 1.9399999999999999 112.201 172.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -54.51 -10.4 0.41 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.84 2.056 . . . . 1.46 116.319 -173.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.64 -64.39 1.15 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.99 -1.069 . . . . 2.0600000000000001 110.509 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.7 ptp -59.26 -33.17 70.72 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.063 0.847 . . . . 3.0 113.005 170.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 2.3 mp -86.79 67.78 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 123.445 1.593 . . . . 3.8900000000000001 110.212 170.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 3.3 m -74.06 -11.16 60.24 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 112.873 -1.967 . . . . 4.1399999999999997 114.978 -157.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -175.72 164.99 3.05 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.298 2.239 . . . . 5.4299999999999997 110.301 178.176 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 9.3 m -29.15 -48.99 0.07 Allowed 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 130.167 3.387 . . . . 3.2799999999999998 113.861 160.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -63.75 -32.96 85.92 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-N 119.857 1.208 . . . . 2.52 113.863 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -77.44 -49.16 15.39 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.757 1.223 . . . . 2.77 109.202 170.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 17.4 ttp180 -50.08 -29.36 8.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.078 1.751 . . . . 4.96 114.78 179.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 32.9 mtmt -49.83 -30.68 10.25 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.34 1.427 . . . . 4.5300000000000002 114.308 170.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.68 -20.86 52.97 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.363 1.246 . . . . 0.93999999999999995 114.363 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -77.49 -52.5 8.97 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.151 0.887 . . . . 0.71999999999999997 110.675 162.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -61.98 -34.26 75.81 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.387 0.675 . . . . 2.0099999999999998 112.759 -175.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.35 -30.27 64.69 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.396 -0.815 . . . . 2.71 112.958 174.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 38.4 mt -74.8 -34.25 62.36 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.649 -0.657 . . . . 0.79000000000000004 111.244 -178.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 28.7 mm -61.84 -48.73 87.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.247 1.019 . . . . 0.87 110.479 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -64.91 -40.93 95.83 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.773 1.229 . . . . 2.9399999999999999 112.32 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -61.0 -26.11 67.37 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.053 1.341 . . . . 2.5600000000000001 113.838 171.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -83.58 -80.13 0.19 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 117.368 -1.301 . . . . 2.5099999999999998 109.465 169.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -50.08 -33.08 17.33 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 120.513 1.506 . . . . 3.46 114.602 -160.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -53.51 -21.01 5.57 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 115.274 1.583 . . . . 3.52 115.274 173.106 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -128.83 9.71 5.89 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.033 1.733 . . . . 3.4500000000000002 113.494 168.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.8 6.3 0.91 Allowed 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 116.397 1.999 . . . . 4.2000000000000002 116.397 -159.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -50.96 144.42 8.72 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 122.226 1.012 . . . . 7.0800000000000001 112.7 172.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 71.56 -20.44 0.8 Allowed Glycine 0 CA--C 1.535 1.313 0 C-N-CA 126.211 1.862 . . . . 2.73 114.925 -173.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -99.79 135.11 41.7 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.418 1.487 . . . . 5.3099999999999996 110.422 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.3 mm -145.22 113.71 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 107.023 -1.473 . . . . 2.8399999999999999 107.023 177.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 2.4 t -87.19 -173.14 4.27 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.678 1.126 . . . . 1.51 113.14 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -92.89 -56.62 2.93 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.031 -1.668 . . . . 2.1200000000000001 110.769 172.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -61.33 -23.55 65.81 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 129.048 2.939 . . . . 3.02 113.138 176.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -47.62 -58.92 3.68 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.492 1.517 . . . . 3.1499999999999999 110.856 167.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -51.99 -45.52 64.53 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 120.931 -1.106 . . . . 2.29 112.372 177.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.3 t-105 -65.82 -47.37 75.25 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.65 -0.69 . . . . 0.58999999999999997 111.875 -178.097 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 8.2 t -72.7 -24.1 60.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 117.684 -1.15 . . . . 1.72 112.975 177.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.449 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 82.5 mt -65.82 -45.24 83.02 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.882 1.219 . . . . 0.68999999999999995 110.815 170.255 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 34.9 mm -48.03 -43.42 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 CA-C-N 120.734 1.606 . . . . 0.75 112.51 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -58.59 -19.57 42.55 Favored Glycine 0 CA--C 1.538 1.476 0 CA-C-N 118.57 0.623 . . . . 0.72999999999999998 114.497 177.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.74 -19.36 79.24 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 118.619 1.209 . . . . 0.77000000000000002 114.147 174.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -117.1 -47.79 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 118.829 1.314 . . . . 1.1699999999999999 110.108 177.168 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 20.7 m -74.23 50.68 0.4 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.679 1.991 . . . . 1.5 109.573 166.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -138.97 -64.48 0.04 OUTLIER Glycine 0 CA--C 1.527 0.815 0 C-N-CA 127.022 2.249 . . . . 1.03 109.481 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -62.0 -54.44 1.5 Allowed 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.198 2.599 . . . . 1.23 112.8 172.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 4.2 pt -84.78 -19.38 8.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 N-CA-C 114.672 1.36 . . . . 1.24 114.672 -175.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -53.33 -43.0 67.31 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.963 0.905 . . . . 1.1899999999999999 112.498 -174.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -54.45 -27.93 40.77 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.167 1.173 . . . . 4.75 114.167 175.589 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.22 -19.07 61.78 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.443 1.897 . . . . 1.5600000000000001 111.735 178.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 98.2 mt -57.68 -43.71 84.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 O-C-N 120.062 -1.649 . . . . 1.51 110.561 166.595 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -74.89 -0.39 18.38 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 115.145 1.535 . . . . 3.98 115.145 177.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -88.63 -66.09 0.95 Allowed 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.568 1.147 . . . . 4.9400000000000004 111.2 153.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -54.65 -44.94 73.69 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 114.301 1.223 . . . . 2.3799999999999999 114.301 -167.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -80.86 10.71 4.66 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 123.026 1.393 . . . . 2.73 111.006 -175.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -114.65 -54.07 2.6 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.432 1.493 . . . . 2.5099999999999998 109.885 166.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -57.07 -19.11 17.36 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.153 2.181 . . . . 5.0800000000000001 113.887 178.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 34.4 t -123.97 28.76 6.7 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.324 1.849 . . . . 8.1799999999999997 112.187 172.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 42.4 t -76.51 3.4 11.39 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 119.885 -1.76 . . . . 11.01 115.044 179.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 38.4 t . . . . . 0 C--O 1.252 1.196 0 C-N-CA 128.097 2.559 . . . . 13.51 111.073 -176.961 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 CA--C 1.504 -0.821 0 N-CA-C 108.889 -0.782 . . . . 9.7300000000000004 108.889 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -136.88 -15.78 1.52 Allowed 'General case' 0 N--CA 1.472 0.661 0 O-C-N 124.997 1.436 . . . . 6.04 113.585 -134.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 71.4 m 66.39 20.33 10.96 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 127.264 2.226 . . . . 3.6299999999999999 115.364 164.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -42.0 125.95 3.08 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.394 1.877 . . . . 2.6699999999999999 114.517 -178.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.5 p -66.4 147.84 52.72 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.187 0.595 . . . . 1.5600000000000001 109.915 164.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -67.12 -17.8 65.03 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 119.276 -0.392 . . . . 2.2799999999999998 111.712 170.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.6 -48.94 62.86 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.617 1.098 . . . . 0.90000000000000002 110.062 173.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -51.39 66.99 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.421 -0.585 . . . . 3.3700000000000001 109.421 175.514 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -53.89 -37.1 63.39 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.764 0.653 . . . . 4.1900000000000004 112.764 176.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.778 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -62.58 -37.95 88.21 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 117.609 -1.186 . . . . 0.83999999999999997 112.896 172.304 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 16.8 t -58.52 -44.93 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-N 120.914 1.688 . . . . 0.96999999999999997 110.516 168.279 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.8 mt -54.69 -46.93 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 CA-C-N 118.765 0.711 . . . . 0.93000000000000005 110.663 172.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.477 HG21 ' HG2' ' B' ' 110' ' ' GLU . 42.0 t -69.09 -40.49 80.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 124.057 0.943 . . . . 0.66000000000000003 112.994 -176.384 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -62.74 -39.85 95.41 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.122 -0.986 . . . . 0.97999999999999998 111.051 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 84.1 t -74.76 -38.14 43.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.72 0.808 . . . . 0.64000000000000001 112.582 177.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -51.12 -52.16 46.43 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.015 0.926 . . . . 3.1699999999999999 109.848 168.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -60.38 -30.66 69.72 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.486 1.291 . . . . 2.0600000000000001 114.486 -175.47 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -80.81 -54.16 5.85 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.225 -0.922 . . . . 1.9199999999999999 111.812 175.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -69.63 -23.44 63.5 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.734 1.013 . . . . 2.1899999999999999 113.734 -174.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 42.2 pttt -60.74 -9.25 3.73 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 115.712 1.745 . . . . 2.3100000000000001 115.712 175.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -107.03 2.28 24.94 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.877 1.271 . . . . 2.3999999999999999 114.264 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.2 m -126.28 170.14 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 120.111 1.323 . . . . 2.5600000000000001 110.987 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -67.47 -30.18 69.82 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 116.024 1.861 . . . . 3.9199999999999999 116.024 -177.073 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 ttpm? 107.84 -30.65 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 131.297 3.839 . . . . 5.04 111.952 -160.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -143.02 101.7 3.87 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.536 1.534 . . . . 7.7699999999999996 112.617 -177.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 p -169.59 150.03 4.02 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.594 2.358 . . . . 4.5199999999999996 107.246 157.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 90.0 mt -75.21 -61.0 2.05 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 118.739 0.7 . . . . 7.9699999999999998 109.125 162.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.9 t -144.39 72.19 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 124.486 1.114 . . . . 5.0499999999999998 110.273 178.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -124.5 -21.97 4.76 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 118.122 -0.942 . . . . 8.4000000000000004 113.482 160.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -163.14 61.51 0.18 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.903 1.281 . . . . 7.04 111.116 178.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.46 169.9 14.06 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.505 1.122 . . . . 6.54 111.806 168.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.2 pt -75.59 140.59 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 O-C-N 120.985 -1.072 . . . . 2.79 110.28 163.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.0 m -92.97 152.15 19.5 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.624 -0.672 . . . . 2.9700000000000002 110.457 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.1 mtpt -52.48 -33.18 43.57 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.324 1.45 . . . . 2.5600000000000001 114.768 -176.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.3 t -69.59 -23.35 63.52 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.545 1.313 . . . . 2.2400000000000002 114.545 172.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.1 m -77.19 -44.48 29.99 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.85 1.205 . . . . 1.3200000000000001 111.385 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -51.49 -54.2 29.63 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.416 1.007 . . . . 1.9299999999999999 111.85 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -57.88 -27.03 62.9 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.91 1.078 . . . . 2.8700000000000001 113.91 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -94.98 -48.8 5.83 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.63 1.572 . . . . 2.8700000000000001 110.74 -171.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -49.5 -40.12 36.47 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.713 2.405 . . . . 1.3700000000000001 112.24 165.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 42' ' ' LEU . 7.1 mt -60.25 -20.27 58.22 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.948 1.462 . . . . 1.1100000000000001 114.948 176.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -92.82 -14.33 27.93 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.592 1.157 . . . . 2.2000000000000002 112.428 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.36 -53.54 3.89 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.553 1.141 . . . . 1.51 112.599 172.666 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -78.34 -16.7 57.43 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.55 -0.719 . . . . 2.4500000000000002 112.287 -174.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.51 24.88 9.66 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.427 1.891 . . . . 1.7 111.576 179.12 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -61.94 -39.09 90.87 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.405 2.002 . . . . 1.6200000000000001 116.405 -162.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.516 ' H ' ' CD2' ' A' ' 48' ' ' HIS . 0.5 OUTLIER -69.58 -19.8 63.66 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.975 1.262 . . . . 1.75 113.228 -174.036 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 52.0 tpp -77.64 -26.55 50.57 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.233 1.813 . . . . 2.0899999999999999 113.016 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.0 mp -56.75 111.57 1.05 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.069 0.948 . . . . 2.9100000000000001 110.399 174.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.2 m -100.73 -3.89 29.24 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.364 1.066 . . . . 3.6299999999999999 111.769 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -178.75 175.46 1.06 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 131.366 3.866 . . . . 3.8100000000000001 106.768 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -53.99 -26.08 24.21 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 117.021 -1.466 . . . . 3.6000000000000001 111.78 160.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -51.53 -39.96 46.23 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 127.344 2.402 . . . . 1.96 115.0 -174.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -57.07 -47.63 80.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 117.951 0.875 . . . . 3.7200000000000002 110.78 170.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -70.98 -32.24 69.03 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.392 0.677 . . . . 5.3700000000000001 112.207 175.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -58.84 -38.01 77.73 Favored 'General case' 0 N--CA 1.481 1.078 0 O-C-N 119.516 -1.99 . . . . 3.4300000000000002 111.334 173.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.77 -14.22 62.36 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.059 1.503 . . . . 1.23 115.059 172.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.64 -53.83 5.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.389 0.995 . . . . 0.93999999999999995 110.82 164.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.47 -34.98 69.58 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.965 0.906 . . . . 2.0600000000000001 112.866 -177.142 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -61.34 -24.31 66.36 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.682 0.993 . . . . 2.71 113.682 174.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.5 mt -78.63 -37.5 42.03 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.257 -0.902 . . . . 0.84999999999999998 111.135 174.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.4 mm -58.19 -44.6 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.196 0.998 . . . . 0.87 111.558 -176.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -67.22 -38.8 85.87 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.234 1.813 . . . . 2.27 113.173 176.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -62.56 -27.65 69.33 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.916 -0.49 . . . . 3.4199999999999999 111.972 172.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.4 mp -86.82 -19.89 28.33 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 113.565 0.95 . . . . 3.4300000000000002 113.565 174.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.49 -25.21 67.89 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 120.419 1.463 . . . . 3.6200000000000001 111.507 168.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.2 -10.79 59.79 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.474 1.287 . . . . 2.6400000000000001 114.474 170.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -136.79 -14.08 1.65 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.805 1.78 . . . . 2.71 115.805 -171.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -155.45 119.02 4.45 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 121.195 1.816 . . . . 3.3399999999999999 114.036 -159.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.9 40.28 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 130.375 3.47 . . . . 4.4400000000000004 116.563 -170.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.18 13.4 76.51 Favored Glycine 0 CA--C 1.537 1.415 0 O-C-N 119.502 -1.999 . . . . 4.9100000000000001 114.283 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -86.38 -171.51 3.59 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.212 1.405 . . . . 7.1299999999999999 108.303 155.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 41.9 pt -147.94 161.6 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.966 1.706 . . . . 4.6900000000000004 107.911 150.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.8 m -74.08 169.1 18.2 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 112.745 0.646 . . . . 2.3199999999999998 112.745 164.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -63.1 -52.91 60.79 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.07 -1.019 . . . . 1.97 111.069 169.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.6 -33.76 60.92 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 128.142 2.577 . . . . 3.0800000000000001 113.224 172.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.83 -38.99 76.7 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 118.44 -0.791 . . . . 4.1500000000000004 112.622 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -53.09 -47.31 68.67 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.655 1.571 . . . . 1.8 110.393 172.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 28.5 t-105 -64.55 -45.86 85.29 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 118.455 -0.783 . . . . 0.59999999999999998 111.987 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.13 -40.64 98.19 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.549 1.068 . . . . 1.6100000000000001 112.039 -177.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 91.1 mt -63.88 -34.11 77.2 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.839 -0.6 . . . . 0.62 112.1 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.45 -36.21 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 119.896 1.225 . . . . 0.64000000000000001 111.6 179.008 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.48 -18.02 67.25 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.929 1.252 . . . . 0.66000000000000003 114.41 178.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.47 -29.58 59.66 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-N 119.007 1.404 . . . . 0.84999999999999998 112.737 176.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.441 HD12 ' H ' ' A' ' 86' ' ' ILE . 2.8 mp -86.95 -45.14 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.264 1.026 . . . . 0.92000000000000004 109.537 168.228 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.4 m -82.55 57.28 3.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 127.546 2.338 . . . . 1.26 109.989 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -132.74 -67.56 0.08 OUTLIER Glycine 0 CA--C 1.527 0.793 0 C-N-CA 125.825 1.678 . . . . 0.73999999999999999 110.093 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -66.02 -51.77 1.11 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.269 2.646 . . . . 1.03 112.576 175.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.6 pt -71.84 -17.83 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 N-CA-C 113.95 1.093 . . . . 1.0900000000000001 113.95 -175.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -50.36 -55.73 14.38 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.763 0.825 . . . . 0.95999999999999996 111.994 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -61.84 -32.69 73.04 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 120.569 -1.332 . . . . 3.1600000000000001 113.168 176.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.0 tt -60.39 -40.79 92.17 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 121.146 1.794 . . . . 1.5600000000000001 111.024 178.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 74.7 mt -53.84 -54.46 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-O 122.156 0.979 . . . . 1.22 110.429 172.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -67.76 -28.38 67.57 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.228 -0.92 . . . . 1.72 113.279 -177.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -73.88 -29.2 61.96 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.597 1.159 . . . . 3.6200000000000001 111.356 173.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -74.16 -42.5 59.81 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.288 1.035 . . . . 2.1299999999999999 111.538 174.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -73.47 17.28 0.15 Allowed 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 123.736 1.731 . . . . 2.96 112.211 172.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -124.5 -67.87 0.89 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.522 1.529 . . . . 2.3900000000000001 110.398 161.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . 0.317 3.3 pt20 42.36 19.66 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 130.437 3.495 . . . . 4.6500000000000004 115.141 -171.52 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 3.3 m -146.94 29.26 1.0 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.977 2.511 . . . . 7.1699999999999999 109.093 -174.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.1 t -79.61 0.0 31.89 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 120.049 -1.657 . . . . 9.1899999999999995 114.849 -175.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 45.9 t . . . . . 0 C--O 1.252 1.188 1 C-N-CA 132.249 4.22 . . . . 11.0 107.461 -166.09 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 20.4 m . . . . . 0 CA--C 1.504 -0.8 0 N-CA-C 108.704 -0.85 . . . . 9.6199999999999992 108.704 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -135.51 -16.26 1.82 Allowed 'General case' 0 N--CA 1.47 0.568 0 O-C-N 124.935 1.397 . . . . 5.6600000000000001 113.549 -134.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 94.2 m 54.03 43.77 30.29 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.841 2.056 . . . . 3.8799999999999999 113.858 168.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -53.07 132.49 38.12 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.327 1.051 . . . . 2.8700000000000001 112.36 -179.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 8.3 p -62.68 152.3 35.84 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.223 -0.658 . . . . 1.22 109.223 173.056 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 110' ' ' GLU . . . . . 0.477 ' HG2' HG21 ' A' ' 14' ' ' VAL . 10.4 tp10 -63.85 -27.54 69.24 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 118.415 -0.802 . . . . 2.52 111.489 170.189 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.56 -46.46 85.8 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.759 1.618 . . . . 0.89000000000000001 109.83 176.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -50.15 32.2 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.597 -0.69 . . . . 2.9300000000000002 111.142 -177.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -48.74 -38.66 22.27 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.804 1.241 . . . . 4.9000000000000004 113.255 167.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.778 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -64.98 -42.9 94.14 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 120.783 -1.198 . . . . 0.76000000000000001 113.233 171.126 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 14.0 t -55.74 -42.58 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 CA-C-N 120.917 1.689 . . . . 1.1100000000000001 110.666 170.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 59.9 mt -56.4 -51.22 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 118.638 -0.696 . . . . 1.0800000000000001 110.189 172.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 36.1 t -65.79 -36.6 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.346 0.975 . . . . 0.55000000000000004 113.342 -176.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -64.26 -37.97 89.37 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.997 -1.064 . . . . 0.94999999999999996 111.44 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 89.3 t -83.21 -35.32 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 118.619 -0.705 . . . . 0.91000000000000003 112.396 -178.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -51.16 -54.98 20.33 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.511 1.125 . . . . 3.3300000000000001 109.634 165.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -57.78 -37.56 73.92 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 113.207 0.817 . . . . 2.0099999999999998 113.207 -176.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -76.59 -55.87 5.13 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 122.02 -0.425 . . . . 2.25 110.785 -177.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -68.15 -24.05 64.94 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.675 0.991 . . . . 2.23 113.675 -175.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -56.81 -16.21 6.17 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 120.979 1.718 . . . . 2.1200000000000001 115.137 176.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -90.69 -0.7 57.78 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.824 1.787 . . . . 2.1299999999999999 115.824 173.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.6 m -128.38 177.24 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 125.075 1.35 . . . . 2.6200000000000001 109.787 176.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.4 p -69.98 -28.97 65.96 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 116.666 -1.635 . . . . 3.8999999999999999 115.373 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 4.3 ttpm? 111.62 -26.82 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 130.879 3.672 . . . . 5.0899999999999999 111.852 -156.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -148.11 105.16 3.62 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.811 1.244 . . . . 7.8700000000000001 114.094 -173.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 3.8 p -168.63 149.31 4.63 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 127.572 2.349 . . . . 4.71 107.74 155.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 93.8 mt -74.87 -61.77 1.77 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 119.321 0.964 . . . . 7.7999999999999998 109.731 163.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 132' ' ' VAL . . . . . 0.418 HG13 ' HD2' ' B' ' 135' ' ' LYS . 21.3 t -147.21 71.22 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.128 1.371 . . . . 5.2199999999999998 109.002 -177.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -132.79 -15.29 2.7 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.168 1.387 . . . . 8.5 114.266 164.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -159.91 30.22 0.18 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.798 0.839 . . . . 7.1900000000000004 112.609 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 135' ' ' LYS . . . . . 0.418 ' HD2' HG13 ' B' ' 132' ' ' VAL . 0.0 OUTLIER -71.83 151.09 43.72 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 120.48 -1.388 . . . . 6.4500000000000002 111.956 176.071 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 28.5 pt -63.83 151.38 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 120.899 -1.125 . . . . 2.3100000000000001 111.092 176.279 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 20.6 m -91.26 155.14 18.77 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 120.396 -1.44 . . . . 2.6200000000000001 110.737 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -55.48 -30.75 61.16 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.016 0.926 . . . . 2.6400000000000001 113.118 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 39.3 t -69.18 -20.4 64.0 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 115.31 1.596 . . . . 2.3900000000000001 115.31 170.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 16.4 m -74.49 -41.46 60.67 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 120.638 1.563 . . . . 1.4199999999999999 111.444 176.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.463 ' CZ ' HD11 ' B' ' 145' ' ' LEU . 35.9 t80 -56.35 -53.46 57.08 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 118.906 0.776 . . . . 2.04 111.29 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.4 ptt180 -57.12 -23.62 48.41 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.109 0.964 . . . . 2.5800000000000001 113.092 178.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 tm-20 -99.48 -45.11 5.93 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.024 1.33 . . . . 2.9300000000000002 112.131 -173.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 11.9 tmm? -51.62 -36.44 45.83 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.062 1.745 . . . . 1.2 112.175 167.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 145' ' ' LEU . . . . . 0.463 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 12.4 mt -65.94 -12.4 54.5 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 115.917 1.821 . . . . 1.0600000000000001 115.917 172.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -86.26 -25.14 25.7 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 123.826 0.85 . . . . 2.2799999999999998 112.592 169.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.02 -61.39 1.41 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.761 1.624 . . . . 1.6200000000000001 112.45 -175.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -70.51 -16.12 62.86 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.604 0.761 . . . . 2.6400000000000001 111.658 -175.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.83 17.12 11.85 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.683 1.993 . . . . 1.73 113.472 177.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -49.49 -37.73 27.49 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.468 1.655 . . . . 1.78 115.468 -171.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 151' ' ' HIS . . . . . 0.439 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 12.3 m-70 -63.45 -28.46 69.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.882 1.273 . . . . 1.9399999999999999 113.917 -175.548 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 60.1 tpp -81.79 -22.88 36.89 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.177 1.391 . . . . 2.0499999999999998 113.421 -172.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 11.2 mp -58.13 116.32 3.47 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.251 1.42 . . . . 3.0099999999999998 111.024 176.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 45.9 m -97.46 -4.85 37.32 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.836 0.854 . . . . 3.7999999999999998 112.616 172.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 12.4 t70 175.71 179.23 0.16 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 129.939 3.295 . . . . 3.9500000000000002 106.694 -168.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 12.4 t -55.49 -26.23 41.5 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 116.931 -1.509 . . . . 3.5600000000000001 112.077 160.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -51.32 -46.1 52.23 Favored Glycine 0 N--CA 1.471 1.023 0 C-N-CA 126.468 1.985 . . . . 2.0 115.46 -171.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -53.81 -45.05 70.68 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.244 1.022 . . . . 3.6899999999999999 111.173 171.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.7 ttt-85 -74.13 -33.78 63.67 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.516 0.726 . . . . 5.0800000000000001 111.99 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 60.0 mmtt -56.62 -38.18 71.72 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 120.82 1.645 . . . . 3.3399999999999999 111.448 172.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -65.49 -14.46 61.06 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 115.089 1.515 . . . . 1.29 115.089 173.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -85.67 -50.62 7.05 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.565 1.075 . . . . 1.0 111.886 165.188 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.61 -37.63 76.29 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.957 0.903 . . . . 2.1400000000000001 112.458 -178.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -60.42 -25.29 65.85 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.506 0.928 . . . . 2.7000000000000002 113.506 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 15.6 mt -76.21 -37.7 57.41 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.13 -0.981 . . . . 0.80000000000000004 111.123 176.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 28.1 mm -57.13 -43.73 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.076 0.95 . . . . 0.85999999999999999 111.337 -175.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -69.32 -41.11 77.15 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.505 1.922 . . . . 2.4199999999999999 113.054 175.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -59.53 -27.18 65.97 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.862 -0.524 . . . . 3.5299999999999998 112.138 170.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 6.2 mp -86.57 -19.62 29.15 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 114.227 1.195 . . . . 3.29 114.227 174.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -22.71 67.04 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 120.296 1.407 . . . . 3.77 112.026 167.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -74.59 -9.56 58.69 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.309 1.225 . . . . 3.0099999999999998 114.309 168.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -138.0 -14.95 1.35 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 116.455 2.02 . . . . 2.77 116.455 -170.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -154.7 122.06 5.68 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 121.079 1.763 . . . . 3.1400000000000001 114.187 -159.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -71.75 41.81 0.08 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 128.936 2.894 . . . . 4.4299999999999997 116.034 -171.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 76.32 0.36 66.26 Favored Glycine 0 CA--C 1.534 1.269 0 O-C-N 119.996 -1.69 . . . . 5.0999999999999996 114.195 177.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -78.94 -175.47 4.53 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.309 1.444 . . . . 7.1200000000000001 108.826 160.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 16.6 pt -147.51 155.74 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 128.098 2.559 . . . . 4.4199999999999999 106.871 158.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 4.2 m -77.65 -177.53 4.86 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.464 0.706 . . . . 2.3100000000000001 112.687 165.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -69.51 -54.27 15.0 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 122.281 1.038 . . . . 2.1200000000000001 110.462 169.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.68 -37.35 18.3 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 128.99 2.916 . . . . 3.1400000000000001 113.7 172.019 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -66.96 -42.97 84.27 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.14 0.976 . . . . 4.7000000000000002 112.886 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -53.8 -47.4 70.86 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.362 -1.462 . . . . 1.8799999999999999 111.176 173.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 28.7 t-105 -63.41 -45.07 92.69 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 118.621 -0.704 . . . . 0.70999999999999996 111.484 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.91 -41.71 97.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.734 0.814 . . . . 1.52 111.569 -179.583 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.424 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 87.0 mt -64.82 -33.44 76.01 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.399 -0.81 . . . . 0.63 112.446 179.338 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 36.8 mm -56.98 -34.66 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 CA-C-N 120.698 1.59 . . . . 0.59999999999999998 111.823 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.66 -20.19 69.89 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 124.292 0.949 . . . . 0.66000000000000003 114.079 176.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.78 -27.6 68.74 Favored Glycine 0 CA--C 1.529 0.916 0 CA-C-N 118.282 1.041 . . . . 0.72999999999999998 113.218 177.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -89.82 -42.75 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.446 1.099 . . . . 0.95999999999999996 110.127 167.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 6.2 m -83.14 57.34 3.89 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.935 2.094 . . . . 1.3100000000000001 110.5 -177.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -126.17 -71.64 0.19 Allowed Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.831 1.682 . . . . 0.71999999999999997 110.57 177.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.5 -44.19 1.15 Allowed 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 123.017 2.478 . . . . 1.0600000000000001 112.71 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 12.9 pt -72.0 -22.35 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 119.091 0.859 . . . . 1.1000000000000001 113.128 -173.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -45.41 -62.65 1.19 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.374 1.47 . . . . 1.0900000000000001 112.988 177.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -64.37 -26.82 68.64 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 120.539 -1.351 . . . . 3.6299999999999999 113.36 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.47 -41.78 97.76 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.796 1.634 . . . . 1.6599999999999999 110.621 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 53.4 mt -53.69 -56.06 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-O 121.867 0.842 . . . . 1.3999999999999999 110.682 170.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 43.4 t60 -63.19 -28.95 70.4 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.09 1.144 . . . . 1.8200000000000001 114.09 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -74.43 -28.24 60.97 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.796 1.238 . . . . 3.71 111.657 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -74.72 -40.56 61.24 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.501 1.12 . . . . 2.25 111.164 171.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -73.2 19.59 0.09 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 126.662 1.985 . . . . 2.8799999999999999 112.293 170.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -127.97 -61.68 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 125.238 1.415 . . . . 2.6099999999999999 109.652 159.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.307 12.2 pt20 41.71 18.66 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 130.127 3.371 . . . . 4.9500000000000002 115.366 -171.831 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 1.9 m -146.59 27.49 1.11 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 127.769 2.428 . . . . 7.1299999999999999 109.607 -174.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 33.4 t -81.74 4.15 23.05 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 119.869 -1.769 . . . . 9.2200000000000006 114.211 -178.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 48.5 t . . . . . 0 C--O 1.251 1.135 1 C-N-CA 132.527 4.331 . . . . 10.76 107.303 -166.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.0 m . . . . . 0 CA--C 1.508 -0.642 0 CA-C-O 117.14 -1.409 . . . . 11.34 108.51 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 72.43 -53.01 0.7 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.957 2.206 . . . . 9.9399999999999995 116.957 130.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 21.2 m 136.62 -31.56 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 1 C-N-CA 134.064 4.946 . . . . 3.4199999999999999 109.304 -173.513 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.57 142.5 42.72 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.135 1.374 . . . . 2.8500000000000001 110.476 165.44 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 60.1 p -65.7 148.87 51.05 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 120.142 1.337 . . . . 1.1699999999999999 110.138 168.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -63.71 -36.65 84.56 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.743 -0.598 . . . . 2.0899999999999999 111.644 -175.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.72 -48.39 80.95 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.273 1.429 . . . . 1.3200000000000001 110.031 174.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -72.82 -43.52 62.58 Favored 'General case' 0 C--O 1.23 0.072 0 CA-C-N 118.142 0.428 . . . . 3.6699999999999999 111.442 -173.422 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -48.51 -42.86 34.34 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.921 1.288 . . . . 5.4100000000000001 111.432 163.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.416 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -71.96 -30.22 65.07 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 116.762 -1.59 . . . . 0.76000000000000001 114.511 175.247 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.7 t -55.59 -33.81 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 CA-C-N 122.447 2.385 . . . . 0.94999999999999996 111.095 167.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 16.8 mt -56.89 -63.34 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 CA-C-N 119.588 1.085 . . . . 1.3799999999999999 111.401 162.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.7 t -50.1 -43.31 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.095 1.358 . . . . 0.57999999999999996 113.279 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.4 mp -66.44 -39.93 89.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.541 1.136 . . . . 1.05 112.245 176.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.3 t -68.61 -45.98 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.906 0.883 . . . . 0.66000000000000003 110.258 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.3 tt0 -55.88 -44.86 78.54 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.364 0.529 . . . . 3.1200000000000001 111.027 171.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -69.1 -17.42 63.85 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 115.23 1.567 . . . . 2.3999999999999999 115.23 -170.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -80.74 -61.48 1.96 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.208 0.603 . . . . 1.96 111.368 161.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -68.12 -22.9 64.86 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.376 0.88 . . . . 1.9199999999999999 113.376 -164.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -49.1 -24.2 1.53 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 125.018 1.327 . . . . 2.75 113.084 170.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -94.43 -2.76 51.36 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.512 1.525 . . . . 2.1600000000000001 114.998 178.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.531 HG23 ' H ' ' A' ' 24' ' ' SER . 16.3 m -130.0 -101.07 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 125.593 1.557 . . . . 2.25 112.8 -178.368 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.531 ' H ' HG23 ' A' ' 23' ' ' VAL . 1.9 p 162.53 159.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 128.905 2.882 . . . . 5.2300000000000004 114.079 -178.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.488 ' HE3' ' HB2' ' B' ' 199' ' ' GLU . 43.1 tttt -18.34 -64.08 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 129.707 3.203 . . . . 8.4199999999999999 117.342 -170.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -124.99 27.61 6.66 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 126.215 1.806 . . . . 8.5 112.759 -178.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.5 m -70.31 45.68 0.08 Allowed 'General case' 0 CA--C 1.55 0.944 0 O-C-N 120.242 -1.536 . . . . 4.6299999999999999 112.555 170.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 71.7 mt -62.17 -23.34 66.54 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 116.573 2.064 . . . . 8.5099999999999998 116.573 -157.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.414 ' HA ' ' HA ' ' A' ' 75' ' ' SER . 2.4 p -126.82 4.72 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 127.391 2.276 . . . . 5.9100000000000001 112.345 170.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.21 105.37 16.48 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.497 1.519 . . . . 7.7199999999999998 112.288 -159.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 t-20 -42.65 126.04 3.52 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.076 1.75 . . . . 8.0999999999999996 112.645 170.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -126.1 8.93 7.36 Favored 'General case' 0 CA--C 1.556 1.177 0 O-C-N 121.13 -0.981 . . . . 9.2400000000000002 110.566 145.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.9 pt -150.98 146.75 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 131.147 3.779 . . . . 3.1299999999999999 107.42 175.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.2 m -99.8 168.9 9.6 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 121.69 -0.631 . . . . 2.8199999999999998 111.302 172.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.02 -35.48 15.54 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.835 2.054 . . . . 2.4700000000000002 112.525 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.6 p -55.44 -19.62 9.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.889 2.076 . . . . 1.97 114.843 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m -79.17 -46.44 17.93 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.398 0.999 . . . . 1.54 111.253 175.147 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -51.47 -51.87 51.36 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.556 1.142 . . . . 1.79 111.768 -177.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -52.67 -26.78 14.77 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.177 1.177 . . . . 3.7400000000000002 114.177 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -108.04 -40.08 5.32 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.457 1.103 . . . . 3.7599999999999998 112.792 -172.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -46.32 -46.17 17.97 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.122 0.969 . . . . 1.3200000000000001 110.577 162.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.3 mt -45.85 -67.1 0.31 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.453 1.501 . . . . 1.6000000000000001 111.703 165.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -67.27 -12.04 59.06 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 115.544 1.683 . . . . 2.1400000000000001 115.544 -172.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.81 -43.44 10.64 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.505 0.928 . . . . 1.75 113.505 169.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -104.14 -31.06 9.83 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.761 1.225 . . . . 2.7000000000000002 113.375 -166.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.3 mt -109.34 62.64 0.6 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 127.819 2.448 . . . . 2.6000000000000001 109.838 164.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -94.65 -12.26 27.7 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 115.147 1.536 . . . . 1.3100000000000001 115.147 -177.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 -91.14 -36.76 13.79 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 120.425 -1.422 . . . . 1.6499999999999999 113.014 -173.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.2 mmm -81.31 5.14 18.2 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.302 1.441 . . . . 2.3399999999999999 111.25 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.4 tp -66.88 83.49 0.11 Allowed 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 127.566 2.346 . . . . 3.2000000000000002 110.952 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.6 t -69.38 59.94 0.13 Allowed 'General case' 0 CA--C 1.549 0.94 0 O-C-N 121.281 -0.887 . . . . 5.0599999999999996 111.529 165.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.0 t70 51.09 -132.25 1.94 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 129.639 3.176 . . . . 3.9700000000000002 112.879 171.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.1 m -71.42 -36.85 71.44 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 126.665 1.986 . . . . 4.0 109.951 -172.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.18 -51.35 59.37 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-N 119.518 1.054 . . . . 2.4700000000000002 111.63 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -60.15 -52.31 65.86 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.28 1.032 . . . . 3.73 112.53 174.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.5 ttt-85 -76.65 -31.66 57.48 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.628 -0.67 . . . . 4.6900000000000004 112.608 -170.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -68.2 -32.6 72.94 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 120.112 -1.617 . . . . 3.6099999999999999 112.33 167.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.68 -19.83 59.46 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.392 1.256 . . . . 1.01 114.392 169.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.85 -56.51 4.53 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 119.994 1.27 . . . . 0.64000000000000001 111.869 162.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.96 -31.44 72.55 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.172 1.175 . . . . 2.0899999999999999 114.172 -173.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -57.36 -28.4 63.14 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.35 -0.843 . . . . 2.6800000000000002 113.173 173.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.8 mt -75.37 -43.72 48.89 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.039 0.935 . . . . 1.0600000000000001 110.802 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.0 mm -56.9 -53.65 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.066 1.746 . . . . 1.0900000000000001 110.728 -175.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -58.92 -29.68 67.26 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.997 1.319 . . . . 1.97 113.624 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.5 -24.72 42.1 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.484 1.914 . . . . 2.46 113.524 176.572 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 mt -124.05 -20.56 5.3 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.672 2.101 . . . . 2.9900000000000002 116.672 -168.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -61.89 -25.33 67.49 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.627 1.103 . . . . 3.2999999999999998 110.734 154.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -79.47 -21.29 45.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.53 1.532 . . . . 2.8700000000000001 114.836 171.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -128.58 17.04 6.43 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 119.939 1.245 . . . . 3.77 114.031 -174.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -153.78 126.99 8.46 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 120.556 -1.34 . . . . 3.8500000000000001 111.736 173.106 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.07 59.26 3.22 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.284 2.234 . . . . 5.2999999999999998 114.226 -148.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.65 4.59 26.32 Favored Glycine 0 CA--C 1.534 1.277 0 O-C-N 120.727 -1.233 . . . . 3.02 112.566 -165.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 75.2 mmt-85 -75.29 151.55 38.32 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 127.006 2.122 . . . . 4.9500000000000002 111.413 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.6 mm -140.06 113.52 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 105.134 -2.173 . . . . 2.9100000000000001 105.134 166.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 29' ' ' VAL . 1.2 m -79.72 173.68 12.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 118.967 0.803 . . . . 1.97 112.153 168.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -55.03 -50.12 69.86 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.828 0.823 . . . . 2.0299999999999998 111.403 156.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.76 -26.58 67.79 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.492 1.917 . . . . 3.3199999999999998 113.994 -174.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -58.94 -55.24 37.68 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.938 1.295 . . . . 3.4900000000000002 110.952 173.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -54.85 -48.36 73.0 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 120.726 -1.234 . . . . 2.3300000000000001 111.668 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 24.6 t-105 -63.02 -44.03 97.08 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.163 0.801 . . . . 0.57999999999999996 113.163 -177.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.9 t -67.58 -42.68 82.13 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.288 0.949 . . . . 1.8200000000000001 110.997 178.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.1 -39.12 93.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 117.975 -1.012 . . . . 0.70999999999999996 112.337 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 28.7 mm -52.47 -40.58 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 CA-C-N 120.62 1.555 . . . . 0.69999999999999996 111.5 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -68.19 -22.07 74.22 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.843 0.735 . . . . 0.70999999999999996 113.922 -178.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.38 -30.15 76.1 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-N 118.343 1.072 . . . . 0.68000000000000005 112.368 174.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -89.03 -47.73 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.069 0.947 . . . . 0.87 109.514 167.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.2 m -83.62 59.35 5.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.327 2.251 . . . . 1.51 110.948 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -151.06 -57.35 0.01 OUTLIER Glycine 0 CA--C 1.529 0.95 0 C-N-CA 126.642 2.068 . . . . 0.93999999999999995 110.974 -178.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.02 -60.46 0.44 Allowed 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.445 2.097 . . . . 1.1299999999999999 111.569 167.047 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.2 pt -64.24 -18.32 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 115.425 1.639 . . . . 1.24 115.425 -175.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.32 -45.52 69.06 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.282 1.433 . . . . 1.1000000000000001 113.026 -175.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -60.75 -36.76 79.72 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.618 0.767 . . . . 5.2300000000000004 112.786 178.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.3 tt -75.15 -44.59 46.03 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.702 1.601 . . . . 1.0900000000000001 109.875 -176.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 42.2 mt -52.51 -60.58 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.495 0.718 . . . . 1.1100000000000001 109.491 168.17 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -55.52 -40.54 71.94 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 118.42 -0.8 . . . . 2.1400000000000001 112.99 -176.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.477 ' HB2' ' HE3' ' B' ' 128' ' ' LYS . 11.8 pt-20 -69.66 -36.7 76.27 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 119.672 -0.811 . . . . 3.3100000000000001 111.638 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -70.82 -34.29 71.57 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 117.708 -1.139 . . . . 3.8799999999999999 113.879 -174.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -63.33 -12.24 28.32 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.443 1.02 . . . . 2.8100000000000001 112.396 172.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -111.14 -40.28 4.51 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.613 1.565 . . . . 2.6400000000000001 112.907 179.21 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -87.13 -3.66 59.08 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.349 2.26 . . . . 7.5899999999999999 112.155 -172.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 49.1 m -153.93 28.65 0.47 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.951 1.301 . . . . 7.0599999999999996 112.813 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.4 m -64.23 -21.66 66.66 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.402 2.001 . . . . 11.15 116.402 -172.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 35.8 m . . . . . 0 C--O 1.253 1.287 0 C-N-CA 129.966 3.307 . . . . 13.859999999999999 109.87 -172.743 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 8.5 m . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 118.338 -0.839 . . . . 10.99 110.293 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 87.27 -37.31 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 114.204 1.187 . . . . 9.4299999999999997 114.204 139.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 1.5 m -177.07 -40.66 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 131.436 3.895 . . . . 3.9100000000000001 107.231 -178.446 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.32 105.63 0.95 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 109.966 -0.383 . . . . 2.98 109.966 171.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 10.4 p -59.78 147.94 36.21 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 120.707 0.289 . . . . 0.90000000000000002 110.642 -165.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.4 tp10 -63.96 -32.52 74.09 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 121.925 -0.484 . . . . 2.2999999999999998 111.942 -174.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.9 -47.68 76.92 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.427 1.091 . . . . 0.91000000000000003 110.164 171.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.04 -44.98 52.44 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 119.544 1.065 . . . . 3.46 112.748 -172.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 44.6 tttm -42.72 -47.21 5.35 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.368 1.467 . . . . 5.04 112.43 157.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.416 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -70.27 -31.96 69.56 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 117.165 -1.398 . . . . 0.58999999999999997 114.284 176.186 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 32.8 t -59.72 -33.58 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 121.253 1.842 . . . . 1.02 110.747 171.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 11.8 mt -55.9 -63.59 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 CA-C-N 119.377 0.99 . . . . 1.46 110.58 164.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 83.4 t -55.35 -40.47 57.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.398 1.479 . . . . 0.56999999999999995 112.936 -173.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -62.57 -35.01 78.11 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.118 0.967 . . . . 1.1000000000000001 112.319 175.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 70.5 t -80.86 -41.54 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.538 1.135 . . . . 0.57999999999999996 110.735 -177.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 64.7 tt0 -56.96 -45.67 82.71 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.363 0.529 . . . . 3.0600000000000001 111.087 171.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -59.25 -27.94 66.26 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 114.51 1.3 . . . . 2.0099999999999998 114.51 -177.036 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -79.46 -60.35 2.4 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.236 0.926 . . . . 1.9199999999999999 111.296 173.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -65.73 -24.14 66.9 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.1 0.778 . . . . 1.96 113.1 -169.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -51.55 -23.51 4.24 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.547 1.314 . . . . 2.8900000000000001 114.547 175.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -89.55 -11.09 43.79 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 115.045 1.498 . . . . 2.3500000000000001 115.045 175.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.412 HG23 ' H ' ' B' ' 127' ' ' SER . 27.4 m -127.93 -118.63 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 126.267 1.827 . . . . 2.1699999999999999 111.864 -169.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 127' ' ' SER . . . . . 0.412 ' H ' HG23 ' B' ' 126' ' ' VAL . 24.8 m -162.54 165.56 25.88 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 121.069 1.758 . . . . 5.4199999999999999 113.459 -176.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.477 ' HE3' ' HB2' ' A' ' 96' ' ' GLU . 59.0 tttt -37.64 -48.43 1.04 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 128.079 2.552 . . . . 7.9900000000000002 115.802 -171.09 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -126.16 36.61 4.48 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.383 1.873 . . . . 8.3100000000000005 112.421 -177.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 16.8 m -71.1 67.0 0.42 Allowed 'General case' 0 N--CA 1.478 0.97 0 O-C-N 120.776 -1.202 . . . . 6.1200000000000001 113.624 175.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 90.9 mt -77.23 -17.75 58.22 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.309 1.226 . . . . 8.8200000000000003 114.309 -178.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -140.6 -1.74 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 126.337 1.855 . . . . 5.6900000000000004 112.887 173.26 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -93.49 108.18 19.91 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 120.793 -1.192 . . . . 7.3499999999999996 113.696 -169.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -51.72 123.24 9.66 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 114.09 -1.414 . . . . 8.4600000000000009 109.757 155.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.64 -7.02 11.09 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.682 0.793 . . . . 8.3000000000000007 109.805 147.418 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 8.8 pt -136.7 153.48 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 128.49 2.716 . . . . 3.2200000000000002 108.368 167.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 75.7 m -100.06 174.27 6.25 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.259 0.624 . . . . 3.1299999999999999 110.837 169.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 138' ' ' LYS . . . . . 0.404 ' HE2' ' HB2' ' B' ' 138' ' ' LYS . 3.0 mppt? -48.12 -30.74 4.81 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 113.767 1.025 . . . . 1.99 113.767 177.192 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 14.1 p -50.46 -30.36 12.52 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.628 1.344 . . . . 2.1299999999999999 114.628 172.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 51.0 m -82.4 -32.42 29.14 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.41 1.004 . . . . 1.1699999999999999 112.754 174.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.424 ' CE1' HD11 ' B' ' 145' ' ' LEU . 29.0 t80 -60.95 -48.57 81.21 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 120.007 1.276 . . . . 1.9199999999999999 111.38 179.035 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -56.86 -28.63 61.99 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.114 0.783 . . . . 4.0700000000000003 113.114 174.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.36 -52.09 5.83 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 125.253 1.421 . . . . 2.6299999999999999 111.81 -173.563 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 7.0 tmm? -47.24 -41.02 17.77 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.792 1.237 . . . . 1.26 111.402 167.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 145' ' ' LEU . . . . . 0.424 HD11 ' CE1' ' B' ' 141' ' ' PHE . 30.7 mt -56.52 -70.86 0.1 Allowed 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 123.949 0.899 . . . . 1.46 111.502 167.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -72.37 -1.7 16.52 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.742 1.756 . . . . 2.9300000000000002 115.742 -171.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.25 -50.84 3.51 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.704 1.602 . . . . 1.6499999999999999 114.767 166.369 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -100.28 -26.18 14.0 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.102 1.319 . . . . 2.8700000000000001 113.468 -172.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 22.2 mt -101.89 65.12 0.98 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.633 1.173 . . . . 2.9199999999999999 110.3 160.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -96.96 -8.79 29.74 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.636 1.347 . . . . 1.28 114.636 -177.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 36.3 m-70 -93.89 -32.08 14.06 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.489 -1.382 . . . . 1.6399999999999999 113.458 -171.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.0 mmm -91.25 -2.39 57.46 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.817 2.047 . . . . 2.3700000000000001 111.365 173.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.4 tp -71.47 74.45 0.76 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.857 2.063 . . . . 2.3599999999999999 111.322 -173.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 33.8 t -68.64 72.98 0.24 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.302 1.841 . . . . 4.4100000000000001 112.635 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 21.8 t70 38.2 -133.43 0.13 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 130.146 3.378 . . . . 4.3300000000000001 113.258 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 81.8 m -69.76 -40.99 75.76 Favored 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 125.097 1.359 . . . . 4.3499999999999996 111.19 -165.25 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.37 -48.17 87.49 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 119.562 1.074 . . . . 2.5099999999999998 111.747 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -72.47 -41.73 65.72 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.108 0.781 . . . . 3.3799999999999999 113.108 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -67.12 -40.24 86.8 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 120.256 -1.527 . . . . 4.9299999999999997 112.124 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 27.5 mmmt -67.23 -31.36 71.67 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 120.617 -1.302 . . . . 3.8700000000000001 112.401 170.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.49 -19.81 65.81 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 114.651 1.352 . . . . 1.26 114.651 169.611 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.28 -57.7 3.64 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.808 1.185 . . . . 0.83999999999999997 111.632 162.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -65.73 -26.37 67.71 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.736 1.013 . . . . 2.25 113.736 -172.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -56.47 -34.07 66.55 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.014 -1.054 . . . . 2.7799999999999998 112.254 169.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 21.0 mt -75.7 -34.59 60.41 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.803 0.441 . . . . 0.76000000000000001 111.593 -177.25 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 38.7 mm -62.47 -55.23 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 124.746 1.218 . . . . 1.0800000000000001 109.744 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -60.73 -33.71 73.31 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.899 0.857 . . . . 1.95 112.88 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -64.48 -24.53 67.65 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.469 1.508 . . . . 2.5499999999999998 113.308 174.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.32 -23.48 4.14 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 115.526 1.676 . . . . 2.6499999999999999 115.526 -165.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -61.74 -13.61 24.78 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.065 -1.022 . . . . 3.2999999999999998 112.139 153.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.86 -12.53 59.41 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 115.435 1.643 . . . . 2.7000000000000002 115.435 163.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -134.48 -3.64 2.66 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.049 1.87 . . . . 3.1800000000000002 116.049 -169.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -149.8 90.36 1.69 Allowed 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 120.853 1.66 . . . . 3.7400000000000002 114.72 -170.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -81.07 116.42 21.0 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.094 1.757 . . . . 6.04 112.894 -178.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 67.02 8.59 50.27 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 115.989 1.156 . . . . 2.6299999999999999 115.989 165.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 36.2 mmt-85 -112.31 163.57 14.23 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.078 1.751 . . . . 5.2199999999999998 110.428 173.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.8 mm -149.82 129.78 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 126.375 1.87 . . . . 2.6200000000000001 106.469 161.416 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 11.3 m -93.25 171.75 8.73 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.216 1.006 . . . . 1.9299999999999999 111.065 171.19 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -71.37 -50.36 32.99 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 122.048 0.928 . . . . 2.25 111.956 173.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -70.79 -18.48 62.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.189 2.196 . . . . 3.04 113.621 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -54.38 -55.7 26.02 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.93 1.692 . . . . 3.4399999999999999 111.569 167.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -55.22 -44.8 75.76 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.662 -1.274 . . . . 2.4199999999999999 111.824 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 22.9 t-105 -62.93 -45.62 91.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.742 -0.647 . . . . 0.73999999999999999 112.419 -177.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 6.8 t -71.59 -40.09 70.12 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 118.668 -0.682 . . . . 1.72 111.827 178.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 85.9 mt -56.42 -49.31 74.9 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 117.888 -1.053 . . . . 0.56000000000000005 111.091 173.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 26.7 mm -50.13 -36.97 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-N 120.53 1.514 . . . . 0.65000000000000002 112.63 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.42 -26.87 66.92 Favored Glycine 0 CA--C 1.53 1.023 0 CA-C-O 119.121 -0.821 . . . . 0.58999999999999997 113.257 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -73.9 -31.5 60.0 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 118.313 1.056 . . . . 0.88 113.922 178.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 189' ' ' ILE . . . . . 0.463 HD12 ' H ' ' B' ' 189' ' ' ILE . 1.1 mp -85.99 -36.0 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 118.638 1.219 . . . . 0.83999999999999997 110.877 173.273 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 62.6 m -71.46 -54.63 9.99 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.17 1.388 . . . . 2.9199999999999999 111.475 -176.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -46.63 -41.85 13.44 Favored Glycine 0 CA--C 1.539 1.588 0 CA-C-O 117.264 -1.853 . . . . 0.94999999999999996 116.705 -175.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.92 -51.91 2.02 Favored 'Trans proline' 0 C--N 1.353 0.812 0 CA-C-N 122.173 2.986 . . . . 1.28 112.046 175.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 25.2 pt -81.11 -15.49 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 N-CA-C 114.722 1.379 . . . . 0.92000000000000004 114.722 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -49.8 -43.76 48.65 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.692 1.597 . . . . 0.96999999999999997 112.849 -178.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 2.6 ptpp? -59.7 -36.31 76.26 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.962 0.905 . . . . 5.3799999999999999 113.349 175.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 3.4 tt -77.89 -41.31 37.07 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.894 1.678 . . . . 1.46 110.091 -176.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 24.2 mt -56.22 -60.86 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.413 0.685 . . . . 1.1399999999999999 109.347 168.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -54.58 -39.36 67.72 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 113.256 0.836 . . . . 2.2200000000000002 113.256 -177.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 199' ' ' GLU . . . . . 0.488 ' HB2' ' HE3' ' A' ' 25' ' ' LYS . 12.3 pt-20 -68.89 -38.02 79.39 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 119.745 -0.782 . . . . 3.29 111.627 178.133 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -70.14 -34.23 72.78 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 117.959 -1.019 . . . . 3.9399999999999999 113.281 -173.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -63.01 -9.7 11.1 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.407 1.003 . . . . 2.7599999999999998 112.942 171.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -114.15 -39.14 3.96 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.773 1.629 . . . . 2.6899999999999999 113.33 177.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -87.73 -3.51 58.95 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.185 2.194 . . . . 7.7800000000000002 112.159 -172.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 48.8 m -153.99 28.35 0.47 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.843 1.257 . . . . 6.75 112.992 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 1.3 m -66.51 -23.99 66.33 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 116.324 1.972 . . . . 10.779999999999999 116.324 -172.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 34.4 m . . . . . 0 C--O 1.254 1.291 0 C-N-CA 130.275 3.43 . . . . 13.52 110.071 -173.641 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.511 -0.556 0 CA-C-O 120.314 0.102 . . . . 11.09 110.921 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -63.11 -141.36 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.388 0 O-C-N 124.966 1.416 . . . . 8.3699999999999992 109.796 146.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 13.6 t -79.85 -4.19 51.15 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.258 1.823 . . . . 4.0 112.982 176.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -66.61 155.19 38.54 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.854 1.262 . . . . 2.5800000000000001 112.322 169.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.1 p -62.67 144.95 55.76 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 108.006 -1.109 . . . . 1.0800000000000001 108.006 159.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.41 -43.54 98.57 Favored 'General case' 0 C--O 1.213 -0.834 0 CA-C-O 116.815 -1.564 . . . . 2.5499999999999998 110.071 176.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -46.89 -48.44 21.18 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 120.3 1.409 . . . . 0.93000000000000005 110.363 177.4 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -71.54 -51.21 24.75 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 118.045 -0.979 . . . . 2.9399999999999999 112.581 -175.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 34.5 tptt -61.84 -23.89 66.55 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 121.456 1.935 . . . . 6.0499999999999998 114.082 170.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.798 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -71.04 -38.79 72.55 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 125.338 1.455 . . . . 0.88 111.302 167.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.86 -41.09 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 121.04 1.745 . . . . 0.78000000000000003 110.07 169.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.517 HD13 HG23 ' B' ' 197' ' ' ILE . 16.6 mm -53.07 -50.56 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 119.567 1.076 . . . . 1.3600000000000001 111.063 167.239 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.7 t -62.43 -38.03 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.823 1.192 . . . . 0.76000000000000001 111.99 179.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp -70.52 -26.84 63.77 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 120.705 -1.247 . . . . 1.1499999999999999 112.584 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 97.3 t -81.41 -38.3 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 118.932 0.787 . . . . 0.76000000000000001 111.311 175.018 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -52.57 -48.66 66.05 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.984 0.914 . . . . 3.3599999999999999 110.512 165.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.504 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 3.3 t30 -63.98 -15.39 59.18 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.516 1.673 . . . . 2.48 115.516 -171.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -88.86 -60.56 1.92 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.846 0.858 . . . . 2.0099999999999998 111.886 166.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -68.23 -22.39 64.79 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.383 1.253 . . . . 1.8200000000000001 114.383 -169.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.504 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 9.1 ptmt -52.54 -19.89 2.58 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 115.707 1.743 . . . . 2.5299999999999998 115.707 -177.191 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -96.53 -1.43 47.17 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 115.36 1.615 . . . . 3.4300000000000002 115.36 174.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 19.9 m -137.29 144.46 31.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-N 120.704 1.593 . . . . 2.9700000000000002 112.377 -172.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.1 p -84.55 70.5 10.73 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.376 1.25 . . . . 3.9199999999999999 114.376 -175.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.9 ttpp 72.81 -43.67 0.57 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.687 2.395 . . . . 6.9299999999999997 115.976 149.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -136.09 117.83 15.05 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.412 -1.43 . . . . 8.9000000000000004 110.532 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.448 ' HB3' ' HE2' ' A' ' 30' ' ' LYS . 84.5 p -170.98 146.43 2.48 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.484 1.114 . . . . 4.3899999999999997 113.718 155.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.48 -78.8 0.08 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 107.186 -1.413 . . . . 7.9000000000000004 107.186 143.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 t -80.1 -109.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 125.071 1.349 . . . . 4.8200000000000003 110.9 175.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.448 ' HE2' ' HB3' ' A' ' 27' ' ' SER . 19.7 mtmt 54.34 -4.53 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 126.394 1.878 . . . . 8.1899999999999995 115.103 -160.039 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 58.42 154.83 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.306 1.842 . . . . 7.4500000000000002 113.005 -144.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.4 mtmm -131.75 -157.28 0.81 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.854 1.661 . . . . 9.3000000000000007 107.931 167.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 37.7 pt -64.23 162.43 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.6 -0.688 . . . . 2.8599999999999999 111.331 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.0 m -71.05 145.87 49.66 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.646 -0.659 . . . . 2.6400000000000001 110.578 170.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -59.39 -25.9 64.67 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 119.765 -1.834 . . . . 1.96 113.12 172.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.1 p -72.71 -20.42 61.22 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 114.04 1.126 . . . . 1.6699999999999999 114.04 169.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 39.6 m -71.54 -21.03 61.95 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 120.748 -1.22 . . . . 1.0700000000000001 111.527 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 51.0 t80 -58.98 -59.24 5.78 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.548 1.067 . . . . 2.1899999999999999 111.206 172.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -61.84 -19.67 62.84 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.878 0.871 . . . . 2.5099999999999998 113.301 -176.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.41 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 9.6 tt0 -88.82 -49.88 6.56 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 127.175 2.19 . . . . 2.9399999999999999 110.685 179.497 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 7.1 tmm? -54.4 -40.13 67.93 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.642 1.577 . . . . 1.29 111.599 173.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.3 mt -49.77 -32.64 14.3 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.252 1.421 . . . . 1.3300000000000001 113.206 168.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.84 -5.61 50.61 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.103 1.32 . . . . 3.25 113.823 -178.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.41 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -97.23 -51.58 4.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.676 0.79 . . . . 1.46 111.186 168.074 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -96.06 -21.38 18.0 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.597 0.962 . . . . 2.8100000000000001 113.597 -167.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.01 34.61 4.84 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.427 1.891 . . . . 1.52 111.616 -176.547 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -80.42 -15.23 57.3 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 116.727 2.121 . . . . 1.53 116.727 -156.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 15.3 m-70 -79.73 -49.52 11.94 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 121.324 1.875 . . . . 1.6200000000000001 112.388 -167.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 76.4 mtm -72.13 -19.83 61.71 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.925 1.69 . . . . 1.98 112.861 170.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.7 tp -86.13 50.89 2.07 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.927 1.291 . . . . 3.7400000000000002 110.061 178.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 2.5 m -71.02 -9.03 57.33 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 115.801 1.778 . . . . 4.2199999999999998 115.801 -153.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.403 ' CG ' ' N ' ' A' ' 53' ' ' THR . 22.6 t70 -162.28 174.98 12.1 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.423 1.889 . . . . 5.4000000000000004 111.44 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.403 ' N ' ' CG ' ' A' ' 52' ' ' ASP . 9.5 m -48.66 -37.0 17.24 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 130.232 3.413 . . . . 3.5299999999999998 111.943 162.383 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.0 -45.82 91.97 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 119.235 0.925 . . . . 2.3999999999999999 112.217 172.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -69.47 -42.39 74.93 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.93 0.892 . . . . 4.4400000000000004 109.975 175.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.75 -30.45 22.7 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.801 1.64 . . . . 5.0199999999999996 114.114 172.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.5 mtmt -59.96 -22.23 62.23 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.28 1.4 . . . . 3.9500000000000002 113.293 174.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.48 -15.32 57.01 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 114.866 1.432 . . . . 1.45 114.866 169.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.74 -49.31 10.58 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.402 1.081 . . . . 0.80000000000000004 110.799 162.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -67.71 -29.46 68.72 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.735 1.214 . . . . 2.0600000000000001 114.105 -176.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.2 ptmt -50.34 -35.68 28.87 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 119.563 1.074 . . . . 4.0599999999999996 111.663 165.106 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.7 mt -78.23 -44.97 24.17 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 123.305 0.642 . . . . 1.04 111.15 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 23.0 mm -52.55 -49.53 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 123.734 0.646 . . . . 0.96999999999999997 110.468 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -65.43 -40.12 92.92 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.503 0.927 . . . . 1.8799999999999999 113.503 178.282 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -61.97 -29.66 70.4 Favored 'General case' 0 CA--C 1.554 1.123 0 N-CA-C 113.224 0.824 . . . . 3.3100000000000001 113.224 172.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.84 -26.15 21.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.745 1.218 . . . . 2.1899999999999999 112.158 179.209 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -64.16 -22.21 66.85 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.83 -1.168 . . . . 2.8599999999999999 113.772 165.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.43 -15.98 60.89 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 114.294 1.22 . . . . 2.27 114.294 164.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -126.56 -13.38 5.98 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 116.887 2.18 . . . . 2.6000000000000001 116.887 -166.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.14 125.31 27.66 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 121.963 2.165 . . . . 3.4500000000000002 111.873 174.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -80.1 58.52 3.0 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.933 2.093 . . . . 4.2300000000000004 111.955 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 76.12 2.5 72.6 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.594 1.093 . . . . 3.21 113.819 -174.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -77.22 163.0 26.93 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.407 1.104 . . . . 6.6900000000000004 110.855 177.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 36.0 mm -138.61 140.11 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.479 1.511 . . . . 2.46 108.084 171.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.9 t -95.24 -146.49 0.27 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 127.05 2.14 . . . . 2.6800000000000002 112.061 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -112.92 -59.67 1.99 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.03 1.732 . . . . 2.5499999999999998 109.904 152.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.53 -22.63 61.93 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.079 2.151 . . . . 3.5 112.943 -170.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -47.57 -59.62 3.13 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 127.335 2.254 . . . . 3.1299999999999999 111.09 167.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -54.17 -44.21 71.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.381 0.992 . . . . 2.4199999999999999 112.202 -179.161 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.8 t-105 -63.1 -48.07 80.12 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 118.881 -0.581 . . . . 0.79000000000000004 111.887 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.9 t -71.22 -26.45 62.93 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.931 0.787 . . . . 1.71 112.304 178.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 51.0 mt -66.15 -46.43 77.47 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.448 -1.263 . . . . 0.73999999999999999 111.338 170.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.7 mm -51.99 -41.4 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 CA-C-N 121.808 2.094 . . . . 0.82999999999999996 112.038 176.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.57 -21.96 71.17 Favored Glycine 0 CA--C 1.532 1.118 0 O-C-N 121.568 -0.708 . . . . 0.89000000000000001 113.565 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.29 -23.36 68.48 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 118.631 -1.094 . . . . 0.90000000000000002 114.279 -177.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.494 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.4 OUTLIER -92.04 -42.68 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 125.441 1.496 . . . . 0.95999999999999996 110.044 166.137 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.2 m -78.77 60.11 2.71 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.528 2.331 . . . . 1.3400000000000001 110.691 -177.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -130.33 -77.2 0.17 Allowed Glycine 0 CA--C 1.532 1.154 0 C-N-CA 126.206 1.86 . . . . 0.87 111.094 173.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -62.32 -38.0 57.23 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.146 2.564 . . . . 0.97999999999999998 112.735 -178.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.2 pp -77.82 -14.75 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 112.864 0.69 . . . . 1.1799999999999999 112.864 174.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.67 -33.02 41.56 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.798 -1.188 . . . . 1.0600000000000001 113.512 -174.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.82 -33.57 71.93 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 120.095 -1.628 . . . . 2.8199999999999998 111.657 163.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.04 -40.01 90.64 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 118.407 -0.806 . . . . 1.8500000000000001 111.687 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 92.3 mt -45.71 -62.68 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.617 0.767 . . . . 1.03 110.212 164.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -60.43 -42.81 96.86 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.088 -0.505 . . . . 1.79 111.875 -172.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.298 4.1 pt-20 -76.38 -19.97 57.63 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 112.818 0.673 . . . . 3.2799999999999998 112.818 -176.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -85.11 -37.24 20.49 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.984 1.714 . . . . 2.4900000000000002 115.297 173.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -73.07 -16.48 61.48 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.178 0.899 . . . . 2.48 110.992 176.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -92.06 -66.4 0.93 Allowed 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.047 1.339 . . . . 2.2999999999999998 111.085 170.12 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 53.03 -2.31 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 131.068 3.747 . . . . 4.6900000000000004 116.238 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 37.4 t -129.16 17.28 6.09 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.555 1.542 . . . . 7.04 112.818 -166.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 23.3 m -113.22 6.02 17.24 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.224 1.41 . . . . 9.0099999999999998 113.862 -171.387 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.7 t . . . . . 0 C--O 1.255 1.359 0 C-N-CA 125.159 1.384 . . . . 10.609999999999999 109.616 -148.765 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 CA--C 1.52 -0.202 0 N-CA-C 108.392 -0.966 . . . . 10.289999999999999 108.392 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -49.23 -154.42 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.592 0 CA-C-O 121.94 0.876 . . . . 7.5199999999999996 111.72 122.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 12.1 t -71.44 -14.3 62.1 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 119.398 -2.064 . . . . 3.4399999999999999 112.478 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -63.57 144.5 56.95 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 124.171 0.989 . . . . 2.2000000000000002 111.552 167.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 11.7 p -57.93 151.35 18.42 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.053 -0.721 . . . . 0.98999999999999999 109.053 166.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -68.55 -31.44 70.66 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 116.498 -1.715 . . . . 3.2000000000000002 111.614 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.98 -48.62 70.17 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 121.418 1.917 . . . . 0.93999999999999995 109.746 171.591 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -72.25 -51.35 21.35 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.442 -0.789 . . . . 2.8999999999999999 112.325 -174.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -62.29 -24.07 67.08 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 121.324 1.875 . . . . 7.0700000000000003 114.078 170.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.798 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.43 -43.24 73.78 Favored 'General case' 0 C--O 1.222 -0.376 0 O-C-N 120.233 -1.542 . . . . 0.64000000000000001 111.461 166.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.04 -43.17 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 121.512 1.96 . . . . 0.72999999999999998 110.69 169.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 22.3 mm -52.93 -55.57 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.045 0.838 . . . . 1.79 111.648 168.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 6.7 t -61.15 -38.71 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.61 1.164 . . . . 0.62 112.32 -177.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.8 mp -66.84 -32.59 73.96 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.237 -0.914 . . . . 1.26 111.848 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 79.4 t -80.01 -38.94 19.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.267 1.027 . . . . 0.68000000000000005 111.025 177.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -55.05 -46.82 75.38 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.279 1.031 . . . . 3.1800000000000002 110.5 168.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -59.44 -24.8 63.83 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 115.303 1.594 . . . . 2.3700000000000001 115.303 -173.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -87.96 -58.4 2.58 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.158 1.383 . . . . 2.2999999999999998 112.302 171.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -64.79 -26.69 68.46 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 112.582 0.586 . . . . 1.72 112.582 -172.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -53.43 -16.51 1.45 Allowed 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.017 1.488 . . . . 2.3399999999999999 115.017 174.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -90.24 -5.51 56.27 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 114.744 1.387 . . . . 2.54 114.744 173.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 22.4 m -141.05 148.65 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 CA-C-N 121.271 1.85 . . . . 2.7400000000000002 112.418 -171.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 12.8 p -83.18 72.0 10.16 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 120.956 -1.09 . . . . 4.0099999999999998 113.748 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 20.7 ttpt 69.39 -53.27 0.6 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.799 2.44 . . . . 6.6600000000000001 116.682 153.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -131.69 117.83 19.18 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.52 1.528 . . . . 9.5600000000000005 112.15 -175.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 130' ' ' SER . . . . . 0.431 ' HB3' ' HE2' ' B' ' 133' ' ' LYS . 96.2 p -173.89 148.33 1.41 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.575 1.55 . . . . 4.5099999999999998 113.35 156.3 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.95 -69.79 0.42 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 107.92 -1.141 . . . . 8.1799999999999997 107.92 148.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 2.4 t -85.89 -112.68 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 C-N-CA 124.764 1.225 . . . . 4.79 110.87 175.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 133' ' ' LYS . . . . . 0.431 ' HE2' ' HB3' ' B' ' 130' ' ' SER . 22.1 mtmt 56.61 -6.33 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 126.669 1.988 . . . . 7.8499999999999996 114.658 -159.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 42.3 m-20 57.77 159.17 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.306 1.842 . . . . 7.8700000000000001 112.494 -144.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -138.93 -131.55 0.12 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.662 1.585 . . . . 9.4100000000000001 108.961 173.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 31.3 pt -86.95 165.66 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 119.682 1.128 . . . . 2.1899999999999999 112.064 -175.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 69.0 m -85.95 151.17 23.96 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.201 -0.937 . . . . 2.25 111.172 169.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 138' ' ' LYS . . . . . 0.47 ' HE3' ' HA ' ' B' ' 170' ' ' ASP . 0.0 OUTLIER -58.06 -28.99 65.03 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.238 -1.539 . . . . 2.8100000000000001 112.667 175.764 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 43.9 p -70.5 -24.51 62.86 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.616 -1.303 . . . . 1.6399999999999999 114.218 171.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 20.0 m -72.53 -26.3 61.7 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 120.794 -1.191 . . . . 1.2 112.195 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.425 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 69.6 t80 -60.97 -51.25 70.06 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.137 -0.977 . . . . 2.0099999999999998 112.103 173.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -67.08 -25.93 66.47 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.597 -0.689 . . . . 2.52 112.312 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.92 -52.52 28.49 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 124.314 1.046 . . . . 3.1899999999999999 110.714 170.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 2.2 ttm -55.39 -39.83 70.63 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.976 1.31 . . . . 1.5700000000000001 110.696 179.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.7 mt -56.53 -62.1 1.96 Allowed 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 125.825 1.65 . . . . 1.54 112.25 165.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -63.85 -16.76 62.13 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 120.349 1.431 . . . . 3.2999999999999998 114.779 -176.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.78 -56.8 3.31 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.331 0.969 . . . . 1.3799999999999999 112.019 170.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -93.88 -19.48 20.93 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 113.606 0.965 . . . . 2.8300000000000001 113.606 -165.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 3.9 mt -122.33 57.21 1.09 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 129.135 2.974 . . . . 1.5900000000000001 109.739 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -96.2 -16.82 21.23 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.724 1.75 . . . . 1.3799999999999999 115.724 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -82.72 -27.51 31.1 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 121.087 1.767 . . . . 1.8799999999999999 114.131 -172.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 65.3 mtm -89.26 6.1 41.85 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.413 1.885 . . . . 2.0499999999999998 113.207 174.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 2.3 tp -83.36 -167.37 1.67 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 128.148 2.579 . . . . 3.0600000000000001 111.49 173.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 15.5 m -174.6 -45.63 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 128.524 2.73 . . . . 3.9700000000000002 109.266 171.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -151.69 179.07 8.72 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-O 123.437 1.589 . . . . 4.96 112.192 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 12.5 m -35.38 -40.99 0.16 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 128.802 2.841 . . . . 3.0899999999999999 112.673 151.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.96 -47.76 47.43 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 124.923 1.249 . . . . 1.8799999999999999 113.351 176.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -64.15 -48.17 77.04 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.904 0.881 . . . . 4.5300000000000002 110.391 173.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -55.86 -33.4 64.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.992 1.717 . . . . 5.2199999999999998 114.074 -178.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -55.69 -22.95 25.81 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 120.99 -1.069 . . . . 4.8200000000000003 113.721 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -80.94 -14.89 57.56 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.044 1.498 . . . . 1.5600000000000001 115.044 172.171 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -80.15 -52.19 8.06 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.58 1.082 . . . . 0.81999999999999995 110.485 160.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -66.42 -29.8 70.03 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.775 1.23 . . . . 1.95 113.323 -172.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt -50.13 -35.18 24.78 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 118.911 0.778 . . . . 4.1500000000000004 112.406 165.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.5 mt -81.32 -40.86 22.96 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.64 -0.663 . . . . 1.02 111.322 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.62 -48.98 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 123.23 0.612 . . . . 0.80000000000000004 111.102 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -65.04 -24.42 67.48 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.002 1.112 . . . . 1.8799999999999999 114.002 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -82.36 -41.05 20.49 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.293 1.22 . . . . 3.1200000000000001 114.293 173.048 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.56 -32.04 20.9 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 121.12 -0.988 . . . . 2.6000000000000001 112.45 -171.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 170' ' ' ASP . . . . . 0.47 ' HA ' ' HE3' ' B' ' 138' ' ' LYS . 7.9 t70 -60.26 -44.88 94.91 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.256 -0.902 . . . . 3.0 111.228 174.5 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.99 -12.0 7.02 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.168 1.787 . . . . 2.0499999999999998 115.363 174.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -117.11 -4.06 11.48 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.758 1.223 . . . . 2.2799999999999998 113.628 -177.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -154.96 95.29 1.73 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.697 1.135 . . . . 3.7400000000000002 110.104 -168.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -76.23 79.94 3.02 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.631 1.572 . . . . 4.21 112.858 -164.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 68.24 -4.67 4.56 Favored Glycine 0 CA--C 1.535 1.304 0 O-C-N 121.03 -1.043 . . . . 2.8900000000000001 113.114 -166.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 64.3 mmt-85 -68.52 147.95 51.25 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.799 1.24 . . . . 5.96 109.702 174.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 35.6 mm -142.55 137.92 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 126.464 1.905 . . . . 2.52 107.37 176.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 9.1 t -92.12 -142.87 0.2 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.961 1.704 . . . . 2.6099999999999999 111.512 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -117.82 -56.71 2.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.404 1.881 . . . . 2.5899999999999999 110.284 158.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -61.68 -27.41 68.67 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 128.508 2.723 . . . . 3.0 114.32 -177.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -43.54 -58.78 2.46 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.336 1.854 . . . . 3.0099999999999998 111.054 165.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -54.5 -43.88 72.22 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.239 -0.913 . . . . 2.4300000000000002 111.772 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 35.4 t-105 -62.3 -47.94 82.07 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 122.123 -0.361 . . . . 0.75 111.753 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 13.2 t -71.74 -25.81 62.21 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 118.215 -0.898 . . . . 1.6599999999999999 112.274 177.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.425 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 62.1 mt -63.96 -48.97 74.37 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 117.28 -1.343 . . . . 0.70999999999999996 110.737 168.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 38.7 mm -50.27 -41.88 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 CA-C-N 121.348 1.885 . . . . 0.73999999999999999 112.065 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.55 -25.1 72.69 Favored Glycine 0 CA--C 1.531 1.057 0 O-C-N 121.534 -0.729 . . . . 0.91000000000000003 113.744 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.94 -21.68 75.83 Favored Glycine 0 CA--C 1.533 1.182 0 CA-C-O 118.672 -1.071 . . . . 1.02 114.438 -176.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 189' ' ' ILE . . . . . 0.505 HD12 ' H ' ' B' ' 189' ' ' ILE . 0.5 OUTLIER -88.49 -48.4 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 125.12 1.368 . . . . 0.98999999999999999 109.161 163.457 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 1.5 m -86.44 44.71 1.17 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.621 1.968 . . . . 1.6899999999999999 111.9 -165.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -118.42 -71.39 0.39 Allowed Glycine 0 CA--C 1.53 1.027 0 C-N-CA 126.603 2.049 . . . . 0.93000000000000005 111.036 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.14 -30.66 82.54 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.471 2.781 . . . . 1.6000000000000001 114.176 -178.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 7.7 pt -83.88 -13.75 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 119.713 1.142 . . . . 1.29 113.518 172.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.95 -34.94 76.17 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.31 1.226 . . . . 0.87 114.31 -169.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -56.78 -36.29 69.69 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.434 -1.416 . . . . 3.2000000000000002 111.808 168.289 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.02 -40.04 75.44 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 123.625 0.77 . . . . 2.2000000000000002 111.369 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 197' ' ' ILE . . . . . 0.517 HG23 HD13 ' A' ' 13' ' ' ILE . 90.3 mt -47.41 -62.33 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.768 0.827 . . . . 1.1299999999999999 110.85 166.266 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -56.35 -46.67 79.87 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.514 0.561 . . . . 1.6799999999999999 112.514 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.305 2.6 pt-20 -78.6 -13.19 59.95 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.977 0.732 . . . . 2.9100000000000001 112.977 -173.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -81.45 -25.81 35.81 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 115.058 1.503 . . . . 2.3300000000000001 115.058 169.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -75.13 -15.63 60.58 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.12 0.968 . . . . 2.23 111.228 170.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -102.49 -61.81 1.35 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.965 1.306 . . . . 2.3399999999999999 110.876 -179.553 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.254 7.5 pt20 56.85 -6.11 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.057 1 C-N-CA 132.026 4.13 . . . . 4.79 115.72 171.744 . . . . . . . . 3 2 . 1 . 019 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 48.4 t -118.26 40.54 3.16 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.789 2.036 . . . . 6.8700000000000001 110.317 -178.22 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 20.0 m -144.54 17.55 1.67 Allowed 'General case' 0 N--CA 1.477 0.92 0 O-C-N 119.961 -1.712 . . . . 9.0 114.092 -172.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 C--O 1.256 1.418 0 C-N-CA 125.032 1.333 . . . . 10.92 110.54 -164.507 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.54 ' HA ' ' CE2' ' A' ' 5' ' ' TYR . 42.0 m . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 118.831 -0.604 . . . . 10.57 110.877 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.5 ' CG ' ' H ' ' A' ' 4' ' ' CYS . 2.4 t70 -76.69 -116.09 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 106.708 -1.59 . . . . 7.5899999999999999 106.708 137.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.5 ' H ' ' CG ' ' A' ' 3' ' ' ASP . 75.7 m -82.96 -60.93 2.0 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.595 1.543 . . . . 3.8300000000000001 108.86 166.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.54 ' CE2' ' HA ' ' A' ' 2' ' ' SER . 10.1 m-30 70.88 138.07 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.992 2.517 . . . . 2.5899999999999999 112.34 176.431 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 17.1 p -78.95 166.75 22.03 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 120.795 -1.191 . . . . 0.90000000000000002 110.953 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -56.58 -34.13 66.85 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.28 0.632 . . . . 2.25 112.47 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -45.7 90.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.17 1.388 . . . . 0.82999999999999996 110.122 175.043 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -76.23 -47.99 21.93 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.993 0.917 . . . . 2.9300000000000002 111.423 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 40.2 tttm -44.89 -46.69 11.01 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.248 1.419 . . . . 5.8700000000000001 113.104 159.141 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.82 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -63.52 -45.99 88.08 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.563 -1.208 . . . . 0.53000000000000003 112.896 175.695 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.5 t -57.76 -38.61 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 120.87 1.668 . . . . 0.58999999999999997 110.377 174.1 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.4 mt -63.64 -43.37 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 121.634 -0.666 . . . . 1.04 111.277 173.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.8 t -68.28 -39.82 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 124.394 1.077 . . . . 0.48999999999999999 111.986 179.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.4 mp -59.83 -45.29 92.85 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.75 1.159 . . . . 0.91000000000000003 110.212 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.6 t -64.66 -42.22 94.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 124.896 1.278 . . . . 0.53000000000000003 112.32 177.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -56.57 -49.28 75.33 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.408 1.083 . . . . 3.3799999999999999 111.13 168.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.406 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -72.16 -24.62 61.47 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.91 0.707 . . . . 2.5899999999999999 112.91 -170.115 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -71.2 -63.15 1.16 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.983 0.513 . . . . 1.95 112.185 161.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -63.53 -32.59 74.09 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.792 -0.623 . . . . 1.8799999999999999 112.376 -163.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 18' ' ' ASN . 35.8 pttt -55.57 -23.38 26.66 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.585 1.328 . . . . 2.3100000000000001 114.585 175.248 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -78.95 -31.03 44.9 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.623 -1.298 . . . . 2.3999999999999999 112.607 174.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.1 m -92.92 -170.06 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 CA-C-N 120.824 1.647 . . . . 2.0899999999999999 111.72 176.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.46 -44.76 61.88 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 120.306 -1.496 . . . . 3.75 114.189 173.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt 132.01 -95.9 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 131.184 3.793 . . . . 4.9900000000000002 107.744 -156.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -121.1 125.28 46.86 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.938 1.695 . . . . 9.1199999999999992 111.272 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.4 m -154.68 25.05 0.45 Allowed 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.252 -0.905 . . . . 4.4800000000000004 111.576 174.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 71.7 mt 59.56 -61.66 0.05 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 128.269 2.628 . . . . 8.3300000000000001 114.018 -175.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.3 t -72.74 -37.85 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 127.489 2.316 . . . . 4.54 111.044 174.1 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt 70.93 -2.77 2.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 127.927 2.491 . . . . 12.92 116.463 175.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -57.7 139.83 52.84 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 119.269 0.941 . . . . 8.0500000000000007 111.884 176.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.63 -40.43 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 128.294 2.638 . . . . 10.369999999999999 108.069 -169.01 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.0 pt -117.5 171.11 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 127.315 2.246 . . . . 3.25 108.907 158.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 72.1 m -113.92 167.64 10.48 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.606 0.763 . . . . 2.9900000000000002 109.512 160.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.41 -18.28 4.01 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 115.583 1.697 . . . . 2.3599999999999999 115.583 176.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.3 p -57.15 -20.73 28.01 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.384 -1.447 . . . . 2.1800000000000002 114.286 165.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.7 m -82.44 -33.01 28.69 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.725 -1.234 . . . . 1.26 113.52 171.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -55.3 -52.38 63.63 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.789 1.177 . . . . 2.3700000000000001 111.37 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -16.32 8.81 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.688 1.195 . . . . 2.96 113.976 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -106.86 -38.58 6.03 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 124.826 1.251 . . . . 3.04 112.529 -174.301 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.2 ttm -47.99 -44.58 30.74 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.767 0.827 . . . . 1.6000000000000001 110.286 156.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.2 mt -62.46 -12.64 23.17 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 116.006 1.854 . . . . 0.95999999999999996 116.006 170.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -104.96 -15.56 15.09 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 124.761 1.224 . . . . 2.3300000000000001 113.505 174.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.51 -47.56 3.9 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.326 1.051 . . . . 1.49 112.924 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -94.73 -9.53 34.42 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.223 1.374 . . . . 2.9399999999999999 113.967 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -120.14 34.11 5.34 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.849 1.66 . . . . 1.48 112.601 171.389 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -78.65 -21.2 48.69 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 116.209 1.929 . . . . 1.6499999999999999 116.209 -161.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -94.18 -14.35 25.69 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.237 1.381 . . . . 1.96 112.989 -170.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 50.2 mtm -85.53 -18.1 34.43 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.625 1.17 . . . . 2.1200000000000001 112.922 162.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.55 125.99 26.93 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 120.643 -1.286 . . . . 3.1499999999999999 108.618 163.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.6 p -171.81 -57.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.568 -0.707 . . . . 3.5 109.449 -158.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -79.49 147.2 32.32 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.511 0.724 . . . . 5.4500000000000002 109.25 155.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.3 m -69.15 -30.17 68.35 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.785 0.834 . . . . 2.3799999999999999 110.473 171.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -55.8 -33.74 60.29 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 124.461 1.029 . . . . 1.74 113.098 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -59.78 -56.0 27.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.319 1.047 . . . . 3.0699999999999998 111.514 -179.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.6 ttt-85 -73.33 -33.29 65.05 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.148 0.795 . . . . 4.7999999999999998 113.148 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -55.65 -38.11 69.12 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 119.562 -1.961 . . . . 3.0800000000000001 112.163 171.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.96 -10.14 55.79 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.571 1.693 . . . . 1.25 115.571 172.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.32 -57.32 3.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.585 1.084 . . . . 0.88 111.019 162.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.18 -29.42 70.35 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.49 0.716 . . . . 2.96 112.085 -172.295 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -62.64 -28.07 69.65 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 120.434 -1.416 . . . . 2.5699999999999998 114.311 172.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.9 mt -78.54 -36.76 44.3 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.315 0.646 . . . . 0.91000000000000003 110.554 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.4 mm -51.6 -55.48 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 126.271 1.828 . . . . 1.0 109.55 178.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -60.1 -31.15 69.77 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.67 0.989 . . . . 2.25 113.67 -178.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -31.61 65.64 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.405 1.482 . . . . 2.96 112.55 175.345 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.4 -29.98 21.08 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.335 1.454 . . . . 2.1000000000000001 111.587 177.497 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -55.4 -52.01 64.98 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.757 1.623 . . . . 2.9900000000000002 109.503 164.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.97 -14.69 24.47 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 115.553 1.686 . . . . 2.0299999999999998 115.553 175.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -118.73 -7.39 10.52 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.152 1.538 . . . . 2.3500000000000001 115.152 -175.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -147.45 125.28 11.92 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 121.019 1.736 . . . . 3.7599999999999998 111.051 -179.082 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -114.88 149.82 36.56 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.632 0.773 . . . . 5.2300000000000004 110.44 163.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.54 -43.67 0.59 Allowed Glycine 0 CA--C 1.53 1.002 0 C-N-CA 126.598 2.047 . . . . 3.0 114.346 -178.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -88.93 140.66 29.21 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.296 1.439 . . . . 5.4299999999999997 112.342 -173.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 46.7 mm -114.29 129.61 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 N-CA-C 106.357 -1.72 . . . . 2.48 106.357 154.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.2 t -84.9 -171.71 3.79 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.392 0.615 . . . . 1.7 112.489 -179.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -94.51 -57.76 2.39 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 119.253 -2.154 . . . . 1.8899999999999999 110.404 167.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -51.46 -29.13 15.23 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 130.713 3.605 . . . . 3.3300000000000001 114.94 170.721 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -49.72 -58.67 4.87 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.306 1.442 . . . . 3.23 111.306 171.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -52.44 -48.21 65.94 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.211 -0.931 . . . . 1.99 111.652 176.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.4 t-105 -64.54 -45.56 86.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 119.054 -0.498 . . . . 0.54000000000000004 111.416 -171.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.2 t -71.17 -29.39 65.13 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 117.753 -1.117 . . . . 1.8700000000000001 112.229 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.89 -35.51 76.95 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.459 1.027 . . . . 0.66000000000000003 112.207 174.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.3 mm -52.26 -38.72 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 CA-C-N 120.322 1.419 . . . . 0.67000000000000004 111.359 173.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.79 -14.02 64.64 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.422 1.487 . . . . 0.57999999999999996 115.309 177.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.29 -24.94 64.7 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-N 119.394 1.597 . . . . 0.80000000000000004 112.842 173.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -97.08 -41.99 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.305 1.442 . . . . 1.05 109.96 171.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.4 m -80.93 64.12 5.57 Favored 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 127.014 2.126 . . . . 1.3300000000000001 108.342 173.227 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -159.87 -55.67 0.01 OUTLIER Glycine 0 CA--C 1.531 1.038 0 C-N-CA 126.04 1.781 . . . . 1.3200000000000001 110.937 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.09 -73.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.344 2.696 . . . . 1.3999999999999999 111.341 161.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.5 pt -73.51 -18.33 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 N-CA-C 114.7 1.37 . . . . 1.25 114.7 -170.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.484 ' HA ' HD12 ' A' ' 94' ' ' ILE . . . -55.23 -39.29 69.55 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.227 1.011 . . . . 1.1299999999999999 112.606 -178.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -63.28 -41.79 99.05 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.5 -0.75 . . . . 5.7800000000000002 111.863 175.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.5 tt -65.18 -40.89 94.9 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 117.908 -1.044 . . . . 1.1799999999999999 110.818 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.484 HD12 ' HA ' ' A' ' 91' ' ' ALA . 96.7 mt -45.72 -51.28 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 119.375 0.988 . . . . 1.0 110.726 174.002 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -63.71 -39.18 93.66 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.605 0.965 . . . . 1.96 113.605 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -85.41 -24.09 27.66 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.18 0.9 . . . . 2.7799999999999998 112.978 -177.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -66.89 -46.36 75.15 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.159 1.383 . . . . 2.4500000000000002 109.166 164.521 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -84.16 41.16 0.8 Allowed 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 124.914 2.292 . . . . 3.1099999999999999 111.002 176.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -125.08 -54.38 1.61 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 111.862 -2.426 . . . . 2.4399999999999999 107.361 149.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -64.94 -10.05 26.11 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.009 1.724 . . . . 5.7000000000000002 115.213 -175.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 14.2 p -70.64 -1.45 11.24 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.155 -0.966 . . . . 6.8700000000000001 113.567 161.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 23.2 t -149.74 -22.36 0.27 Allowed 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 116.432 2.012 . . . . 8.7599999999999998 116.432 174.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 30.5 t . . . . . 0 N--CA 1.489 1.51 0 C-N-CA 127.008 2.123 . . . . 9.1799999999999997 114.347 177.841 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 118.778 -0.63 . . . . 9.6199999999999992 110.937 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 106' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' B' ' 107' ' ' CYS . 4.4 t70 -72.8 -116.73 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.232 0 N-CA-C 106.847 -1.538 . . . . 6.8200000000000003 106.847 138.62 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 107' ' ' CYS . . . . . 0.438 ' H ' ' CG ' ' B' ' 106' ' ' ASP . 40.6 t -71.9 -63.48 1.13 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 121.154 1.797 . . . . 3.3300000000000001 109.208 156.009 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 74.15 146.3 0.08 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.857 2.863 . . . . 2.4300000000000002 111.976 -176.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.3 p -82.74 168.99 16.67 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 121.526 -0.734 . . . . 0.97999999999999998 110.359 177.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -63.8 -48.78 75.51 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-O 117.022 -1.466 . . . . 2.5600000000000001 110.509 171.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.25 -47.23 36.11 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 120.2 1.363 . . . . 0.75 111.0 178.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -73.49 -53.91 9.5 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 126.078 1.751 . . . . 2.96 112.503 -173.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -47.55 -36.64 10.83 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.125 1.37 . . . . 4.5599999999999996 113.299 161.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.82 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -73.61 -38.82 64.96 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 120.716 -1.24 . . . . 0.46999999999999997 112.003 176.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.94 -40.99 79.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 120.914 1.688 . . . . 0.66000000000000003 110.385 166.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 97.1 mt -58.74 -49.04 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 118.867 0.758 . . . . 0.90000000000000002 112.103 171.521 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.8 t -61.38 -43.3 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.98 1.312 . . . . 0.48999999999999999 112.265 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -60.77 -44.01 97.32 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.825 1.193 . . . . 0.93999999999999995 110.778 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 55.5 t -63.38 -42.55 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 124.325 1.05 . . . . 0.52000000000000002 111.836 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -55.54 -47.75 75.81 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 119.972 1.26 . . . . 3.6000000000000001 110.514 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 121' ' ' ASN . . . . . 0.407 ' HA ' ' HE2' ' B' ' 124' ' ' LYS . 0.2 OUTLIER -72.9 -24.9 60.89 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 112.694 0.627 . . . . 2.5600000000000001 112.694 -168.983 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -74.02 -59.72 2.59 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.898 0.479 . . . . 1.97 112.111 163.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -64.34 -32.68 74.39 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.6 -0.714 . . . . 1.8300000000000001 112.286 -165.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 124' ' ' LYS . . . . . 0.407 ' HE2' ' HA ' ' B' ' 121' ' ' ASN . 37.4 pttt -54.84 -24.57 23.67 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.437 1.273 . . . . 2.1899999999999999 114.437 175.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -77.39 -31.29 54.09 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 117.49 -1.243 . . . . 2.1299999999999999 112.963 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.7 m -95.26 -173.87 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 CA-C-N 120.901 1.682 . . . . 2.0600000000000001 112.125 -179.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.59 -43.03 73.65 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.605 -1.309 . . . . 3.8500000000000001 113.645 175.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 22.4 ttpt 126.98 -93.1 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 131.466 3.906 . . . . 4.8099999999999996 108.161 -156.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -123.69 132.9 53.94 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.881 1.672 . . . . 9.1999999999999993 112.002 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 12.5 m -154.33 26.56 0.46 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.285 1.034 . . . . 4.8799999999999999 110.997 173.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 67.3 mt 59.01 -62.17 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.193 2.597 . . . . 8.6099999999999994 112.73 -167.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 54.9 t -74.45 -33.54 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 127.461 2.305 . . . . 4.5199999999999996 112.204 177.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt 69.75 -5.54 1.2 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 127.672 2.389 . . . . 12.9 116.655 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -57.39 138.04 55.41 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 119.012 0.824 . . . . 8.0399999999999991 111.544 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.83 -38.75 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 128.158 2.583 . . . . 10.34 108.469 -167.206 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 3.2 pt -120.69 173.37 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 127.431 2.293 . . . . 3.3500000000000001 108.62 158.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 66.3 m -117.17 168.95 9.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.744 0.818 . . . . 2.9399999999999999 109.457 161.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.6 -16.96 2.77 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 116.02 1.859 . . . . 2.21 116.02 175.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.9 p -59.59 -20.48 56.09 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 119.636 -1.915 . . . . 2.1099999999999999 114.455 165.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 23.6 m -78.88 -31.68 45.57 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 120.439 -1.413 . . . . 1.21 112.983 170.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.484 ' CE2' HD11 ' B' ' 145' ' ' LEU . 50.1 t80 -61.05 -49.38 77.58 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.592 1.157 . . . . 2.2400000000000002 112.039 -178.217 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 1.2 ptt180 -55.58 -15.55 3.02 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.899 1.074 . . . . 2.9399999999999999 113.899 173.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -106.03 -38.33 6.34 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 125.451 1.5 . . . . 2.73 112.525 -175.551 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.5 ttm -49.79 -44.39 49.0 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.247 1.019 . . . . 1.5700000000000001 110.45 159.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 145' ' ' LEU . . . . . 0.484 HD11 ' CE2' ' B' ' 141' ' ' PHE . 28.7 mt -65.04 -0.6 1.66 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 126.214 1.806 . . . . 1.21 115.644 171.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -120.78 -14.71 8.5 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 125.452 1.501 . . . . 2.3500000000000001 114.046 174.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.86 -53.23 2.8 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.171 0.988 . . . . 1.54 113.47 175.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -85.69 -34.65 21.23 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 120.585 1.539 . . . . 2.79 112.545 177.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.22 47.38 0.9 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.753 1.221 . . . . 1.8300000000000001 111.595 179.284 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -89.69 -16.32 30.65 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 115.685 1.735 . . . . 1.6000000000000001 115.685 -160.505 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -97.82 -22.72 16.22 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 120.454 1.479 . . . . 1.6399999999999999 113.278 -167.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 60.2 mtm -79.64 -19.38 49.26 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.672 -1.268 . . . . 2.1000000000000001 111.947 166.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 5.9 mp -63.28 125.54 24.46 Favored 'General case' 0 C--O 1.222 -0.358 0 O-C-N 121.399 -0.813 . . . . 3.02 108.815 160.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 18.4 p -172.74 -68.72 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.996 -1.113 . . . . 3.3399999999999999 107.996 -161.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -66.14 139.52 58.15 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.723 0.773 . . . . 5.7000000000000002 109.392 155.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 37.8 m -68.0 -28.02 67.06 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.003 0.921 . . . . 2.5299999999999998 110.441 174.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.76 -32.02 58.45 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.544 1.069 . . . . 1.77 112.953 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -64.78 -55.65 18.42 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.262 1.031 . . . . 3.1600000000000001 111.522 -175.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 31.0 ttt-85 -71.74 -36.22 70.37 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.441 0.904 . . . . 4.5700000000000003 113.441 173.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -53.42 -42.88 67.5 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.829 1.65 . . . . 3.4700000000000002 111.859 172.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.66 -23.3 58.96 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.206 -1.378 . . . . 0.95999999999999996 114.521 174.054 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.4 -52.01 11.75 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.818 1.19 . . . . 0.81000000000000005 111.799 167.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.42 -27.38 68.51 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 124.062 0.945 . . . . 2.5800000000000001 112.807 -175.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.1 mtmt -63.19 -31.21 72.3 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.345 -1.472 . . . . 3.9300000000000002 113.742 169.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 7.9 mt -76.25 -36.72 58.34 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.12 0.568 . . . . 0.95999999999999996 111.209 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 34.8 mm -53.84 -58.81 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.046 1.339 . . . . 1.1299999999999999 110.099 175.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -59.06 -34.8 72.36 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.328 0.862 . . . . 1.8200000000000001 113.328 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -63.68 -36.6 84.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.54 1.136 . . . . 3.1899999999999999 112.205 173.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.67 -28.85 24.44 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.343 1.057 . . . . 2.2999999999999998 111.749 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -55.67 -55.51 31.32 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.252 1.021 . . . . 3.0099999999999998 110.264 163.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -56.52 -24.76 48.76 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.694 1.368 . . . . 1.98 114.694 176.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -103.6 -9.23 19.39 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 114.576 1.324 . . . . 2.3799999999999999 114.576 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -150.55 122.57 8.22 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 121.394 1.906 . . . . 3.77 112.083 -177.504 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -100.42 153.1 19.62 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.289 0.635 . . . . 5.0099999999999998 110.315 153.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.56 -45.54 1.28 Allowed Glycine 0 CA--C 1.53 0.976 0 C-N-CA 126.876 2.179 . . . . 2.79 115.489 168.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 23.6 mmt85 -84.47 154.19 22.9 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.352 1.461 . . . . 5.3399999999999999 111.89 -176.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.9 mm -131.67 129.2 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 126.236 1.814 . . . . 2.4700000000000002 106.324 159.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 2.8 t -87.11 -174.2 4.79 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 112.779 0.659 . . . . 1.74 112.779 -177.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -89.82 -58.12 2.62 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 119.234 -2.166 . . . . 1.8899999999999999 110.029 163.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -54.53 -28.51 45.91 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.184 3.394 . . . . 3.1600000000000001 114.19 176.487 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -46.87 -59.93 2.76 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.148 1.379 . . . . 3.3100000000000001 111.287 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -52.0 -46.71 65.01 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.41 -0.806 . . . . 2.0899999999999999 111.498 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 -65.92 -42.65 89.84 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 119.009 -0.519 . . . . 0.59999999999999998 111.908 -174.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 11.2 t -70.5 -28.88 65.31 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 117.662 -1.161 . . . . 1.74 112.262 174.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.7 mt -69.92 -40.97 75.25 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.801 1.182 . . . . 0.68000000000000005 112.106 172.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.5 mm -53.44 -37.19 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 CA-C-N 121.232 1.833 . . . . 0.63 111.989 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.22 -13.12 59.59 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 124.917 1.246 . . . . 0.56000000000000005 115.126 177.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -81.31 -19.61 66.33 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-N 119.535 1.668 . . . . 1.04 113.778 173.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.1 mp -100.39 -44.57 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 124.815 1.246 . . . . 1.22 109.411 168.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.7 m -77.82 58.51 1.89 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.86 2.064 . . . . 1.47 109.24 169.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -158.68 -58.54 0.01 OUTLIER Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.359 1.933 . . . . 1.3700000000000001 111.141 -172.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -61.66 -71.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.373 2.715 . . . . 1.6499999999999999 111.242 163.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 16.8 pt -76.38 -18.22 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 115.1 1.519 . . . . 1.25 115.1 -170.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.0 -35.26 76.36 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.078 0.77 . . . . 1.26 113.078 -172.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -60.38 -38.49 84.08 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.918 -0.489 . . . . 6.0999999999999996 111.923 175.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.4 tt -71.67 -34.67 69.89 Favored 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 124.343 1.057 . . . . 1.51 111.466 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 91.0 mt -47.16 -50.81 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 CA-C-N 119.83 1.195 . . . . 1.01 110.098 172.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 13.3 t60 -63.86 -25.16 68.04 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.495 1.295 . . . . 1.99 114.495 -176.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -98.35 -27.0 14.3 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.769 1.168 . . . . 2.8300000000000001 113.17 176.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -72.0 -45.65 60.15 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 124.546 1.139 . . . . 2.2599999999999998 109.824 173.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -83.26 36.3 0.52 Allowed 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 124.374 2.035 . . . . 3.1200000000000001 110.969 175.043 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -117.06 -52.79 2.5 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 112.803 -1.999 . . . . 2.02 108.247 151.369 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -65.7 -7.77 17.26 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.537 1.535 . . . . 5.4699999999999998 114.814 -176.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 22.0 p -71.25 -0.54 10.17 Favored 'General case' 0 CA--C 1.549 0.909 0 O-C-N 120.884 -1.135 . . . . 7.2400000000000002 113.6 160.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 27.0 t -150.62 -22.07 0.23 Allowed 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 116.921 2.193 . . . . 9.0299999999999994 116.921 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 26.4 t . . . . . 0 N--CA 1.492 1.628 0 CA-C-N 121.954 2.161 . . . . 9.1300000000000008 115.048 179.751 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 N--CA 1.477 0.879 0 CA-C-O 117.553 -1.213 . . . . 8.9600000000000009 107.983 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -48.69 -104.61 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 118.929 0.786 . . . . 6.2199999999999998 109.142 111.516 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 86.3 m -91.61 -101.33 0.11 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.514 1.525 . . . . 4.5599999999999996 109.298 172.361 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -46.11 127.31 8.45 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 126.171 1.788 . . . . 2.2999999999999998 113.186 -165.362 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p -71.51 168.12 18.23 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.952 0.901 . . . . 1.25 111.251 -169.874 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -61.2 -59.92 4.57 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-O 118.502 -0.761 . . . . 2.6800000000000002 109.941 169.287 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -46.64 -41.91 15.48 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.158 1.383 . . . . 0.82999999999999996 111.243 -178.168 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -70.78 -58.02 4.06 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 125.357 1.463 . . . . 2.6899999999999999 113.181 179.131 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -54.24 -26.54 29.26 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 120.622 1.556 . . . . 5.7199999999999998 113.438 168.341 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.869 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -74.75 -42.44 58.22 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 125.456 1.502 . . . . 0.48999999999999999 110.716 174.492 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.5 t -58.9 -38.24 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 120.144 1.338 . . . . 0.69999999999999996 110.754 165.501 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.5 mt -58.25 -48.78 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-O 117.481 -1.247 . . . . 0.81000000000000005 111.183 168.664 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.8 t -60.77 -35.53 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 CA-C-N 121.029 1.74 . . . . 0.63 113.085 178.39 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp -67.15 -48.66 67.36 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.042 -1.036 . . . . 0.94999999999999996 111.775 170.384 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.1 t -57.59 -40.92 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 125.319 1.448 . . . . 0.63 111.797 173.59 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -68.33 -47.87 66.38 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 126.991 2.116 . . . . 3.1499999999999999 111.154 -179.343 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -75.17 -5.27 43.5 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.8 1.037 . . . . 2.6699999999999999 113.8 -179.851 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -84.08 -60.01 2.23 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.272 -0.893 . . . . 2.3900000000000001 112.239 162.277 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -64.64 -30.88 71.91 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.075 -1.016 . . . . 1.76 113.575 -175.0 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -48.8 -34.11 11.73 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 114.277 1.214 . . . . 2.6899999999999999 114.277 167.633 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -95.42 -36.87 11.18 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.865 0.866 . . . . 2.5099999999999998 110.385 -176.012 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.8 t -70.15 -35.74 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 N-CA-C 114.244 1.201 . . . . 3.0299999999999998 114.244 175.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.6 p 154.91 -89.4 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 129.983 3.313 . . . . 4.21 111.295 175.276 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -173.19 -64.21 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.792 1.637 . . . . 7.1200000000000001 111.457 -174.684 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -117.18 -26.99 6.6 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.296 1.038 . . . . 7.7000000000000002 112.239 -173.298 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.9 p -98.83 102.54 14.31 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.14 1.376 . . . . 4.9100000000000001 113.099 -171.094 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 79.8 mt -55.5 -41.65 73.36 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.059 0.944 . . . . 7.5899999999999999 113.458 -176.745 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 39.8 t -134.16 77.21 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 125.754 1.622 . . . . 4.5800000000000001 110.562 174.289 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -127.47 -10.96 5.7 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.416 1.265 . . . . 8.0399999999999991 114.416 157.053 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -146.86 -65.21 0.28 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.582 0.753 . . . . 6.8300000000000001 110.876 163.906 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.403 ' HE3' ' HB2' ' A' ' 32' ' ' LYS . 21.5 mtmt 81.66 -156.96 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 127.357 2.263 . . . . 7.2999999999999998 111.971 178.014 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 29.7 pt -125.38 166.7 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 C-N-CA 126.378 1.871 . . . . 2.3100000000000001 109.377 175.639 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.4 m -98.77 139.83 33.87 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.011 0.924 . . . . 2.2799999999999998 109.353 163.143 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -54.45 -31.04 54.68 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 122.861 1.315 . . . . 2.2599999999999998 113.28 -177.19 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.2 p -60.77 -24.22 65.6 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.864 1.666 . . . . 1.8200000000000001 114.615 173.723 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.5 m -80.78 -33.43 34.94 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.08 0.952 . . . . 1.21 112.425 174.691 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.441 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 28.8 t80 -59.98 -49.28 78.28 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.072 -1.018 . . . . 2.1400000000000001 111.309 178.232 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 24.5 ptt180 -58.97 -25.21 63.36 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.94 0.718 . . . . 2.4300000000000002 112.94 176.159 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -88.08 -47.54 8.42 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 125.298 1.439 . . . . 2.5499999999999998 111.276 -178.741 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -45.77 -43.39 13.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.332 1.453 . . . . 1.3 111.43 167.949 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.441 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 44.5 mt -67.9 -4.26 12.32 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 115.474 1.657 . . . . 1.4199999999999999 115.474 175.252 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -98.22 -19.25 17.97 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.166 1.787 . . . . 2.7400000000000002 113.611 166.657 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.47 -57.1 2.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.371 1.468 . . . . 1.5600000000000001 112.774 -178.669 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -79.2 -15.8 57.51 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.097 -1.002 . . . . 3.6699999999999999 111.849 -178.085 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -126.66 45.85 2.6 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 127.508 2.323 . . . . 1.9299999999999999 110.672 176.101 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -87.34 -16.41 35.11 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 116.057 1.873 . . . . 1.3700000000000001 116.057 -175.314 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -98.57 -17.84 18.46 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 121.402 1.91 . . . . 1.6100000000000001 112.196 -175.744 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.0 tpp -77.03 -13.29 59.98 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.874 1.67 . . . . 1.8700000000000001 112.543 166.423 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.3 tp -72.97 89.85 1.45 Allowed 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 124.142 1.925 . . . . 3.5800000000000001 112.813 -173.648 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.6 t -82.38 71.94 9.44 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 112.999 -1.909 . . . . 4.1299999999999999 110.027 163.284 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.1 t70 82.26 159.78 0.14 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 127.627 2.371 . . . . 3.8700000000000001 116.266 165.114 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -28.21 -41.28 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 130.959 3.704 . . . . 2.21 114.475 159.371 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.91 -50.87 62.76 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-N 119.596 1.089 . . . . 1.6499999999999999 112.36 176.296 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -64.39 -32.21 73.74 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.892 -0.769 . . . . 3.2799999999999998 112.263 172.795 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -66.33 -50.47 63.49 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 120.104 1.32 . . . . 6.1399999999999997 112.871 173.506 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.8 mmmt -49.26 -40.84 35.72 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 119.144 0.884 . . . . 5.2599999999999998 112.283 170.022 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' A' ' 61' ' ' LYS . . . -61.16 -18.72 59.59 Favored 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 115.622 1.712 . . . . 1.1899999999999999 115.622 177.453 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.418 ' HB2' HG12 ' A' ' 86' ' ' ILE . . . -78.2 -52.87 8.03 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.797 0.839 . . . . 0.81000000000000005 111.882 163.188 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -60.28 -29.41 68.79 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.888 2.075 . . . . 2.7200000000000002 113.433 -177.163 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.497 ' HG2' ' HA ' ' A' ' 58' ' ' ALA . 2.1 ptmm? -56.51 -32.03 64.66 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 120.763 -1.21 . . . . 3.5800000000000001 113.015 167.562 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.9 mt -67.38 -42.15 83.83 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.493 -0.754 . . . . 0.92000000000000004 111.507 176.406 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.9 mm -57.79 -50.09 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.774 1.23 . . . . 0.93999999999999995 110.385 -173.013 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -67.31 -36.57 81.76 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.373 1.069 . . . . 1.9399999999999999 112.621 -179.085 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -65.81 -28.44 69.0 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 112.747 0.647 . . . . 3.9100000000000001 112.747 172.628 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 tt -91.94 -21.72 20.41 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.409 1.083 . . . . 2.4100000000000001 113.121 -178.366 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -59.21 -19.1 42.56 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.014 1.116 . . . . 2.5699999999999998 114.014 162.15 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.66 -9.28 59.8 Favored 'General case' 0 CA--C 1.553 1.096 0 N-CA-C 115.26 1.578 . . . . 2.6200000000000001 115.26 164.849 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -148.13 59.22 1.1 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 120.547 1.521 . . . . 3.1600000000000001 114.048 -166.116 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.9 t60 -168.64 112.93 0.59 Allowed 'General case' 0 N--CA 1.48 1.029 0 O-C-N 120.11 -1.619 . . . . 4.6500000000000004 113.34 -173.79 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.93 30.38 0.17 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.276 2.23 . . . . 7.1600000000000001 113.864 -175.785 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.93 8.06 72.25 Favored Glycine 0 CA--C 1.537 1.424 0 O-C-N 120.07 -1.644 . . . . 3.1600000000000001 113.468 -169.826 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 10.8 mmt-85 -98.98 98.7 9.72 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 125.964 1.706 . . . . 4.9100000000000001 108.909 -178.148 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.5 mm -68.69 113.16 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 N-CA-C 105.729 -1.952 . . . . 2.2000000000000002 105.729 164.801 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.8 m -80.25 165.64 22.16 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.049 0.841 . . . . 1.4199999999999999 112.297 167.798 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -59.59 -48.75 80.42 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 122.508 1.147 . . . . 2.0499999999999998 110.407 161.607 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.1 -22.73 66.04 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.722 2.009 . . . . 2.8700000000000001 113.482 177.457 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -66.66 -50.13 63.95 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.304 0.957 . . . . 2.8100000000000001 111.098 174.968 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -56.09 -49.8 72.83 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 120.857 -1.152 . . . . 1.8 111.694 173.314 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.1 t-105 -63.64 -47.99 79.1 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 121.69 -0.631 . . . . 0.52000000000000002 112.206 -176.095 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 t -67.04 -26.79 66.93 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.354 -0.831 . . . . 1.5800000000000001 111.978 -179.945 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.6 mt -72.43 -35.59 68.37 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.306 -1.331 . . . . 0.60999999999999999 112.921 171.725 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.5 mm -57.47 -39.29 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 CA-C-N 121.605 2.002 . . . . 0.68999999999999995 111.912 178.271 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.5 -10.84 67.44 Favored Glycine 0 N--CA 1.475 1.298 0 C-N-CA 124.291 0.948 . . . . 0.73999999999999999 114.045 175.917 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.99 -17.91 66.34 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.792 1.187 . . . . 0.77000000000000002 113.562 176.018 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.418 HG12 ' HB2' ' A' ' 59' ' ' ALA . 0.2 OUTLIER -104.09 -45.7 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.667 1.187 . . . . 1.03 109.637 166.999 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 30.7 m -75.02 96.53 3.21 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.103 1.361 . . . . 1.3100000000000001 109.042 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -168.97 -74.02 0.04 OUTLIER Glycine 0 CA--C 1.532 1.127 0 CA-C-O 118.44 -1.2 . . . . 0.97999999999999998 113.481 -175.807 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -63.18 -45.81 11.5 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.652 2.235 . . . . 1.2 111.531 179.325 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.1 pt -71.82 -13.53 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 114.019 1.118 . . . . 1.1000000000000001 114.019 176.013 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.78 -52.96 63.33 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.148 1.34 . . . . 1.0600000000000001 112.922 177.916 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -61.01 -33.56 73.45 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.423 -1.423 . . . . 3.0800000000000001 112.669 173.957 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.6 -45.55 86.48 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.478 0.711 . . . . 1.0600000000000001 110.865 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.8 mt -49.77 -58.3 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.273 0.629 . . . . 0.98999999999999999 110.277 168.363 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -73.16 -20.01 61.0 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.434 0.901 . . . . 2.5600000000000001 113.434 -169.643 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.287 4.0 pt-20 -88.07 -21.9 24.46 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.586 0.754 . . . . 2.6899999999999999 111.987 175.055 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -79.96 -38.72 31.7 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 125.057 1.343 . . . . 2.7400000000000002 114.336 172.23 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.62 9.84 0.58 Allowed 'General case' 0 N--CA 1.487 1.391 0 CA-C-O 123.659 1.695 . . . . 2.5600000000000001 112.682 177.438 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -124.87 -68.43 0.85 Allowed 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 126.827 2.051 . . . . 2.6899999999999999 109.965 175.208 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 54.34 4.82 0.07 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 129.16 2.984 . . . . 4.4900000000000002 115.658 170.029 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.7 m -128.94 16.9 6.24 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.021 1.328 . . . . 7.0300000000000002 112.338 -168.32 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 24.1 t -104.05 -5.56 22.0 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 114.36 1.245 . . . . 9.0299999999999994 114.36 -178.993 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.2 m . . . . . 0 C--O 1.25 1.095 0 C-N-CA 127.469 2.307 . . . . 9.7300000000000004 110.161 -167.906 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 42.8 m . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 118.398 -0.811 . . . . 9.7599999999999998 110.211 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -74.19 -111.68 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 106.376 -1.713 . . . . 5.9500000000000002 106.376 136.838 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 90.2 m -68.07 -94.56 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.719 1.608 . . . . 4.4900000000000002 112.043 166.064 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -27.89 108.48 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 127.076 2.151 . . . . 2.1800000000000002 114.992 -170.547 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.7 p -65.29 156.29 32.47 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.232 1.013 . . . . 1.01 110.252 -173.494 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -58.25 -33.82 69.78 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 118.555 0.616 . . . . 2.3500000000000001 112.39 179.767 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 tt -67.57 -44.11 78.99 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.769 1.628 . . . . 0.91000000000000003 110.605 177.956 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -72.83 -46.01 55.33 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.35 -0.844 . . . . 2.77 111.287 -178.428 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -53.05 -39.23 63.1 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.828 1.651 . . . . 5.3099999999999996 111.101 165.503 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.869 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.08 -44.85 78.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 120.686 -1.259 . . . . 0.54000000000000004 112.73 173.269 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 75.7 t -55.4 -41.5 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 121.132 1.787 . . . . 0.65000000000000002 110.608 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 91.1 mt -56.35 -48.33 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 119.322 0.965 . . . . 0.79000000000000004 111.465 170.583 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 37.7 t -65.01 -36.58 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 119.887 1.221 . . . . 0.47999999999999998 113.3 178.876 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.99 -45.83 80.19 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.13 -0.981 . . . . 0.93999999999999995 110.783 172.602 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 48.2 t -62.49 -40.67 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.105 1.362 . . . . 0.72999999999999998 111.647 176.116 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -64.67 -49.07 72.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.462 1.505 . . . . 3.02 111.347 176.163 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -80.65 14.0 2.3 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.232 1.013 . . . . 2.8100000000000001 113.672 -179.052 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -108.31 -58.14 2.03 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.271 1.428 . . . . 2.1099999999999999 111.321 163.963 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -64.35 -27.46 69.04 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 120.71 -1.244 . . . . 1.8200000000000001 113.506 -175.993 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 17.3 mtpt -45.98 -37.41 6.52 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.186 1.18 . . . . 2.3999999999999999 114.186 164.62 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -90.74 -34.6 15.3 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.956 1.302 . . . . 2.6899999999999999 111.258 -176.431 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 67.3 t -68.4 -44.27 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 124.93 1.292 . . . . 3.21 113.485 175.233 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 78.0 p 155.65 -94.77 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 130.417 3.487 . . . . 4.2000000000000002 110.532 -178.206 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -170.63 -66.93 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.568 1.147 . . . . 7.21 112.301 -174.497 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -106.12 -36.16 7.0 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 122.127 0.965 . . . . 7.5099999999999998 111.851 -177.342 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 13.1 p -90.65 116.03 28.21 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.609 1.164 . . . . 4.8099999999999996 112.349 -174.585 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 74.0 mt -59.39 -43.79 92.87 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.294 0.638 . . . . 7.7599999999999998 112.633 177.521 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 132' ' ' VAL . . . . . 0.448 HG13 ' HD3' ' B' ' 135' ' ' LYS . 87.6 t -134.2 78.31 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.801 1.24 . . . . 4.3099999999999996 111.129 -177.092 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -134.58 -12.45 2.34 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 115.245 1.572 . . . . 7.6500000000000004 115.245 165.84 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -143.76 -58.01 0.39 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.305 0.957 . . . . 6.8300000000000001 110.148 159.288 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 135' ' ' LYS . . . . . 0.448 ' HD3' HG13 ' B' ' 132' ' ' VAL . 18.7 mtmt 79.24 -177.72 0.09 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.891 2.076 . . . . 7.1699999999999999 112.351 174.418 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 14.4 pt -87.6 161.59 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.619 0.768 . . . . 2.7400000000000002 111.993 167.509 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 51.5 m -93.45 138.66 31.54 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 108.621 -0.881 . . . . 2.3199999999999998 108.621 156.63 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -55.03 -32.13 61.61 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 119.918 1.235 . . . . 2.2000000000000002 113.313 -173.762 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 50.1 p -64.82 -17.3 64.11 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.533 1.533 . . . . 1.6399999999999999 114.798 176.078 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 43.4 m -85.8 -35.94 20.38 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.947 1.249 . . . . 1.21 112.329 -179.608 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.507 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 11.3 t80 -49.92 -54.14 21.59 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.542 1.137 . . . . 2.1600000000000001 111.047 173.756 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -62.11 -17.83 58.93 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.213 0.82 . . . . 2.2599999999999998 113.213 179.505 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -94.94 -43.83 7.99 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.671 1.588 . . . . 2.3100000000000001 112.516 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -49.39 -41.59 39.86 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.926 -1.109 . . . . 1.26 110.483 162.275 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 145' ' ' LEU . . . . . 0.45 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 17.2 mt -67.49 -8.25 32.11 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 116.389 1.996 . . . . 1.4399999999999999 116.389 171.073 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -93.88 -23.02 18.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.95 1.3 . . . . 2.6200000000000001 113.697 164.843 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.13 -60.99 1.43 Allowed 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.841 1.201 . . . . 1.74 113.54 -178.502 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -76.46 -10.68 59.57 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.619 -1.3 . . . . 3.1899999999999999 112.638 -174.573 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.88 31.75 5.24 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 128.012 2.525 . . . . 1.5800000000000001 111.678 175.142 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -69.16 -29.64 67.69 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.967 1.469 . . . . 1.28 114.967 -171.717 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -86.83 -24.98 24.77 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.391 0.996 . . . . 1.55 111.416 -171.786 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 5.0 tpp -61.81 -17.54 56.57 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.189 0.996 . . . . 1.8600000000000001 112.719 167.869 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 16.8 tp -80.9 88.71 5.87 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 123.258 1.504 . . . . 2.8300000000000001 112.168 -169.993 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 40.2 t -71.27 65.37 0.41 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 113.825 -1.534 . . . . 4.3399999999999999 110.63 158.269 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 35.2 t70 95.38 156.09 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 129.37 3.068 . . . . 3.8500000000000001 115.936 166.761 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.6 m -34.16 -38.6 0.06 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 130.878 3.671 . . . . 2.48 114.496 158.94 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -57.89 -43.49 94.79 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 120.1 1.318 . . . . 1.6599999999999999 111.748 176.131 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -68.93 -21.36 64.21 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 113.413 0.894 . . . . 3.5299999999999998 113.413 172.857 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -75.06 -45.45 41.41 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 121.182 1.81 . . . . 6.5599999999999996 112.741 167.617 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -53.18 -40.61 64.49 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.548 0.613 . . . . 4.04 111.419 175.367 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -51.85 -45.28 63.96 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.388 0.884 . . . . 1.5600000000000001 113.388 171.698 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -63.49 -38.65 91.96 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.175 0.99 . . . . 0.84999999999999998 113.176 177.011 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -32.77 74.5 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.694 0.998 . . . . 2.4100000000000001 113.694 175.537 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -53.63 -40.95 66.23 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.423 1.01 . . . . 3.2999999999999998 111.795 173.138 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.38 -39.87 92.25 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.149 -0.932 . . . . 0.80000000000000004 111.416 179.202 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 24.8 mm -61.58 -46.92 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 123.887 0.875 . . . . 0.91000000000000003 110.967 -178.107 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -69.29 -37.48 77.85 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.036 0.446 . . . . 2.3599999999999999 112.184 177.579 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 -64.61 -26.73 68.53 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 112.646 0.61 . . . . 3.6299999999999999 112.646 176.706 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.55 -28.12 18.7 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.613 0.765 . . . . 2.4500000000000002 113.02 179.616 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.42 -37.95 40.55 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.715 0.806 . . . . 2.98 112.663 164.11 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -63.89 -10.67 22.14 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 115.5 1.667 . . . . 2.9900000000000002 115.5 173.681 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -131.46 6.54 4.45 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.86 1.43 . . . . 3.1000000000000001 114.86 -173.069 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 -156.99 114.92 3.2 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 116.121 1.897 . . . . 3.4900000000000002 116.121 -158.459 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.35 6.74 9.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 128.328 2.651 . . . . 5.4800000000000004 114.977 -170.137 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 92.04 10.94 60.66 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 125.689 1.614 . . . . 2.6600000000000001 112.952 -166.395 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -76.03 67.56 2.39 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.301 1.84 . . . . 5.7999999999999998 110.877 170.11 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 41.4 mm -52.7 133.65 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.431 1.092 . . . . 2.3500000000000001 110.483 175.969 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.74 164.99 16.49 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.094 1.758 . . . . 1.74 110.678 -179.496 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -66.22 -43.21 87.34 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 122.171 0.986 . . . . 2.23 111.534 169.806 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.15 -25.56 67.09 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.815 2.446 . . . . 3.0600000000000001 113.391 177.251 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -62.75 -59.68 4.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 118.76 0.709 . . . . 3.6800000000000002 110.269 175.525 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -52.82 -49.03 66.48 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.612 -0.68 . . . . 2.0499999999999998 110.653 178.327 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 21.0 t-105 -61.84 -48.48 80.38 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.447 0.536 . . . . 0.60999999999999999 112.447 -177.185 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.5 t -70.72 -27.15 63.76 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.078 -0.963 . . . . 1.55 112.075 -179.279 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.507 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 53.2 mt -72.99 -38.98 66.43 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 116.895 -1.526 . . . . 0.64000000000000001 112.656 171.775 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 25.9 mm -52.96 -42.66 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 CA-C-N 121.683 2.038 . . . . 0.59999999999999998 111.579 178.775 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.65 -14.32 64.79 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.556 1.074 . . . . 0.65000000000000002 114.688 177.305 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -79.27 -20.33 69.86 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 118.493 1.147 . . . . 0.75 112.916 176.289 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 189' ' ' ILE . . . . . 0.407 HD12 ' H ' ' B' ' 189' ' ' ILE . 0.4 OUTLIER -101.36 -40.78 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 CA-C-N 118.317 1.058 . . . . 1.1000000000000001 110.046 167.019 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 14.0 m -79.17 86.74 4.94 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.606 1.562 . . . . 1.3899999999999999 109.0 -178.724 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -164.21 -72.91 0.03 OUTLIER Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.39 1.472 . . . . 0.84999999999999998 113.204 -174.491 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -62.4 -45.69 14.16 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.999 2.466 . . . . 1.01 111.913 178.902 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 21.0 pt -68.92 -17.7 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 113.889 1.07 . . . . 0.93000000000000005 113.889 174.42 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -55.11 -56.23 22.24 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.216 1.371 . . . . 0.97999999999999998 113.629 -178.849 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -60.81 -35.02 75.44 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.685 -1.259 . . . . 3.3199999999999998 112.439 175.701 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 5.4 tt -61.48 -47.16 86.95 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.189 0.996 . . . . 1.3999999999999999 110.249 178.969 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 45.9 mt -51.17 -59.83 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.386 1.074 . . . . 1.03 110.835 171.545 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -71.13 -18.28 62.52 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.423 0.897 . . . . 2.5299999999999998 113.423 -174.264 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.328 5.0 pt-20 -85.39 -28.12 25.35 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.868 0.758 . . . . 2.8199999999999998 112.462 173.262 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -80.02 -35.43 37.31 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.059 1.344 . . . . 2.8399999999999999 114.579 174.407 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -72.6 8.75 1.31 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 123.527 1.632 . . . . 2.3399999999999999 112.266 176.325 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -125.41 -67.64 0.88 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 126.661 1.985 . . . . 2.8799999999999999 110.089 174.42 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 54.67 5.32 0.09 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 128.839 2.855 . . . . 4.5199999999999996 115.349 171.53 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 3.8 m -133.75 17.11 3.91 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.909 1.284 . . . . 6.5999999999999996 111.956 -166.372 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 29.4 t -99.4 -10.95 21.6 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.293 1.219 . . . . 8.7200000000000006 114.293 179.391 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 C--O 1.253 1.242 0 C-N-CA 126.674 1.99 . . . . 9.4600000000000009 110.365 -162.63 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 CA--C 1.501 -0.921 0 N-CA-C 108.501 -0.926 . . . . 11.970000000000001 108.501 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -132.76 -5.33 3.2 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 117.985 -1.486 . . . . 6.5999999999999996 114.709 -130.047 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 21.6 m -70.41 23.28 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.513 2.325 . . . . 3.9399999999999999 115.127 -176.027 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -22.37 97.15 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 127.929 2.492 . . . . 2.6000000000000001 114.489 -169.321 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 p -73.2 150.93 41.69 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.212 0.605 . . . . 1.1699999999999999 110.362 -161.973 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -59.62 -34.19 72.45 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.59 1.086 . . . . 2.9300000000000002 113.507 -176.733 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.62 -56.86 13.9 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.161 -0.681 . . . . 1.3600000000000001 109.161 172.066 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -62.58 -61.36 2.48 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 124.13 0.972 . . . . 3.04 110.318 -172.132 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -20.93 66.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.035 0.534 . . . . 5.3300000000000001 110.761 -172.597 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.458 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -75.13 -23.64 57.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 120.195 -1.566 . . . . 0.78000000000000003 113.541 172.679 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.8 t -57.09 -32.76 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.674 1.579 . . . . 0.68000000000000005 110.784 168.306 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.7 mt -56.08 -57.74 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 CA-C-N 118.661 0.664 . . . . 0.84999999999999998 109.869 167.542 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.1 t -55.7 -39.72 56.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 125.301 1.44 . . . . 0.79000000000000004 112.377 -178.483 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 mp -67.13 -24.32 65.9 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.676 1.19 . . . . 0.94999999999999996 113.425 176.323 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.0 t -89.33 -45.9 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.824 0.738 . . . . 0.88 111.537 175.692 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -45.94 -55.76 6.35 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.215 1.406 . . . . 3.3799999999999999 111.843 -178.515 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -47.5 -43.29 24.47 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.968 1.707 . . . . 3.1000000000000001 114.515 178.705 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -81.83 -21.55 37.53 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.127 0.971 . . . . 2.1600000000000001 113.209 -174.742 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -85.77 -32.06 22.03 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.154 -0.966 . . . . 2.2000000000000002 112.454 165.941 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.8 tttp -50.39 -38.63 43.75 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.585 1.954 . . . . 4.2599999999999998 113.843 178.659 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -85.5 8.95 17.26 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.321 1.449 . . . . 2.3700000000000001 114.212 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.8 m -141.14 -174.37 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.541 1.536 . . . . 2.29 110.37 178.006 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.4 p -172.09 -77.21 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.288 -0.882 . . . . 4.5199999999999996 111.779 178.2 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? 177.86 -27.12 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 129.644 3.178 . . . . 12.17 110.925 -165.233 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -89.26 70.75 8.25 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.684 1.194 . . . . 11.49 111.192 -179.521 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.5 m -173.73 158.52 3.31 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.024 1.73 . . . . 8.3399999999999999 110.779 179.008 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.8 mt -61.95 0.54 0.37 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 126.974 2.11 . . . . 14.59 115.898 -172.408 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.7 t -147.97 136.94 15.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 128.59 2.756 . . . . 5.21 105.29 169.794 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.35 -36.09 52.78 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.372 1.069 . . . . 9.8499999999999996 113.773 -174.72 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -131.14 124.16 30.13 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.547 1.939 . . . . 10.98 108.852 165.762 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -170.88 112.0 0.38 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.197 1.399 . . . . 6.9199999999999999 111.242 171.481 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.8 pt -75.33 -176.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.549 0.74 . . . . 2.48 110.01 164.735 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.8 t -81.48 137.61 35.59 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.457 -1.402 . . . . 2.5499999999999998 108.285 157.026 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -58.47 -32.5 68.81 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.917 -1.114 . . . . 2.25 110.986 170.219 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m -66.26 -18.68 65.5 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.849 1.659 . . . . 2.0899999999999999 114.182 170.052 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 53.2 m -69.21 -41.94 76.4 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.742 1.61 . . . . 1.1000000000000001 111.386 173.057 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -50.46 -50.42 52.41 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.664 1.186 . . . . 2.0899999999999999 113.009 -171.459 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -59.7 -25.66 64.96 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.835 1.654 . . . . 3.9900000000000002 113.757 178.586 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -98.96 -44.44 6.32 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 124.991 1.316 . . . . 2.7599999999999998 111.851 -175.641 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 17.9 ptm -57.42 -32.43 66.86 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.66 -1.275 . . . . 2.8500000000000001 111.848 169.514 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.3 mt -61.14 -14.1 22.4 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.388 1.625 . . . . 1.0600000000000001 115.388 166.109 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -109.44 -5.35 15.82 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 120.322 1.419 . . . . 2.1800000000000002 114.175 169.082 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.76 -74.72 0.5 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.74 1.155 . . . . 1.51 109.824 166.445 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -59.1 -34.52 72.1 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.555 1.142 . . . . 3.3799999999999999 113.823 -177.284 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.18 9.47 34.12 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.243 1.572 . . . . 1.6299999999999999 115.243 -173.583 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -48.16 -34.58 10.19 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.518 1.673 . . . . 1.3400000000000001 115.518 -172.181 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.402 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 73.5 m-70 -62.01 -34.98 77.2 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.965 -1.085 . . . . 1.6799999999999999 112.931 -177.333 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.9 tpp -85.0 -3.04 58.63 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.949 1.7 . . . . 1.95 112.871 -178.467 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.2 mp -96.61 112.32 24.12 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.182 1.393 . . . . 2.7200000000000002 111.351 -178.813 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 t -75.56 62.96 1.47 Allowed 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.418 -0.801 . . . . 4.2699999999999996 109.376 152.565 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.6 t70 38.29 -109.61 0.08 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.234 2.214 . . . . 7.1500000000000004 111.802 -166.661 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.84 -14.44 36.92 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 126.481 1.913 . . . . 2.3300000000000001 114.213 -173.896 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -63.85 -30.86 78.92 Favored Glycine 0 CA--C 1.533 1.166 0 CA-C-N 120.732 1.606 . . . . 3.1600000000000001 111.175 168.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -78.46 -75.65 0.22 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.16 0.584 . . . . 3.6299999999999999 110.464 157.793 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.0 ttp-105 -51.91 -28.75 17.39 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 117.837 2.532 . . . . 5.3099999999999996 117.837 -161.816 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -53.69 -35.85 61.54 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 121.122 1.783 . . . . 3.6400000000000001 112.684 170.311 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.33 -26.37 68.4 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.796 1.406 . . . . 1.1799999999999999 114.796 172.888 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.33 -42.59 68.38 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.561 1.073 . . . . 0.88 111.366 171.224 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -68.31 -29.67 68.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.747 1.219 . . . . 1.97 112.991 -175.778 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -48.69 -40.05 26.8 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.013 0.911 . . . . 3.5099999999999998 113.042 165.266 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.9 mt -78.55 -36.65 44.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.729 -1.123 . . . . 1.0800000000000001 111.672 -176.596 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.9 mm -54.68 -53.69 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 122.99 0.516 . . . . 1.1299999999999999 110.386 175.41 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -65.45 -34.42 78.25 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.284 0.846 . . . . 2.0800000000000001 113.284 -179.508 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -62.59 -29.22 70.44 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.312 1.045 . . . . 2.6299999999999999 112.584 176.201 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -88.56 -37.23 15.86 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.246 1.018 . . . . 2.71 111.669 170.865 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.84 -24.43 67.74 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.914 -1.116 . . . . 3.3799999999999999 113.945 177.618 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.86 -11.99 21.9 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.927 1.455 . . . . 3.1099999999999999 114.927 169.823 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -160.31 -17.89 0.06 Allowed 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 118.609 2.818 . . . . 2.9100000000000001 118.609 -171.747 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -96.47 114.68 26.37 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 121.511 1.959 . . . . 4.3600000000000003 111.149 175.831 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -63.54 -18.27 63.67 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.943 2.497 . . . . 4.0499999999999998 115.631 -172.207 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 118.0 2.03 16.49 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.943 -0.921 . . . . 2.75 113.269 -160.736 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -66.18 145.49 55.73 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.726 1.263 . . . . 4.1799999999999997 110.057 137.731 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 13.6 mt -128.33 149.57 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 127.227 2.211 . . . . 2.6600000000000001 106.02 167.954 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.7 t -123.75 159.98 28.29 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 114.0 1.111 . . . . 1.47 114.0 -174.372 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -73.74 -30.56 62.89 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 120.49 -1.381 . . . . 2.3599999999999999 113.647 -173.177 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -70.3 -25.61 63.41 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.169 1.388 . . . . 3.9399999999999999 112.739 168.882 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.5 tt0 -58.01 -58.19 9.5 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.276 1.03 . . . . 3.3500000000000001 111.33 -175.523 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -56.14 -46.86 79.09 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.963 -1.086 . . . . 2.23 112.403 -176.287 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.8 t-105 -61.46 -45.94 92.16 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.856 -0.592 . . . . 0.64000000000000001 111.278 178.223 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -38.22 90.11 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.595 0.758 . . . . 1.5800000000000001 111.61 178.504 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.2 mt -60.75 -46.05 91.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 118.269 -0.872 . . . . 0.77000000000000002 111.754 174.782 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 31.0 mm -51.35 -40.56 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 CA-C-N 120.485 1.493 . . . . 0.69999999999999996 112.872 -178.726 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.86 -16.81 57.35 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.079 0.847 . . . . 0.68000000000000005 114.452 177.151 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.4 -19.61 76.19 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 121.124 -1.221 . . . . 0.89000000000000001 113.358 172.393 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.8 mp -103.02 -48.67 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 118.695 1.248 . . . . 0.91000000000000003 109.879 171.083 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.6 m -72.44 53.76 0.31 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.587 2.355 . . . . 1.3400000000000001 110.077 163.634 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -127.46 -71.46 0.17 Allowed Glycine 0 CA--C 1.528 0.886 0 C-N-CA 128.422 2.915 . . . . 0.76000000000000001 107.998 172.111 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.9 -52.3 0.7 Allowed 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.441 2.76 . . . . 0.96999999999999997 113.484 175.844 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -72.29 -18.95 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 119.632 1.105 . . . . 1.1100000000000001 113.716 -173.994 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -51.15 -59.63 3.98 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.191 1.397 . . . . 0.88 112.325 -178.522 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -56.09 -45.29 79.43 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.477 0.547 . . . . 2.6400000000000001 112.477 175.961 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -56.97 -42.65 80.54 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 125.094 1.358 . . . . 1.27 111.286 -174.704 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.2 mt -54.95 -55.92 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.776 0.83 . . . . 1.6399999999999999 110.756 176.374 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -63.43 -37.39 87.09 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.446 -0.784 . . . . 2.1299999999999999 112.189 -179.568 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -66.37 -32.57 74.04 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.004 0.921 . . . . 3.0499999999999998 110.932 177.117 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -69.97 -40.44 75.37 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 117.496 -1.24 . . . . 2.71 113.414 170.456 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -59.33 -41.5 89.29 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.2 1.364 . . . . 2.7400000000000002 111.432 177.578 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.02 -40.85 97.24 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.456 -0.778 . . . . 2.98 111.01 179.194 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -72.95 -15.0 61.57 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 114.381 -1.282 . . . . 5.7400000000000002 112.905 178.037 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.5 t 60.64 27.92 17.62 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.977 2.111 . . . . 7.6500000000000004 113.064 177.696 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.9 t -124.41 50.77 1.65 Allowed 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.411 1.263 . . . . 12.69 114.411 -153.343 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 26.3 t . . . . . 0 N--CA 1.484 1.228 0 N-CA-C 113.534 0.938 . . . . 16.5 113.534 160.226 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 CA--C 1.502 -0.887 0 N-CA-C 108.684 -0.858 . . . . 12.0 108.684 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -132.07 -6.2 3.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 118.453 -1.299 . . . . 6.3399999999999999 114.343 -130.943 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 41.0 m -72.78 35.22 0.07 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.911 2.084 . . . . 3.8100000000000001 113.63 177.845 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.402 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 15.2 m-85 -32.44 102.65 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.65 2.38 . . . . 2.48 112.501 -174.194 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 3.1 p -74.3 152.08 39.71 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.434 0.294 . . . . 1.2 111.059 -160.06 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -60.1 -21.96 62.16 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.218 1.192 . . . . 2.3799999999999999 114.218 -177.61 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 tt -80.56 -48.04 13.31 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.767 0.827 . . . . 1.6599999999999999 110.183 171.614 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -67.36 -58.48 4.7 Favored 'General case' 0 C--N 1.333 -0.131 0 C-N-CA 123.404 0.682 . . . . 2.9199999999999999 111.036 -175.991 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -20.1 56.75 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.152 0.981 . . . . 4.8899999999999997 112.072 -176.689 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.458 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.3 -34.33 74.52 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.321 -1.487 . . . . 0.60999999999999999 113.425 170.183 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 58.6 t -58.02 -32.9 44.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.254 0.934 . . . . 0.62 110.905 175.703 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 44.0 mt -55.92 -57.66 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 109.079 -0.711 . . . . 1.0 109.079 168.735 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 72.3 t -60.74 -36.54 71.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 125.756 1.622 . . . . 0.79000000000000004 112.932 -176.251 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.65 -38.57 84.02 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.641 -0.662 . . . . 1.0 112.135 175.121 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 60.2 t -76.32 -39.05 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-N 118.503 0.592 . . . . 0.78000000000000003 110.955 178.464 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -51.93 -45.88 64.48 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.868 1.667 . . . . 2.7999999999999998 111.36 175.562 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -58.97 -33.77 71.04 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.362 1.465 . . . . 3.3300000000000001 114.405 175.917 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -80.82 -43.78 19.51 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.656 0.662 . . . . 2.0499999999999998 112.311 -179.541 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -72.3 -27.31 62.37 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.406 -0.809 . . . . 2.1600000000000001 112.654 176.452 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -42.2 -43.74 3.49 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.179 1.792 . . . . 3.3399999999999999 114.128 171.432 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 -97.77 18.67 15.18 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.132 1.373 . . . . 2.4500000000000002 113.732 -172.159 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 34.9 m -146.27 -176.51 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 126.152 1.781 . . . . 2.2200000000000002 110.278 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 16.6 p -173.05 -74.12 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.057 -1.027 . . . . 4.6299999999999999 111.797 174.272 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? 172.85 -26.4 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 130.3 3.44 . . . . 11.869999999999999 110.538 -163.301 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -89.71 70.09 7.73 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.096 1.358 . . . . 11.199999999999999 111.157 179.764 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 2.5 m -175.03 159.5 2.64 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.222 1.809 . . . . 8.2699999999999996 110.791 -178.72 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 28.1 mt -62.05 0.97 0.33 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 126.825 2.05 . . . . 14.539999999999999 115.705 -173.745 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 21.2 t -149.41 138.2 15.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 128.659 2.784 . . . . 5.25 105.453 172.597 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.73 -37.41 59.18 Favored 'General case' 0 CA--C 1.55 0.958 0 N-CA-C 113.351 0.871 . . . . 9.8300000000000001 113.351 -177.176 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -131.27 131.94 44.22 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.285 1.834 . . . . 11.0 108.493 165.268 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 3.5 tmmm? -177.75 113.17 0.08 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.528 1.931 . . . . 6.8499999999999996 110.613 171.791 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 43.3 pt -76.38 -175.69 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 122.988 0.515 . . . . 2.5899999999999999 110.325 165.271 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 33.7 t -85.52 136.55 33.37 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.595 -1.316 . . . . 2.4399999999999999 108.703 157.393 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 17.5 ttpt -59.47 -30.72 68.73 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.97 -1.081 . . . . 2.3199999999999998 111.628 174.638 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 1.7 m -67.62 -18.59 65.02 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.918 1.687 . . . . 1.99 113.879 171.232 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.6 m -70.59 -40.78 73.05 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 120.29 1.405 . . . . 1.0900000000000001 112.316 175.168 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.427 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 64.7 t80 -51.21 -53.55 34.04 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.646 1.179 . . . . 2.1800000000000002 113.12 -173.409 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -54.75 -22.43 14.09 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.074 1.75 . . . . 4.21 114.076 178.254 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -106.46 -38.24 6.25 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.999 1.32 . . . . 3.2599999999999998 113.064 -176.268 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -47.31 -43.16 22.4 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.778 1.231 . . . . 1.46 110.847 161.613 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 25.5 mt -63.26 -12.1 26.48 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 116.174 1.916 . . . . 1.3100000000000001 116.174 171.578 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -113.98 -8.13 13.09 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.106 1.521 . . . . 2.3799999999999999 115.106 167.672 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -76.41 0.44 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.363 0.983 . . . . 1.46 110.015 167.225 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -58.92 -36.3 74.52 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.525 1.511 . . . . 3.5800000000000001 114.4 -178.856 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.25 9.5 43.26 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 115.359 1.614 . . . . 1.6899999999999999 115.359 -174.35 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -47.17 -33.62 5.43 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.197 1.925 . . . . 1.3899999999999999 116.197 -170.522 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -65.07 -35.38 80.98 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.942 1.246 . . . . 1.73 113.341 -175.5 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 18.3 tpp -78.99 -8.76 59.2 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.304 1.442 . . . . 1.9299999999999999 113.142 -177.09 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.5 mp -92.34 114.43 26.98 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 120.58 -1.325 . . . . 2.7200000000000002 112.522 -172.185 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 29.8 t -73.93 60.75 0.76 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 115.784 -0.644 . . . . 4.2599999999999998 109.533 154.059 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 35.3 t70 36.86 -107.64 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.832 2.053 . . . . 6.7699999999999996 112.007 -165.991 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.04 -17.92 26.91 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 126.805 2.042 . . . . 2.4700000000000002 113.853 -174.189 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -62.55 -29.33 73.23 Favored Glycine 0 N--CA 1.473 1.164 0 CA-C-N 120.908 1.685 . . . . 3.2400000000000002 111.259 169.614 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -81.18 -74.57 0.32 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.896 0.878 . . . . 3.3399999999999999 110.95 160.492 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 25.8 ttp-105 -53.69 -27.86 30.29 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 117.67 2.47 . . . . 5.3200000000000003 117.67 -164.954 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -54.12 -37.46 64.37 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 121.344 1.884 . . . . 3.6600000000000001 112.454 171.905 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.63 -26.54 63.83 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.747 1.388 . . . . 1.1799999999999999 114.747 172.329 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.44 -43.24 50.72 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.895 1.278 . . . . 0.90000000000000002 111.37 174.842 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.64 -28.35 67.65 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.678 1.191 . . . . 1.8899999999999999 112.354 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -50.24 -39.47 44.77 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 122.068 0.937 . . . . 3.29 112.923 165.858 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 9.5 mt -77.21 -35.49 55.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.755 -1.111 . . . . 1.03 111.819 -174.741 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 37.7 mm -56.09 -52.14 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 122.781 0.432 . . . . 1.0 110.208 176.765 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -65.42 -34.12 77.55 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.14 0.793 . . . . 2.04 113.14 -179.633 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -62.3 -29.25 70.3 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.05 0.94 . . . . 2.5899999999999999 112.455 176.419 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -90.04 -34.76 15.83 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.513 1.125 . . . . 2.9100000000000001 111.654 171.606 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.28 -22.4 66.94 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.517 -1.364 . . . . 3.4199999999999999 114.135 175.319 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.34 -11.59 43.49 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.031 1.493 . . . . 3.0099999999999998 115.031 168.733 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -162.05 -15.27 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.19 0 N-CA-C 119.097 2.999 . . . . 3.0 119.097 -170.648 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -101.23 116.2 32.26 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.986 2.175 . . . . 4.5 110.935 175.601 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -68.51 -11.5 59.94 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 128.406 2.682 . . . . 3.9199999999999999 116.732 -166.546 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 110.89 0.15 28.72 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-O 118.694 -1.059 . . . . 2.75 113.283 -160.396 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -67.15 144.76 55.85 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 119.199 1.499 . . . . 4.3300000000000001 109.612 136.916 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 13.3 mt -129.89 146.16 34.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 C-N-CA 126.666 1.986 . . . . 3.0 106.137 167.126 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.4 t -106.32 177.74 4.77 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.293 1.037 . . . . 1.52 113.658 -176.895 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -80.81 -48.94 11.73 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.029 -1.045 . . . . 2.0 111.954 171.53 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -64.35 -27.58 69.12 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.734 1.613 . . . . 3.71 112.451 176.726 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -54.4 -54.11 45.06 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.363 0.665 . . . . 3.3300000000000001 110.938 173.62 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -62.61 -47.16 84.99 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.801 -1.187 . . . . 2.4900000000000002 112.324 -175.913 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 49.0 t-105 -60.58 -46.99 88.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 119.182 -0.437 . . . . 0.59999999999999998 111.228 178.236 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.99 -31.94 69.88 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.725 -0.655 . . . . 1.6399999999999999 112.105 -178.469 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.427 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 28.2 mt -60.46 -47.86 84.27 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.129 0.877 . . . . 0.57999999999999996 111.459 171.164 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.9 mm -53.15 -37.71 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 120.188 1.358 . . . . 0.81000000000000005 112.592 179.27 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -59.42 -19.86 48.94 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 118.925 0.784 . . . . 0.67000000000000004 113.898 175.216 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.33 -19.96 79.17 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-N 118.545 1.173 . . . . 0.87 113.846 173.239 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -106.06 -35.43 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.484 1.642 . . . . 1.04 110.977 173.495 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 40.7 m -72.75 65.35 0.7 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.537 1.935 . . . . 1.4399999999999999 109.445 167.155 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -150.51 -78.87 0.02 OUTLIER Glycine 0 CA--C 1.529 0.929 0 C-N-CA 126.088 1.804 . . . . 0.90000000000000002 111.329 -174.711 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -63.26 -46.51 9.79 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.129 2.553 . . . . 1.1599999999999999 112.446 179.288 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 5.8 pt -75.93 -23.34 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 N-CA-C 113.447 0.906 . . . . 1.29 113.447 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -53.73 -56.67 15.36 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.475 1.11 . . . . 0.85999999999999999 112.173 -173.765 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -57.62 -46.5 84.02 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.88 0.696 . . . . 2.8799999999999999 112.88 174.61 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.4 tt -57.78 -40.35 79.62 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 125.351 1.461 . . . . 1.49 111.304 -173.232 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 20.1 mt -56.21 -57.81 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.269 1.028 . . . . 1.77 110.345 175.924 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -60.76 -36.83 79.93 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.522 -0.736 . . . . 2.1200000000000001 112.088 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -67.33 -33.49 75.36 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.7 0.8 . . . . 3.0099999999999998 110.766 177.688 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -68.72 -40.72 79.79 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.123 1.369 . . . . 2.7999999999999998 113.019 171.873 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -61.23 -37.34 82.68 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 120.256 1.389 . . . . 2.6699999999999999 111.644 178.396 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.44 -41.8 84.15 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.624 -0.672 . . . . 2.7000000000000002 110.889 178.021 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -71.32 -15.34 62.4 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.545 -1.207 . . . . 5.79 112.616 177.082 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 32.1 t 61.04 26.36 16.31 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 127.214 2.206 . . . . 7.5800000000000001 113.109 177.679 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 48.2 t -121.36 47.27 1.88 Allowed 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.335 1.235 . . . . 12.52 114.335 -154.479 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 28.6 t . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 118.139 -0.934 . . . . 16.32 111.844 156.139 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.476 0.867 0 CA-C-O 118.592 -0.718 . . . . 10.15 110.737 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 80.4 -22.09 0.29 Allowed 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 117.261 2.319 . . . . 8.9199999999999999 117.261 137.255 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.6 t -74.11 67.78 1.36 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.867 1.267 . . . . 5.7800000000000002 111.276 174.816 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 95.81 168.01 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 131.381 3.872 . . . . 2.27 110.096 -175.854 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.8 p -106.6 162.04 14.1 Favored 'General case' 0 N--CA 1.485 1.32 0 O-C-N 121.284 -0.885 . . . . 1.02 111.089 167.762 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -70.27 -23.37 62.87 Favored 'General case' 0 C--O 1.22 -0.458 0 O-C-N 121.47 -0.769 . . . . 2.9100000000000001 112.98 172.876 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -40.79 97.76 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.903 1.683 . . . . 0.92000000000000004 108.788 172.374 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -67.98 -63.85 0.98 Allowed 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 125.151 1.38 . . . . 2.6000000000000001 111.641 178.016 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -50.81 -27.75 7.94 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.012 1.733 . . . . 5.6299999999999999 114.05 170.827 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.708 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -70.34 -45.08 66.87 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 119.938 -1.726 . . . . 0.71999999999999997 113.204 167.789 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 67.3 t -59.24 -32.81 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-N 121.046 1.748 . . . . 0.77000000000000002 110.86 170.816 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.6 mt -59.0 -60.14 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.362 -1.304 . . . . 0.78000000000000003 110.503 165.086 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.5 t -56.08 -33.9 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 126.218 1.807 . . . . 0.63 113.056 -176.439 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.75 -39.56 91.2 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.32 -0.863 . . . . 1.0700000000000001 111.605 171.068 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 71.1 t -73.23 -40.35 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.657 1.183 . . . . 0.80000000000000004 111.545 174.198 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -54.85 -46.01 74.61 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.184 1.356 . . . . 5.6699999999999999 109.977 171.426 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -76.41 -24.05 54.04 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.143 1.164 . . . . 2.04 114.143 -177.193 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -75.32 -45.75 37.63 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.144 -1.598 . . . . 2.5699999999999998 110.921 167.62 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -71.52 -21.17 61.95 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.718 1.007 . . . . 2.8199999999999998 113.718 -172.795 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -48.64 -20.08 0.42 Allowed 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 114.512 1.301 . . . . 3.8399999999999999 114.512 169.172 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -100.56 -6.23 25.66 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.935 1.694 . . . . 2.9199999999999999 115.336 -179.364 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.8 m -120.41 -172.36 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 119.804 1.184 . . . . 2.9700000000000002 111.93 -175.316 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.8 p -121.36 -87.52 0.64 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.813 0.845 . . . . 4.2699999999999996 111.226 171.766 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.4 ttpt -160.9 -49.5 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.497 1.044 . . . . 6.4900000000000002 111.42 178.578 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -85.67 74.42 10.26 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.393 -0.817 . . . . 9.3900000000000006 112.793 -178.996 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.3 t 93.43 139.05 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 128.437 2.695 . . . . 6.6500000000000004 114.144 164.143 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.6 mt -71.06 -48.33 53.31 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.877 0.871 . . . . 8.3200000000000003 111.536 -174.134 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 p -61.67 -30.69 48.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 124.668 1.187 . . . . 4.2300000000000004 112.976 177.511 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.4 ' HB3' ' HE3' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -62.93 -17.3 61.65 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.491 1.116 . . . . 7.2599999999999998 111.831 172.071 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -128.33 5.2 5.74 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.454 -1.404 . . . . 7.1900000000000004 114.413 -175.317 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.6 132.1 51.27 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.644 0.979 . . . . 6.5999999999999996 113.644 -164.155 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 12.1 pt -82.35 -141.85 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.479 1.111 . . . . 2.8100000000000001 112.063 -178.263 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.5 m -121.71 135.66 54.95 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.2 -0.938 . . . . 2.6499999999999999 111.037 -179.728 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -62.8 -32.73 73.97 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.078 -1.014 . . . . 2.5800000000000001 111.947 -178.771 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 m -57.34 -19.42 22.58 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.418 1.887 . . . . 2.3799999999999999 115.109 169.966 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.7 m -82.81 -30.18 28.98 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.177 0.899 . . . . 1.52 112.905 178.119 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.464 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 36.6 t80 -57.22 -47.88 80.21 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.533 1.515 . . . . 2.0699999999999998 112.317 -176.831 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -57.8 -23.09 50.84 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.086 1.354 . . . . 2.3199999999999998 114.215 174.435 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -100.18 -37.18 9.04 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.264 1.425 . . . . 3.2400000000000002 112.259 -175.474 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 3.5 ttm -48.32 -44.76 34.4 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.355 -1.466 . . . . 1.28 110.283 157.539 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.447 HD11 ' CE1' ' A' ' 38' ' ' PHE . 26.3 mt -64.82 -33.33 75.74 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 114.827 1.417 . . . . 1.0700000000000001 114.827 175.656 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -87.68 -11.55 48.02 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 120.358 1.436 . . . . 2.3999999999999999 114.028 -178.769 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.89 -64.2 1.08 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 126.388 1.875 . . . . 2.6899999999999999 111.691 173.514 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -74.52 -22.56 58.98 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 118.099 -0.953 . . . . 3.79 113.489 -173.377 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 24.2 mt -113.63 31.82 6.24 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.73 1.212 . . . . 2.1299999999999999 112.707 165.771 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -55.69 -31.1 62.14 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.348 -1.47 . . . . 1.6000000000000001 114.247 -175.404 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -78.55 -49.45 13.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.666 0.786 . . . . 1.5800000000000001 109.893 -168.703 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.4 mtm -79.35 -18.68 51.97 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.939 1.088 . . . . 2.29 113.939 174.842 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mp -65.25 -48.99 71.35 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 120.208 1.367 . . . . 2.9700000000000002 110.355 161.45 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.6 m 73.81 -40.71 0.47 Allowed 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.684 1.994 . . . . 4.3499999999999996 114.623 168.427 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -157.47 161.49 38.88 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 123.845 1.783 . . . . 4.2000000000000002 112.614 -179.031 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -33.05 -44.77 0.12 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 130.605 3.562 . . . . 2.5899999999999999 114.445 163.194 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -67.46 -47.22 64.08 Favored Glycine 0 N--CA 1.468 0.777 0 C-N-CA 124.657 1.122 . . . . 2.1800000000000002 112.469 -174.943 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -65.22 -38.93 91.97 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 117.58 0.69 . . . . 2.73 111.334 173.26 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.7 ttt-85 -58.28 -24.35 59.2 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.981 -1.074 . . . . 4.6799999999999997 113.392 177.77 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -57.16 -35.65 69.8 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.793 -1.192 . . . . 3.4100000000000001 112.927 170.648 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.42 -14.66 63.16 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.524 1.305 . . . . 1.24 114.524 176.894 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.66 -54.14 4.91 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.698 1.199 . . . . 0.98999999999999999 111.872 165.288 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.14 -32.15 73.61 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.167 0.587 . . . . 2.02 112.402 -176.498 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -57.21 -30.14 64.3 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.223 -0.923 . . . . 2.6699999999999999 112.905 172.746 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.6 mt -75.41 -37.24 60.57 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.857 -0.527 . . . . 1.1000000000000001 111.517 177.254 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.9 mm -56.54 -50.54 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 123.378 0.671 . . . . 1.1599999999999999 110.495 -177.764 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -64.28 -41.78 96.73 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.364 1.066 . . . . 1.97 112.969 179.039 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -59.5 -32.5 70.35 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.107 1.363 . . . . 2.3199999999999998 112.6 174.847 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.42 -31.29 20.13 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.792 1.237 . . . . 2.29 110.961 175.601 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.18 -35.3 79.85 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.702 1.601 . . . . 3.8300000000000001 114.528 -177.55 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.39 -10.6 3.31 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 114.432 1.271 . . . . 2.9100000000000001 114.432 171.357 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -131.14 -10.91 3.73 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.98 1.844 . . . . 3.3100000000000001 115.98 -167.808 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.84 134.89 11.11 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 121.803 2.092 . . . . 3.6699999999999999 114.674 -160.049 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -74.41 12.65 0.72 Allowed 'General case' 0 N--CA 1.479 0.976 0 O-C-N 120.172 -1.58 . . . . 4.8700000000000001 112.817 167.974 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.84 49.8 16.13 Favored Glycine 0 C--N 1.339 0.706 0 C-N-CA 124.474 1.035 . . . . 4.5800000000000001 111.07 -172.5 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.1 mmt85 -65.88 85.25 0.08 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 105.65 -1.982 . . . . 6.0800000000000001 105.65 159.784 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 9.3 mm -69.85 86.91 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 108.384 -0.969 . . . . 2.8500000000000001 108.384 -173.021 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.4 m -66.61 159.26 27.9 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.141 0.976 . . . . 2.2799999999999998 110.315 171.776 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -51.76 -42.87 62.7 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 122.276 1.036 . . . . 2.6499999999999999 110.873 171.939 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -74.98 -20.22 59.76 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 131.288 3.835 . . . . 3.6200000000000001 114.872 173.725 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -68.27 -55.04 13.56 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 122.003 2.183 . . . . 3.79 107.243 167.439 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -57.92 -52.45 65.43 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.049 -1.032 . . . . 1.71 112.712 176.657 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -64.25 -41.24 97.05 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.266 -0.897 . . . . 0.84999999999999998 113.065 -176.697 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.59 -37.37 73.9 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.19 0.904 . . . . 1.8600000000000001 111.054 177.652 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.464 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 64.6 mt -66.03 -40.32 90.95 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 117.947 -1.025 . . . . 0.90000000000000002 112.289 177.325 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 36.7 mm -56.46 -34.27 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-N 121.417 1.917 . . . . 0.72999999999999998 112.303 177.502 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -73.81 -1.88 59.84 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.247 1.403 . . . . 1.1499999999999999 114.917 176.178 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.72 -28.21 19.58 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-N 118.715 1.257 . . . . 0.67000000000000004 114.211 173.086 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.504 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.5 OUTLIER -93.68 -40.23 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-N 118.417 1.109 . . . . 0.93999999999999995 110.104 172.724 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 11.5 m -75.65 124.58 27.48 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.357 1.463 . . . . 1.72 108.415 176.871 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 139.25 -70.66 0.46 Allowed Glycine 0 N--CA 1.472 1.047 0 CA-C-O 117.918 -1.49 . . . . 1.0800000000000001 113.21 -176.023 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -59.87 -45.58 23.88 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.021 2.481 . . . . 1.04 111.677 178.276 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -84.97 -5.46 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 113.403 0.89 . . . . 1.3 113.403 175.225 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.05 81.9 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.815 1.188 . . . . 1.0600000000000001 112.711 -174.94 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -65.91 -36.62 83.9 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.106 -0.996 . . . . 3.5800000000000001 113.564 174.131 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -60.5 -38.64 84.96 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 117.87 -1.062 . . . . 1.8300000000000001 110.385 177.061 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.7 mt -49.25 -65.52 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 123.63 0.772 . . . . 1.3799999999999999 111.133 170.247 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -61.72 -33.59 74.29 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.903 -0.498 . . . . 2.3700000000000001 111.994 -175.115 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.308 2.8 pt-20 -86.97 -9.91 54.46 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 119.029 -0.51 . . . . 3.23 112.244 -176.048 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -78.05 -36.11 48.79 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.025 1.73 . . . . 3.0299999999999998 113.16 163.525 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -71.08 8.11 1.04 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 124.026 1.869 . . . . 2.4500000000000002 112.208 174.326 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -130.03 -66.89 0.77 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 127.007 2.123 . . . . 3.0 109.515 176.501 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . 0.255 3.5 pt20 53.42 -0.37 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 131.063 3.745 . . . . 5.3700000000000001 115.612 178.732 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.2 t -150.13 33.63 0.66 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.652 1.981 . . . . 5.96 110.653 -170.9 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.2 t -156.16 80.2 0.98 Allowed 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.973 -1.08 . . . . 7.46 110.626 -177.335 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.0 t . . . . . 0 C--O 1.255 1.378 0 CA-C-O 114.023 -2.894 . . . . 10.19 112.907 179.146 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 24.6 m . . . . . 0 N--CA 1.476 0.861 0 CA-C-O 118.807 -0.616 . . . . 9.9299999999999997 110.571 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 82.62 -19.18 0.42 Allowed 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 117.156 2.28 . . . . 8.4399999999999995 117.156 136.662 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 49.7 t -70.98 73.56 0.61 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.018 1.327 . . . . 6.3899999999999997 111.968 175.793 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 95.48 164.17 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 131.68 3.992 . . . . 2.3500000000000001 110.49 -178.759 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.2 p -104.93 158.44 16.54 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.968 0.907 . . . . 1.05 110.662 169.954 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -68.54 -25.27 64.84 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 118.945 0.793 . . . . 3.1499999999999999 112.366 175.544 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.03 -40.9 99.12 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 120.48 1.491 . . . . 0.76000000000000001 108.895 172.784 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -67.58 -63.04 1.14 Allowed 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.788 1.235 . . . . 2.6200000000000001 111.781 177.948 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 36.7 tptt -49.9 -28.97 7.35 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 121.022 1.737 . . . . 6.4000000000000004 114.104 169.472 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.708 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.41 -46.46 66.81 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 119.69 -1.881 . . . . 0.80000000000000004 113.237 167.536 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 85.9 t -56.9 -33.95 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 CA-C-N 121.626 2.012 . . . . 0.88 110.868 170.37 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 17.7 mt -59.01 -61.08 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-O 117.684 -1.151 . . . . 0.88 110.91 166.111 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 10.6 t -55.75 -35.83 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 126.444 1.898 . . . . 0.75 112.519 -176.088 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.2 mp -63.35 -36.71 84.59 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.441 -0.787 . . . . 1.1000000000000001 111.323 173.088 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.8 t -80.3 -37.95 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 125.344 1.458 . . . . 1.02 111.768 176.083 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -53.4 -45.85 69.47 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.104 1.32 . . . . 5.5599999999999996 110.399 169.634 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -72.36 -18.24 61.77 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.088 1.144 . . . . 2.0099999999999998 114.088 -178.624 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -80.71 -48.13 13.0 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 120.338 -1.476 . . . . 2.1600000000000001 111.146 167.26 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -71.34 -20.76 62.13 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.262 0.838 . . . . 2.4900000000000002 113.262 -167.497 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -46.73 -19.71 0.1 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.49 1.516 . . . . 3.79 114.504 164.169 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -107.52 5.73 27.39 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.384 1.874 . . . . 2.7999999999999998 115.429 -178.513 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.2 m -139.24 -169.22 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 119.972 1.26 . . . . 2.3399999999999999 111.291 179.287 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 30.9 p -120.43 -84.32 0.66 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.734 1.152 . . . . 4.2999999999999998 113.697 177.394 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -165.07 -54.48 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.461 1.028 . . . . 6.1399999999999997 111.166 -178.517 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -80.75 68.71 7.09 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.901 0.88 . . . . 9.8499999999999996 112.493 176.016 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 8.9 t 93.54 146.59 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 128.212 2.605 . . . . 6.3700000000000001 114.238 170.857 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 73.5 mt -72.24 -48.3 43.83 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.527 1.131 . . . . 8.6300000000000008 111.74 -176.624 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.77 -19.84 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.821 1.248 . . . . 4.1900000000000004 113.184 177.672 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -21.31 66.8 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.823 0.849 . . . . 7.3799999999999999 112.852 173.104 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -137.5 -1.58 2.06 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 115.283 1.586 . . . . 7.6699999999999999 115.283 -178.756 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.07 134.8 0.17 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.577 1.951 . . . . 6.3700000000000001 115.384 -177.732 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 9.7 pt -83.93 -123.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.864 0.866 . . . . 3.1099999999999999 113.058 -178.48 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 42.8 t -135.56 132.99 37.88 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.83 1.652 . . . . 2.9300000000000002 109.384 175.303 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -62.12 -18.38 60.67 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.217 1.007 . . . . 2.23 112.999 177.352 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.4 m -70.69 -17.99 62.83 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.797 1.639 . . . . 2.3599999999999999 114.333 170.298 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 9.1 m -89.9 -19.51 24.48 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.957 1.095 . . . . 2.3300000000000001 113.957 177.556 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.459 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 59.5 t80 -53.89 -52.55 60.14 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 120.888 1.676 . . . . 2.2599999999999998 111.072 177.811 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 33.8 ptt180 -57.48 -24.65 57.05 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.722 1.609 . . . . 2.3700000000000001 114.468 174.283 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -100.95 -38.36 8.24 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.931 1.692 . . . . 3.5299999999999998 111.722 -168.813 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 6.3 tmm? -47.88 -43.93 29.04 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.393 -1.442 . . . . 1.1799999999999999 110.969 152.726 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 145' ' ' LEU . . . . . 0.448 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 93.9 mt -74.34 -24.75 59.24 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.769 1.396 . . . . 1.1699999999999999 114.769 178.095 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -83.64 -16.82 43.72 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.827 1.649 . . . . 2.71 113.518 173.579 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -100.84 -63.61 1.12 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.928 1.691 . . . . 2.7200000000000002 113.131 176.066 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -74.66 -17.08 60.74 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 119.434 1.015 . . . . 3.73 113.552 -173.252 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 46.0 mt -117.2 30.55 7.25 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.827 1.651 . . . . 2.0099999999999998 112.441 165.447 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -57.25 -28.72 63.19 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.231 -1.543 . . . . 1.6599999999999999 113.525 -176.705 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -76.95 -51.59 10.91 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.446 -0.784 . . . . 1.6200000000000001 109.374 -168.819 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 24.4 mtm -76.65 -17.32 59.22 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.943 1.09 . . . . 2.3599999999999999 113.943 174.391 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.3 mp -66.7 -51.14 59.43 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.172 1.351 . . . . 2.96 110.396 162.315 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 14.2 m 73.63 -48.92 0.68 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.754 2.022 . . . . 4.4000000000000004 113.733 171.436 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -145.01 162.75 36.16 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 123.884 1.802 . . . . 4.4299999999999997 113.409 175.69 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -32.79 -42.88 0.08 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 131.094 3.758 . . . . 2.8100000000000001 114.32 161.064 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -66.82 -34.1 86.19 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 124.399 1.0 . . . . 2.2599999999999998 113.336 -179.198 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -76.98 -41.83 41.38 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 117.818 0.809 . . . . 2.6899999999999999 111.068 172.708 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 10.2 ttt180 -51.15 -30.1 15.65 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 120.604 -1.31 . . . . 4.9400000000000004 114.017 174.156 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -50.86 -37.54 43.93 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.633 -1.292 . . . . 3.8999999999999999 112.5 173.014 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -71.78 -14.24 61.93 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 114.979 1.474 . . . . 1.3600000000000001 114.979 178.451 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.06 -52.73 6.06 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.374 0.988 . . . . 0.96999999999999997 111.214 163.954 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -30.81 70.9 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.508 0.723 . . . . 1.96 111.858 -172.501 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -54.06 -33.01 56.34 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.297 -0.877 . . . . 2.71 112.875 169.579 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 18.0 mt -77.21 -36.26 54.93 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 121.733 -0.604 . . . . 1.04 111.339 -177.721 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 40.8 mm -55.51 -55.84 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 124.079 0.952 . . . . 1.1799999999999999 109.486 177.864 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -62.3 -34.99 77.66 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.183 0.808 . . . . 2.0600000000000001 113.183 -178.19 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -38.61 91.5 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.045 1.338 . . . . 2.7000000000000002 113.044 172.975 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.43 -35.89 18.02 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.431 1.093 . . . . 2.3399999999999999 110.674 -175.345 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -55.95 -40.75 73.65 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.85 1.26 . . . . 3.23 114.33 -175.993 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.61 -11.57 5.1 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 114.833 1.419 . . . . 2.27 114.833 173.212 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -130.04 3.99 4.85 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.734 1.383 . . . . 3.0299999999999998 114.734 -168.91 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -152.14 102.52 2.8 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.216 -1.552 . . . . 3.3100000000000001 111.707 -167.882 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -78.8 69.59 5.0 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.707 2.003 . . . . 3.8100000000000001 112.952 -167.163 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 78.45 -11.43 24.97 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.946 1.736 . . . . 4.0700000000000003 114.588 175.066 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.51 162.84 3.51 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.231 1.812 . . . . 6.0300000000000002 111.297 176.631 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 17.8 mm -133.49 129.5 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.773 1.629 . . . . 3.3599999999999999 106.671 164.963 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.7 m -127.92 157.38 40.71 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.09 1.356 . . . . 3.3599999999999999 112.856 -170.033 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -68.35 -46.49 70.01 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.266 -0.897 . . . . 2.4900000000000002 113.176 -171.562 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -73.65 -35.18 65.23 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.59 2.356 . . . . 3.7999999999999998 111.739 178.087 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -55.55 -58.55 7.32 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.361 1.064 . . . . 3.0600000000000001 110.272 167.258 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -49.6 -51.03 40.26 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.569 -0.707 . . . . 2.2200000000000002 111.565 177.112 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 40.0 t-105 -66.88 -46.42 75.0 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.621 -0.674 . . . . 0.93999999999999995 112.775 -177.767 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -69.04 -35.23 76.36 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.177 0.991 . . . . 1.8400000000000001 111.27 -176.267 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.459 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 87.1 mt -64.05 -37.87 89.0 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 118.152 -0.928 . . . . 0.80000000000000004 112.194 173.594 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 41.6 mm -57.08 -35.75 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 121.425 1.921 . . . . 0.72999999999999998 111.953 174.991 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -72.17 1.12 35.4 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 124.974 1.273 . . . . 1.1299999999999999 114.48 174.46 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -96.81 -30.27 7.65 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.289 1.424 . . . . 0.71999999999999997 114.654 173.871 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 189' ' ' ILE . . . . . 0.459 HD12 ' H ' ' B' ' 189' ' ' ILE . 0.6 OUTLIER -87.51 -44.23 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 118.925 1.363 . . . . 0.93000000000000005 109.777 170.289 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.72 145.0 45.5 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.977 1.311 . . . . 2.1099999999999999 108.861 175.497 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . 122.55 -72.61 0.39 Allowed Glycine 0 CA--C 1.531 1.039 0 CA-C-O 117.791 -1.561 . . . . 1.21 112.074 -176.395 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -62.19 -45.02 16.85 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.621 2.214 . . . . 1.01 111.524 179.935 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.5 pp -82.8 -5.83 9.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 113.397 0.888 . . . . 1.27 113.397 174.257 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.16 -35.63 79.36 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.697 1.135 . . . . 1.1599999999999999 112.99 -175.137 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -65.19 -36.46 84.26 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 113.46 0.911 . . . . 4.1100000000000003 113.46 175.763 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.2 tt -61.8 -39.07 90.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.914 -1.041 . . . . 2.25 110.408 177.65 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 32.6 mt -49.21 -65.54 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-O 121.632 0.729 . . . . 1.5800000000000001 111.231 171.56 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 64.9 t60 -63.13 -33.31 75.18 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.827 -0.545 . . . . 2.6400000000000001 111.467 -174.541 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.297 2.9 pt-20 -85.88 -10.04 55.98 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.523 0.564 . . . . 3.3500000000000001 112.523 -176.355 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -77.67 -36.37 51.41 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 126.197 1.799 . . . . 3.1899999999999999 113.278 164.408 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.09 7.6 1.19 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 126.673 1.989 . . . . 2.5899999999999999 112.064 174.215 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -128.92 -66.94 0.8 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 127.005 2.122 . . . . 3.1800000000000002 109.319 176.209 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 53.04 2.83 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 130.572 3.549 . . . . 5.46 115.379 177.862 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 45.0 t -154.76 30.57 0.41 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.821 1.648 . . . . 5.9800000000000004 110.873 -168.034 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 28.0 t -155.65 79.72 1.01 Allowed 'General case' 0 N--CA 1.47 0.531 0 O-C-N 120.862 -1.149 . . . . 7.3799999999999999 110.426 -176.341 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 18.9 t . . . . . 0 C--O 1.251 1.163 0 CA-C-O 114.469 -2.681 . . . . 10.0 111.831 176.52 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.9 m . . . . . 0 CA--C 1.502 -0.881 0 N-CA-C 108.848 -0.797 . . . . 10.59 108.848 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -131.01 -11.96 3.7 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 118.714 -1.194 . . . . 7.5199999999999996 113.577 -132.021 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.7 t 76.86 -8.17 1.73 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.265 2.226 . . . . 5.25 115.613 162.35 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -26.61 95.8 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 128.083 2.553 . . . . 2.73 112.902 -175.998 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 56.3 p -76.11 167.43 21.87 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.767 0.827 . . . . 1.29 111.759 -165.588 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -55.5 -49.82 71.56 Favored 'General case' 0 C--O 1.217 -0.651 0 CA-C-O 117.833 -1.08 . . . . 3.0 109.877 168.536 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.01 -48.74 61.37 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.44 1.018 . . . . 1.01 110.538 178.494 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -68.39 -58.74 3.89 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 118.455 -0.784 . . . . 3.4199999999999999 111.252 -178.362 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -52.74 -27.49 17.93 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 120.194 1.361 . . . . 6.0599999999999996 112.751 173.333 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.846 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -75.29 -41.76 56.32 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 120.586 -1.321 . . . . 0.59999999999999998 112.702 172.949 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -56.08 -47.05 80.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 CA-C-N 120.503 1.502 . . . . 0.58999999999999997 109.877 165.844 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.1 mt -53.08 -47.48 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.438 1.095 . . . . 0.87 111.007 171.564 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.6 t -68.72 -33.73 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 120.099 1.318 . . . . 0.69999999999999996 113.055 178.329 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.84 -35.64 77.19 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.266 -1.521 . . . . 0.94999999999999996 110.836 171.707 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 t -69.3 -39.44 79.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 125.517 1.527 . . . . 0.60999999999999999 110.999 174.138 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -62.2 -51.25 68.54 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.956 0.902 . . . . 3.1699999999999999 110.552 169.92 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.519 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 2.8 t30 -61.1 -18.37 57.59 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.104 1.15 . . . . 2.2000000000000002 114.104 -179.5 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -80.82 -68.47 0.68 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.402 0.681 . . . . 1.96 111.974 162.949 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -64.23 -25.96 68.3 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.873 1.064 . . . . 1.77 113.873 -163.659 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.519 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 7.4 ptmt -51.54 -26.34 8.39 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 120.054 1.297 . . . . 2.2000000000000002 113.056 172.282 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -98.53 5.19 48.11 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.373 1.469 . . . . 2.1099999999999999 114.907 -175.763 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 18.0 m -137.7 153.55 28.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.374 1.069 . . . . 2.25 110.217 172.131 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.5 m -80.12 56.2 2.36 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 116.145 1.906 . . . . 4.1200000000000001 116.145 -170.742 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.3 tttp 78.61 -45.64 0.4 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 126.627 1.971 . . . . 5.1399999999999997 115.787 150.108 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -116.8 150.28 38.59 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.981 1.713 . . . . 6.46 111.336 -173.114 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.7 m -55.0 -18.1 4.66 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.954 1.835 . . . . 8.2799999999999994 115.954 -173.908 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.8 mt -64.52 -31.13 72.21 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.423 -0.798 . . . . 8.5399999999999991 112.203 171.62 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.5 t 53.22 80.82 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 127.104 2.162 . . . . 5.3899999999999997 111.828 -176.617 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -58.27 -29.9 66.18 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.283 1.033 . . . . 9.0600000000000005 113.507 176.483 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -168.08 150.6 5.53 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 128.043 2.537 . . . . 6.5899999999999999 109.026 -178.875 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.47 154.43 35.5 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 126.562 1.945 . . . . 6.5599999999999996 110.235 -177.911 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 18.5 pt -62.24 155.14 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 N-CA-C 113.702 1.001 . . . . 3.4900000000000002 113.702 -179.437 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.4 m -76.28 139.82 41.27 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.198 -0.939 . . . . 2.5800000000000001 110.109 162.909 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -50.71 -28.63 9.44 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.318 1.447 . . . . 2.9300000000000002 114.405 -178.033 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.1 p -60.17 -21.93 62.28 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.952 1.464 . . . . 1.98 114.952 172.937 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 62.1 m -71.85 -49.62 36.7 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 118.539 -0.743 . . . . 1.6599999999999999 112.377 176.082 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -49.52 -52.48 29.34 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.611 1.165 . . . . 2.1400000000000001 112.107 -178.027 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -57.54 -12.43 2.72 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.007 1.114 . . . . 2.4500000000000002 114.007 178.708 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -116.9 -23.38 8.08 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 114.841 1.423 . . . . 4.8899999999999997 114.841 174.284 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -53.37 -39.23 64.04 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 120.197 1.362 . . . . 1.4399999999999999 110.47 158.723 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 mt -59.72 -22.89 62.66 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 114.317 1.229 . . . . 1.3300000000000001 114.317 169.426 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -98.26 -16.27 19.48 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.88 1.272 . . . . 3.3500000000000001 113.056 -179.231 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -97.66 -70.76 0.71 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.817 0.847 . . . . 1.96 110.721 169.324 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -62.19 -34.38 76.33 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.815 1.189 . . . . 3.6499999999999999 113.347 -177.109 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.8 19.38 20.56 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 114.33 1.233 . . . . 1.8100000000000001 114.33 -178.939 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -51.46 -34.26 34.58 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 115.057 1.503 . . . . 1.45 115.057 -171.823 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.533 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 9.0 m-70 -57.68 -27.64 63.08 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.834 2.054 . . . . 1.6599999999999999 113.988 -175.879 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 28.2 tpp -107.93 1.35 22.57 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.578 1.551 . . . . 2.1600000000000001 113.433 -169.21 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.1 mp -70.38 168.23 16.49 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.96 1.304 . . . . 2.8799999999999999 112.004 175.11 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -164.34 102.28 0.84 Allowed 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.02 -1.675 . . . . 3.8999999999999999 108.96 -168.535 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.6 t70 53.84 -166.83 0.08 Allowed 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 122.285 1.04 . . . . 4.5 110.648 -160.587 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.6 p -71.91 -27.65 62.97 Favored 'General case' 0 CA--C 1.518 -0.269 0 O-C-N 120.381 -1.449 . . . . 2.8900000000000001 112.653 154.226 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.02 -42.12 53.85 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 124.617 1.104 . . . . 1.8600000000000001 112.817 -175.289 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -55.25 -55.69 28.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.464 1.106 . . . . 3.2200000000000002 111.62 169.167 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -55.65 -47.72 76.2 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.522 1.055 . . . . 5.0 112.391 178.34 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -63.39 -19.12 64.39 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 120.758 -1.214 . . . . 3.3300000000000001 113.66 -175.114 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.14 -38.87 74.14 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.17 0.896 . . . . 1.77 112.023 166.522 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.15 99.58 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.594 0.758 . . . . 0.93999999999999995 112.093 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.73 -30.72 70.15 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.742 1.217 . . . . 2.79 113.792 175.317 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.2 mtmt -61.96 -34.82 76.82 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.851 -1.156 . . . . 3.8999999999999999 111.762 170.714 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.0 mt -70.93 -40.04 72.32 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.466 0.706 . . . . 0.90000000000000002 111.954 175.368 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.8 mm -52.16 -53.28 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.55 0.74 . . . . 0.93999999999999995 110.612 177.933 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -71.35 -38.32 71.63 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 124.65 1.219 . . . . 2.21 112.679 -176.753 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.4 t30 -54.83 -35.88 64.42 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.533 0.682 . . . . 2.6000000000000001 111.629 168.402 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.4 tp -86.23 -19.82 29.42 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 120.826 -1.171 . . . . 2.3999999999999999 113.319 -178.287 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -62.18 -22.7 66.11 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.281 0.845 . . . . 3.04 113.281 173.508 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.18 -6.24 41.39 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 114.506 1.299 . . . . 2.6699999999999999 114.506 168.285 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -139.99 14.63 2.46 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 125.152 1.381 . . . . 2.6499999999999999 114.416 -168.313 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -128.35 88.56 2.77 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.471 -1.393 . . . . 6.1200000000000001 113.13 -163.226 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -67.84 32.35 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 128.049 2.54 . . . . 5.8399999999999999 114.623 178.643 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.49 -8.44 9.99 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 126.085 1.802 . . . . 2.5 115.6 175.576 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.0 mmt-85 -78.84 -170.59 2.22 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.898 1.349 . . . . 6.5899999999999999 111.085 168.359 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.8 mm -137.7 135.75 45.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 104.872 -2.269 . . . . 2.46 104.872 164.597 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.2 m -96.94 167.12 11.27 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.927 0.891 . . . . 1.9199999999999999 110.403 165.62 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -66.08 -58.75 4.78 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 120.655 -1.278 . . . . 2.0800000000000001 111.74 -178.883 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -69.3 -14.62 63.04 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.682 1.593 . . . . 2.6400000000000001 112.848 -173.586 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -53.69 -54.12 42.33 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.59 1.556 . . . . 3.2200000000000002 111.028 171.147 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -65.09 -42.37 94.1 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.086 -1.634 . . . . 3.0699999999999998 112.819 175.316 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.6 t-105 -60.79 -43.67 97.8 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.756 -0.59 . . . . 0.60999999999999999 111.305 -179.021 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.5 t -73.57 -26.98 61.08 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 117.306 -1.331 . . . . 1.74 111.939 176.91 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 22.2 mt -65.69 -43.0 90.57 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 120.39 1.45 . . . . 0.69999999999999996 112.582 169.568 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 38.0 mm -52.48 -36.47 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-N 120.801 1.637 . . . . 0.65000000000000002 112.018 176.066 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.24 -29.51 68.85 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-O 119.07 -0.85 . . . . 0.68999999999999995 113.573 175.185 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.09 -26.84 65.49 Favored Glycine 0 CA--C 1.534 1.25 0 CA-C-N 119.182 1.491 . . . . 0.56999999999999995 114.427 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -92.85 -35.6 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 CA-C-N 119.351 1.576 . . . . 0.82999999999999996 111.162 169.737 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.4 m -72.08 -37.46 69.59 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.194 1.398 . . . . 2.77 112.652 -177.598 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.84 -47.09 66.56 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 125.412 1.482 . . . . 1.1100000000000001 114.877 -177.543 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.74 -42.5 6.62 Favored 'Trans proline' 0 C--N 1.352 0.757 0 CA-C-N 120.976 2.388 . . . . 1.3300000000000001 112.898 174.307 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.5 pt -84.58 -31.3 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 115.193 1.553 . . . . 1.1699999999999999 115.193 -171.28 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.25 71.12 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 120.13 1.332 . . . . 1.24 113.579 -168.43 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -62.59 -23.38 67.0 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.403 0.89 . . . . 6.21 113.403 175.578 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.61 -30.75 24.7 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.919 1.288 . . . . 2.04 111.073 174.033 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.5 mt -51.68 -55.53 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.328 0.967 . . . . 1.1100000000000001 111.004 174.27 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -52.69 -41.43 63.88 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.664 1.12 . . . . 3.9100000000000001 113.495 178.1 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.418 ' CD ' ' HZ2' ' B' ' 128' ' ' LYS . 14.1 mm-40 -72.64 -8.36 54.91 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.014 0.925 . . . . 4.7400000000000002 112.488 -179.13 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -97.71 -35.01 10.7 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.594 1.958 . . . . 2.9700000000000002 112.941 165.195 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -62.37 -5.33 2.37 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 120.358 1.435 . . . . 2.4199999999999999 112.586 163.97 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -110.3 -63.17 1.42 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.894 1.678 . . . . 2.3999999999999999 111.039 171.927 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 54.35 7.46 0.14 Allowed 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 128.827 2.851 . . . . 5.3899999999999997 115.791 177.95 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.7 m -158.14 44.8 0.32 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 127.147 2.179 . . . . 6.8899999999999997 108.785 177.81 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.5 t -82.29 5.59 19.61 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.069 -1.019 . . . . 9.0999999999999996 113.301 171.0 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 42.4 t . . . . . 0 C--O 1.25 1.117 1 C-N-CA 132.286 4.234 . . . . 10.81 108.368 -169.581 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 CA--C 1.503 -0.828 0 N-CA-C 109.518 -0.549 . . . . 10.48 109.518 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -135.27 -25.18 1.36 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.713 1.258 . . . . 6.54 111.619 -135.018 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 11.3 t 70.04 -0.36 2.79 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.975 2.11 . . . . 4.7599999999999998 116.111 162.406 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -31.52 112.49 0.1 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 127.664 2.385 . . . . 2.3399999999999999 113.514 -176.385 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 71.7 p -83.64 155.0 23.41 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.194 0.998 . . . . 1.27 111.191 -177.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -53.69 -33.17 54.57 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.712 1.005 . . . . 2.46 113.712 178.894 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.82 -47.41 69.13 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.005 0.522 . . . . 1.6799999999999999 111.083 177.427 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -72.02 -52.7 15.71 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.53 -0.544 . . . . 3.0099999999999998 109.53 -177.211 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.6 tmtt? -54.0 -29.62 44.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.193 0.997 . . . . 5.1100000000000003 111.899 174.465 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.846 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -70.01 -32.79 71.14 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 119.697 -1.877 . . . . 0.57999999999999996 113.687 171.489 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 48.8 t -55.01 -43.5 69.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 120.613 1.551 . . . . 1.05 109.673 174.195 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 48.2 mt -51.24 -55.49 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.197 0.599 . . . . 1.1799999999999999 110.32 171.924 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.53 -40.13 88.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 123.908 0.883 . . . . 0.60999999999999999 113.084 -177.11 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.3 -31.12 70.34 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.077 -1.014 . . . . 1.3600000000000001 111.541 176.752 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 41.5 t -73.56 -42.68 55.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.928 1.691 . . . . 0.78000000000000003 111.241 172.544 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 120' ' ' GLU . . . . . 0.444 ' CD ' ' HZ2' ' B' ' 124' ' ' LYS . 14.5 tm-20 -57.07 -50.48 72.64 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.606 1.162 . . . . 3.5499999999999998 111.66 173.939 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 121' ' ' ASN . . . . . 0.506 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 3.0 t30 -65.9 -10.77 41.61 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 114.162 1.171 . . . . 2.5099999999999998 114.162 -173.838 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -87.82 -63.91 1.23 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.386 1.474 . . . . 1.97 112.146 164.418 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -61.23 -29.94 70.14 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.693 0.997 . . . . 1.73 113.693 -165.683 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 124' ' ' LYS . . . . . 0.506 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 8.4 ptmt -50.67 -26.9 6.0 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 119.43 1.013 . . . . 1.95 113.508 173.697 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -93.35 5.57 51.11 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.23 1.812 . . . . 2.0600000000000001 114.726 -179.517 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 13.2 m -138.76 150.89 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.97 1.259 . . . . 2.1699999999999999 110.971 173.977 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 16.2 m -78.66 42.81 0.46 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 115.488 1.662 . . . . 4.0499999999999998 115.488 -177.31 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.418 ' HZ2' ' CD ' ' A' ' 96' ' ' GLU . 5.3 ttpt 83.84 -52.01 0.14 Allowed 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.561 1.319 . . . . 4.9800000000000004 114.561 142.883 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -95.63 145.23 25.41 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.521 1.528 . . . . 6.3899999999999997 110.916 177.615 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 5.8 m -55.55 -16.71 4.24 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 116.063 1.875 . . . . 8.0399999999999991 116.063 -177.948 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 91.5 mt -63.53 -33.98 76.78 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 118.947 0.794 . . . . 8.6600000000000001 111.792 169.494 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 22.3 t 57.58 86.79 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 127.264 2.225 . . . . 5.5499999999999998 111.933 -178.195 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -60.81 -28.99 69.2 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.837 0.855 . . . . 9.2100000000000009 113.135 171.88 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -171.46 151.89 3.13 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.154 2.581 . . . . 6.71 109.657 -178.482 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.21 152.44 29.35 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.412 2.285 . . . . 6.5099999999999998 110.692 -178.632 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 14.4 pt -63.05 152.67 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 114.14 1.163 . . . . 3.6600000000000001 114.14 -178.369 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 73.5 m -74.63 139.7 43.79 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.378 -0.826 . . . . 2.6000000000000001 110.934 163.831 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -51.79 -24.78 6.44 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.59 1.556 . . . . 2.9199999999999999 114.736 -174.85 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 62.1 p -58.19 -23.65 56.32 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.735 1.383 . . . . 2.0899999999999999 114.735 171.649 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 61.1 m -74.35 -46.15 42.54 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.256 0.935 . . . . 1.6899999999999999 113.002 -179.407 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -53.23 -52.47 58.83 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.784 1.175 . . . . 2.0699999999999998 112.263 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -57.37 -10.65 1.45 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.714 1.005 . . . . 2.52 113.714 177.535 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -117.83 -27.6 6.17 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 120.182 1.355 . . . . 4.3099999999999996 114.387 177.584 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.7 tmm? -53.01 -35.83 59.83 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 119.704 1.138 . . . . 1.3899999999999999 111.375 161.732 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.29 -26.59 68.49 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.053 1.131 . . . . 1.46 114.053 170.307 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -92.14 -24.17 19.18 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 121.208 -0.932 . . . . 3.0 112.951 179.494 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.72 -67.37 0.83 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.17 0.895 . . . . 1.49 111.573 172.261 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -69.06 -29.17 67.24 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.378 1.251 . . . . 3.5299999999999998 114.378 -175.551 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.59 19.36 19.32 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.064 1.346 . . . . 1.71 113.762 -179.693 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -45.07 -38.31 4.89 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 117.647 2.462 . . . . 1.6499999999999999 117.647 -165.467 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 151' ' ' HIS . . . . . 0.487 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 0.0 OUTLIER -61.92 -28.57 69.62 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.118 2.167 . . . . 2.29 113.342 -178.407 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 40.6 tpp -77.94 -4.75 48.46 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.119 1.768 . . . . 1.9099999999999999 113.776 -174.11 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.79 177.21 7.07 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.136 1.375 . . . . 3.0600000000000001 112.95 -175.385 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 6.4 m -176.76 110.47 0.08 Allowed 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.567 2.347 . . . . 3.79 107.956 -176.668 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 155' ' ' ASP . . . . . 0.474 ' CB ' ' H ' ' B' ' 157' ' ' GLY . 21.1 t0 48.39 -175.57 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.299 0 CA-C-O 123.844 1.783 . . . . 4.96 109.992 -147.597 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 65.4 p -56.9 -14.88 3.9 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 120.097 -1.627 . . . . 3.7400000000000002 112.836 142.144 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 157' ' ' GLY . . . . . 0.474 ' H ' ' CB ' ' B' ' 155' ' ' ASP . . . -51.92 -38.43 46.35 Favored Glycine 0 N--CA 1.476 1.324 0 C-N-CA 126.906 2.193 . . . . 2.0899999999999999 113.547 -177.179 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -62.8 -58.85 5.98 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.89 1.276 . . . . 3.23 111.547 169.283 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -50.85 -43.79 59.37 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.698 1.599 . . . . 5.04 114.561 174.597 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 160' ' ' LYS . . . . . 0.454 ' HE2' ' HA2' ' B' ' 157' ' ' GLY . 34.1 mtmt -60.22 -19.01 52.56 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.681 1.992 . . . . 4.6200000000000001 115.281 178.745 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -66.33 -41.42 89.64 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.392 1.077 . . . . 1.71 112.041 167.777 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -61.25 -40.56 94.5 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.106 0.962 . . . . 0.90000000000000002 111.159 176.503 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -56.88 -39.71 74.87 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.73 1.212 . . . . 2.21 113.054 173.775 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -59.53 -34.25 72.4 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.332 -0.855 . . . . 3.9399999999999999 111.962 174.995 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 8.8 mt -69.8 -42.99 73.01 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 118.656 -0.688 . . . . 0.84999999999999998 112.03 174.07 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 35.3 mm -50.04 -53.86 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.889 0.768 . . . . 0.87 110.391 177.47 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -71.1 -38.22 72.38 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.059 1.344 . . . . 2.23 112.961 -176.313 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -54.02 -33.86 58.37 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.559 0.695 . . . . 2.6099999999999999 111.862 167.462 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 9.2 tp -93.59 -14.21 26.78 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 120.63 -1.294 . . . . 2.2599999999999998 113.964 -179.439 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -65.02 -16.59 63.62 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.573 0.749 . . . . 3.1000000000000001 112.978 171.815 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.23 -6.92 58.66 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.464 1.283 . . . . 2.48 114.464 165.086 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -142.97 27.56 1.62 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.182 1.393 . . . . 2.6699999999999999 114.294 -164.93 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -143.56 93.81 2.52 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 120.049 -1.657 . . . . 5.8799999999999999 111.621 -170.406 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -68.68 31.23 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 128.258 2.623 . . . . 5.7599999999999998 114.009 179.041 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.63 -11.93 6.59 Favored Glycine 0 CA--C 1.534 1.223 0 O-C-N 119.802 -1.811 . . . . 2.4900000000000002 114.999 178.905 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 35.2 mmt-85 -83.75 144.81 29.09 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.539 1.67 . . . . 6.7800000000000002 109.745 163.247 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 7.4 mm -93.79 135.29 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 106.97 -1.493 . . . . 2.77 106.97 163.653 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 18.5 m -98.18 159.07 15.17 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.256 1.422 . . . . 2.0499999999999998 110.941 166.685 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -62.97 -54.38 39.28 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.33 -1.482 . . . . 1.8300000000000001 112.311 -174.651 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -68.63 -14.02 62.74 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.64 1.976 . . . . 2.9700000000000002 113.301 -176.215 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -56.69 -54.06 50.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.159 1.784 . . . . 3.2200000000000002 111.168 174.137 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -57.19 -44.7 83.85 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 120.624 -1.297 . . . . 2.25 112.311 173.068 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -62.66 -43.25 99.28 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 121.985 -0.447 . . . . 0.59999999999999998 111.845 -178.028 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.9 t -75.3 -26.07 58.42 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 117.409 -1.281 . . . . 1.6499999999999999 112.496 175.927 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 54.0 mt -68.8 -41.12 79.14 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.677 1.58 . . . . 0.54000000000000004 112.395 171.948 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 21.9 mm -51.58 -36.72 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 CA-C-N 120.509 1.504 . . . . 0.62 112.417 177.612 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -57.28 -32.3 63.56 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 118.505 0.593 . . . . 0.65000000000000002 113.688 173.77 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -73.13 -19.24 79.56 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-N 118.793 1.296 . . . . 0.63 114.903 -179.785 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -98.21 -35.62 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 CA-C-N 119.019 1.409 . . . . 0.79000000000000004 111.147 167.839 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 68.6 m -75.1 -41.88 57.74 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.913 1.685 . . . . 2.7799999999999998 113.177 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -54.48 -42.58 76.01 Favored Glycine 0 CA--C 1.537 1.461 0 CA-C-O 118.086 -1.397 . . . . 1.1200000000000001 115.74 -174.672 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.09 -44.29 7.53 Favored 'Trans proline' 0 C--N 1.354 0.832 0 CA-C-N 121.0 2.4 . . . . 1.1399999999999999 112.444 174.374 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 35.0 pt -90.38 -24.7 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 115.607 1.706 . . . . 1.1299999999999999 115.607 -168.271 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -56.35 -36.16 68.46 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.767 1.227 . . . . 1.03 113.834 -171.072 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.0 ptpp? -57.62 -31.67 66.47 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.735 1.214 . . . . 5.6299999999999999 113.107 173.175 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.66 -30.11 25.12 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.454 1.502 . . . . 2.0899999999999999 110.947 179.115 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 65.0 mt -52.36 -52.81 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.183 0.993 . . . . 0.92000000000000004 110.508 172.207 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -46.79 -50.26 18.57 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 118.761 0.709 . . . . 3.5800000000000001 112.786 173.132 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -68.32 -12.99 61.94 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.813 1.245 . . . . 4.5499999999999998 113.657 -177.018 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -98.57 -30.34 12.55 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.461 1.504 . . . . 2.4100000000000001 113.58 170.683 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -68.18 -17.44 64.33 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 120.552 1.524 . . . . 2.3199999999999998 111.555 165.901 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -93.87 -54.87 3.44 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.18 -0.95 . . . . 2.0 111.787 174.084 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 55.82 6.22 0.2 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 129.115 2.966 . . . . 6.1100000000000003 116.043 176.583 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 74.5 m -162.49 44.04 0.13 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 127.122 2.169 . . . . 6.0999999999999996 109.608 -178.561 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 20.1 t -86.78 5.44 36.44 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.162 1.171 . . . . 8.2899999999999991 114.162 176.459 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.25 1.128 0 C-N-CA 130.824 3.649 . . . . 10.050000000000001 109.938 -171.259 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.9 t . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 104.928 -2.249 . . . . 9.0800000000000001 104.928 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.409 ' CG ' ' H ' ' A' ' 4' ' ' CYS . 37.8 t70 -63.41 -132.18 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.415 0 N-CA-C 109.217 -0.66 . . . . 6.9900000000000002 109.217 117.324 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.409 ' H ' ' CG ' ' A' ' 3' ' ' ASP . 35.3 t -80.81 -93.84 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 O-C-N 119.736 -1.852 . . . . 3.8300000000000001 110.288 170.25 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 95.87 124.1 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.766 1 C-N-CA 131.79 4.036 . . . . 2.1499999999999999 108.586 -163.404 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 31.5 p -76.23 154.68 35.06 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.566 0.747 . . . . 0.97999999999999998 110.15 174.194 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -62.33 -31.76 72.42 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-O 118.818 -0.61 . . . . 2.46 111.897 178.14 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.68 -42.52 88.69 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 120.065 1.302 . . . . 0.79000000000000004 110.224 176.508 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -62.91 1.25 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.822 1.249 . . . . 2.8399999999999999 110.443 179.295 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -52.39 -33.87 45.44 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 114.404 1.261 . . . . 5.9000000000000004 114.404 172.971 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.88 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -67.24 -49.01 66.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 119.938 1.245 . . . . 0.48999999999999999 111.808 173.008 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 52.8 t -57.22 -35.08 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 120.017 1.28 . . . . 0.82999999999999996 110.439 173.641 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.6 mt -59.65 -47.64 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 O-C-N 121.483 -0.761 . . . . 1.0800000000000001 112.305 168.209 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.3 t -64.61 -34.65 71.17 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 CA-C-N 120.279 1.399 . . . . 0.78000000000000003 113.414 175.006 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -63.23 -41.81 99.15 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 120.636 -1.29 . . . . 0.93000000000000005 111.04 171.643 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.2 t -62.56 -40.19 87.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 123.774 0.83 . . . . 0.57999999999999996 110.881 173.689 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -66.04 -36.64 83.8 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.644 1.111 . . . . 3.1299999999999999 113.129 173.609 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.428 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 36.1 t30 -62.11 -23.07 66.32 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.756 1.162 . . . . 2.0099999999999998 113.556 -177.883 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -81.91 -50.19 9.46 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.037 1.335 . . . . 1.95 112.797 171.213 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -75.74 -16.44 60.14 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.667 1.358 . . . . 2.27 114.667 -174.019 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 18' ' ' ASN . 5.4 ptmt -66.87 -25.66 66.51 Favored 'General case' 0 CA--C 1.553 1.059 0 O-C-N 120.218 -1.552 . . . . 2.6899999999999999 112.116 161.075 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -97.89 -36.25 10.23 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 115.277 1.584 . . . . 3.1000000000000001 115.277 -178.018 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.1 p -130.29 159.57 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 CA-C-N 120.509 1.504 . . . . 3.9300000000000002 112.238 172.23 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.9 t 87.78 -163.43 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 127.872 2.469 . . . . 6.0499999999999998 112.713 174.145 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt 51.84 -71.09 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 130.462 3.505 . . . . 6.5999999999999996 114.621 168.758 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -61.68 -17.56 56.02 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.614 2.366 . . . . 11.58 112.729 169.887 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.6 m -159.66 151.26 20.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.181 1.793 . . . . 7.4199999999999999 111.409 171.821 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.8 mt -72.59 -69.33 0.41 Allowed 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.35 -0.611 . . . . 8.1500000000000004 109.35 159.035 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.7 t -143.34 93.13 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.697 1.199 . . . . 5.3899999999999997 109.405 -177.836 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -139.47 39.82 2.05 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 127.255 2.222 . . . . 9.5 112.077 169.773 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 55.49 36.31 26.88 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.209 1.404 . . . . 8.8900000000000006 113.711 -179.295 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.66 -24.0 65.24 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 120.887 -1.133 . . . . 9.7799999999999994 112.034 -175.339 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.0 tt -127.7 164.08 29.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 126.503 1.921 . . . . 3.4399999999999999 109.296 167.415 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.2 m -143.04 168.6 19.34 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.507 -1.371 . . . . 2.6200000000000001 109.245 159.08 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -59.26 -34.95 72.86 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.274 -1.516 . . . . 2.5600000000000001 112.048 -173.237 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 p -57.21 -21.28 32.42 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.358 1.863 . . . . 1.8400000000000001 114.57 171.823 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 m -74.65 -39.8 61.84 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.19 -0.944 . . . . 1.71 112.395 171.275 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.421 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 71.7 t80 -58.27 -49.72 76.12 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.742 1.155 . . . . 2.1200000000000001 113.066 -175.36 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -53.18 -23.02 7.43 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.001 0.92 . . . . 2.8399999999999999 112.874 172.918 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -99.68 -45.82 5.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.931 1.693 . . . . 3.54 113.244 -170.271 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 16.7 ptm -52.53 -37.16 56.99 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.979 0.809 . . . . 3.3999999999999999 110.444 161.154 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.8 mt -58.72 -64.17 1.03 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.954 0.902 . . . . 1.4299999999999999 111.865 167.306 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -70.0 -12.17 61.42 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.585 1.538 . . . . 3.0499999999999998 115.12 -173.458 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.1 -49.21 6.32 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.506 1.048 . . . . 1.75 112.419 170.616 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -80.97 -36.48 30.78 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 120.06 1.3 . . . . 2.7200000000000002 112.529 -175.091 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.8 mt -103.81 27.32 7.65 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.957 1.303 . . . . 2.1099999999999999 112.666 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -58.5 -16.77 16.76 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 115.766 1.765 . . . . 1.54 115.766 -169.407 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.12 -36.15 15.0 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 119.517 1.053 . . . . 1.79 113.089 174.858 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.8 ttm -71.31 -22.27 61.95 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.909 1.284 . . . . 3.04 112.292 176.316 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.9 mp -61.9 90.35 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 123.528 1.632 . . . . 2.4900000000000002 111.046 171.114 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.6 m -74.39 75.77 1.9 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 113.535 -1.666 . . . . 4.5499999999999998 109.701 173.818 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.9 t70 71.77 169.89 0.32 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 128.312 2.645 . . . . 4.04 112.999 -176.064 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m -30.77 -45.86 0.07 Allowed 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 127.376 2.27 . . . . 2.3399999999999999 111.989 150.062 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.56 -50.17 54.43 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.433 1.492 . . . . 1.6899999999999999 113.654 177.223 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -62.65 -41.67 99.18 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.794 1.297 . . . . 3.5 112.001 172.208 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 44.2 ttt-85 -57.01 -40.49 76.74 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.735 0.698 . . . . 5.2599999999999998 112.521 173.729 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.29 -19.06 64.25 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 120.443 1.474 . . . . 3.5899999999999999 113.609 176.164 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.494 ' HA ' ' HG2' ' A' ' 61' ' ' LYS . . . -79.09 -17.61 54.84 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.127 1.158 . . . . 1.05 114.127 170.999 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.29 -53.11 9.31 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.481 1.112 . . . . 0.78000000000000003 110.525 160.559 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -57.01 -35.77 69.63 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.086 0.954 . . . . 2.2999999999999998 112.923 -176.451 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.494 ' HG2' ' HA ' ' A' ' 58' ' ' ALA . 2.9 ptmm? -57.59 -23.83 52.98 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 120.377 -1.452 . . . . 3.9399999999999999 114.763 171.654 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.2 mt -82.84 -37.05 24.92 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.465 -0.772 . . . . 1.5600000000000001 112.308 174.676 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.2 mm -52.53 -51.56 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.766 1.226 . . . . 0.97999999999999998 110.823 -178.326 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -55.14 -48.93 73.0 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 122.176 0.988 . . . . 3.0600000000000001 112.359 177.426 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 -66.01 -21.19 66.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.744 1.218 . . . . 3.1099999999999999 113.316 -178.691 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.47 -34.9 14.63 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.849 0.75 . . . . 2.1299999999999999 112.533 178.428 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -61.88 -25.36 67.5 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.3 -0.875 . . . . 3.23 112.511 164.695 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.67 -14.01 62.3 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 114.484 1.29 . . . . 2.0600000000000001 114.484 167.251 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -123.91 -19.47 5.68 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 116.119 1.896 . . . . 2.5899999999999999 116.119 -173.411 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.93 127.02 22.49 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.08 1.763 . . . . 3.6400000000000001 112.435 -171.488 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -85.91 -7.66 58.54 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.804 1.409 . . . . 4.6600000000000001 114.804 -169.353 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 130.8 -13.65 5.55 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 124.762 1.172 . . . . 2.52 113.628 -163.116 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.5 mmt-85 -76.61 147.03 37.86 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.244 1.522 . . . . 4.9100000000000001 109.467 153.273 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 37.4 mm -133.22 146.2 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 127.458 2.303 . . . . 2.3100000000000001 107.317 -178.307 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 10.6 m -109.44 151.52 26.58 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 118.977 0.808 . . . . 1.7 110.289 173.809 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -55.72 -40.46 72.46 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-O 122.658 1.218 . . . . 2.0600000000000001 111.137 172.918 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.8 -32.2 65.45 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 129.772 3.229 . . . . 3.0499999999999998 112.782 178.688 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -54.76 9.76 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.395 1.478 . . . . 3.25 110.0 -170.4 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -52.77 -43.46 65.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.092 0.557 . . . . 1.9299999999999999 112.028 174.169 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.7 t-105 -63.26 -48.14 79.44 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.709 -0.62 . . . . 0.87 111.375 177.532 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 88.5 m -58.37 -37.45 75.24 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.501 1.921 . . . . 2.2799999999999998 111.694 176.453 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.421 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 75.2 mt -62.14 -50.5 71.64 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 118.25 -0.881 . . . . 1.02 111.955 174.114 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.0 mm -52.62 -41.84 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 CA-C-N 120.215 1.37 . . . . 0.94999999999999996 113.441 -173.591 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.28 -19.46 59.66 Favored Glycine 0 N--CA 1.475 1.282 0 C-N-CA 123.637 0.637 . . . . 0.97999999999999998 113.499 177.993 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.0 -11.63 85.4 Favored Glycine 0 CA--C 1.534 1.252 0 CA-C-O 117.85 -1.528 . . . . 1.1399999999999999 114.993 173.979 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.3 -45.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 119.796 1.798 . . . . 1.3899999999999999 111.036 175.939 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 40.6 m -76.28 87.19 3.09 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 105.997 -1.853 . . . . 1.4299999999999999 105.997 172.688 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -160.4 -77.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.916 0 CA-C-O 118.038 -1.423 . . . . 0.97999999999999998 112.549 -167.762 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -61.57 -33.37 87.27 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 122.856 2.371 . . . . 1.1399999999999999 112.311 175.263 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.3 pt -75.85 -16.9 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 114.047 1.128 . . . . 1.1899999999999999 114.047 173.885 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.12 -65.05 0.63 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.997 1.271 . . . . 1.76 112.958 -169.47 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp -55.2 -40.75 71.13 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.349 -0.845 . . . . 3.3399999999999999 113.185 178.0 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.69 -38.27 74.89 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.648 0.779 . . . . 1.3899999999999999 111.216 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 51.2 mt -54.93 -62.43 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 118.973 0.806 . . . . 1.3799999999999999 111.111 171.117 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -57.11 -27.98 62.26 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.299 0.852 . . . . 1.7 113.299 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -81.36 -25.89 35.98 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.048 -1.033 . . . . 2.8999999999999999 112.261 177.605 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -74.96 -33.49 61.92 Favored 'General case' 0 C--O 1.227 -0.086 0 N-CA-C 113.776 1.028 . . . . 2.1800000000000002 113.776 178.783 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -70.47 6.69 1.29 Allowed 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 123.305 1.526 . . . . 2.3399999999999999 112.031 172.151 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -115.52 -56.51 2.34 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 126.416 1.887 . . . . 2.3199999999999998 110.306 170.599 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -62.06 -13.45 26.38 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.376 1.25 . . . . 5.0099999999999998 114.376 178.989 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.4 t -121.26 25.12 9.69 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.115 1.366 . . . . 8.5500000000000007 112.177 169.153 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.9 t -75.59 1.52 14.17 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.874 1.435 . . . . 11.050000000000001 114.874 -179.403 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 30.8 m . . . . . 0 C--O 1.254 1.312 0 C-N-CA 130.036 3.334 . . . . 13.119999999999999 109.913 178.491 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 107.372 -1.344 . . . . 9.6999999999999993 107.372 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -31.46 176.83 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.579 0 N-CA-C 115.147 1.536 . . . . 6.2800000000000002 115.147 111.824 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 44.4 t -51.86 -57.19 10.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.52 2.728 . . . . 4.2300000000000004 113.128 174.865 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 65.37 -179.69 0.19 Allowed 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.561 1.945 . . . . 2.3100000000000001 114.238 -175.201 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.4 p -85.27 159.79 19.99 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.575 -0.703 . . . . 1.0700000000000001 109.311 160.42 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -59.61 -45.06 93.05 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.599 -0.715 . . . . 2.79 111.657 174.505 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.59 -43.04 75.63 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.581 1.082 . . . . 1.03 111.211 -174.46 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -56.75 7.6 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.993 0.517 . . . . 2.77 110.239 -177.381 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -50.2 -37.61 36.05 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.755 1.222 . . . . 5.2400000000000002 112.268 172.103 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.88 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.35 -44.67 74.76 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 120.37 -1.456 . . . . 0.51000000000000001 113.51 172.588 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 79.6 t -61.72 -34.53 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 CA-C-N 121.009 1.731 . . . . 0.77000000000000002 111.017 172.399 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 44.4 mt -56.03 -52.48 49.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.681 1.128 . . . . 0.76000000000000001 110.913 165.154 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 9.3 t -58.03 -41.37 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 119.407 1.003 . . . . 0.56999999999999995 112.657 178.569 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.37 -39.36 94.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.02 0.928 . . . . 0.98999999999999999 112.298 175.007 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 99.2 t -70.93 -44.86 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-O 118.455 -0.783 . . . . 0.56999999999999995 110.895 177.873 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -61.24 -39.2 89.44 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.552 1.069 . . . . 4.2000000000000002 112.042 178.625 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 121' ' ' ASN . . . . . 0.515 HD21 ' HG3' ' B' ' 148' ' ' GLU . 6.9 t30 -67.51 -14.85 63.3 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.523 1.305 . . . . 2.3500000000000001 114.523 -177.469 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -102.11 -40.18 6.94 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.55 1.54 . . . . 2.4199999999999999 113.155 174.881 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -68.69 -26.08 65.11 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 120.862 -1.149 . . . . 2.0800000000000001 112.827 175.874 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 42.2 pttt -59.23 -34.78 72.61 Favored 'General case' 0 CA--C 1.551 0.994 0 O-C-N 119.444 -2.035 . . . . 2.4399999999999999 112.248 164.298 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -81.86 -33.46 30.6 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 116.993 -1.479 . . . . 2.5600000000000001 114.876 178.95 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 9.6 p -138.52 138.89 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 CA-C-N 120.573 1.533 . . . . 3.8799999999999999 113.162 176.576 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.7 t 103.51 -168.03 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 129.904 3.282 . . . . 5.9000000000000004 111.919 174.634 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt 54.83 -69.67 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 130.227 3.411 . . . . 6.0700000000000003 114.756 165.492 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -59.79 -21.69 61.15 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.329 1.852 . . . . 11.17 112.353 173.197 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 40.9 m -166.16 135.11 3.09 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 127.529 2.331 . . . . 8.0700000000000003 109.121 164.16 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -68.31 -64.5 0.85 Allowed 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 110.039 -0.356 . . . . 8.0600000000000005 110.039 172.245 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 50.1 t -140.88 89.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 C-N-CA 124.407 1.083 . . . . 5.7199999999999998 109.463 176.977 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -129.88 17.98 5.65 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.195 1.798 . . . . 9.8399999999999999 111.547 157.548 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 68.43 61.53 0.37 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.437 1.895 . . . . 8.6300000000000008 110.422 -167.36 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.29 -15.56 63.33 Favored 'General case' 0 CA--C 1.552 1.055 0 O-C-N 120.851 -1.156 . . . . 9.9100000000000001 112.482 179.2 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 5.3 tt -143.92 171.77 7.3 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 128.417 2.687 . . . . 3.27 109.334 175.022 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 74.2 m -142.55 163.53 32.59 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.049 1.74 . . . . 2.6699999999999999 108.722 155.992 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 38.4 mmtm -56.15 -32.6 64.44 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.523 -1.36 . . . . 2.8700000000000001 112.699 -174.219 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 9.1 p -56.7 -23.0 39.14 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.032 1.733 . . . . 1.9199999999999999 113.854 174.497 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 6.0 m -76.56 -26.61 55.29 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.882 -1.137 . . . . 1.4099999999999999 113.159 173.518 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -65.17 -53.51 43.82 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.73 1.605 . . . . 1.9199999999999999 111.656 -179.212 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 6.3 ptt180 -52.14 -25.26 8.51 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.581 1.152 . . . . 2.5499999999999998 112.622 176.128 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.27 -45.08 7.31 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.269 1.827 . . . . 3.48 112.077 -173.115 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.3 tmm? -49.95 -44.08 50.41 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.13 0.972 . . . . 1.6000000000000001 110.232 162.283 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.9 mt -55.01 -63.62 1.1 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.666 1.587 . . . . 1.49 111.967 166.945 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -68.56 -15.16 63.44 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 115.338 1.607 . . . . 2.96 115.338 -174.931 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.92 -48.12 7.43 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.462 1.028 . . . . 1.6899999999999999 112.331 172.362 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.515 ' HG3' HD21 ' B' ' 121' ' ' ASN . 50.6 mm-40 -87.36 -33.88 19.0 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.68 1.127 . . . . 2.79 113.043 -172.861 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.5 mt -101.62 27.38 6.42 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.899 1.28 . . . . 2.2000000000000002 112.317 176.22 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -60.76 -12.59 11.1 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 116.166 1.913 . . . . 1.4399999999999999 116.166 -169.662 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -92.1 -59.77 2.02 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.606 1.162 . . . . 1.4299999999999999 111.587 -175.281 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 27.7 ttp -61.44 -13.58 21.56 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 114.917 1.451 . . . . 1.79 114.917 169.315 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.9 tp -58.39 91.44 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.726 1.61 . . . . 2.4300000000000002 110.185 176.306 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 63.7 m -82.92 70.22 9.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.489 1.116 . . . . 4.5700000000000003 110.879 -167.571 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 25.9 t70 74.62 167.22 0.29 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 128.316 2.646 . . . . 4.1500000000000004 112.695 -175.159 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -27.6 -47.34 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.4 0 C-N-CA 127.792 2.437 . . . . 2.6099999999999999 112.697 151.549 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.06 -52.42 52.94 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-N 120.232 1.378 . . . . 1.8999999999999999 113.756 -178.977 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.19 -38.8 80.74 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.913 0.885 . . . . 3.1000000000000001 111.325 173.818 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.2 ttt-85 -62.06 -45.87 91.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.719 0.808 . . . . 4.5999999999999996 113.099 172.444 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -21.72 66.05 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 120.024 -1.672 . . . . 3.7599999999999998 113.182 -177.709 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -61.3 -28.79 69.45 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 117.325 -1.322 . . . . 1.3600000000000001 113.476 167.783 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.27 73.18 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.199 1.0 . . . . 1.1200000000000001 111.484 167.089 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -62.88 -32.78 74.1 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.656 0.783 . . . . 2.1200000000000001 111.944 -175.057 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt -47.17 -42.25 19.34 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 122.402 1.096 . . . . 2.5600000000000001 113.663 166.845 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 165' ' ' LEU . . . . . 0.441 HD11 ' HA3' ' B' ' 188' ' ' GLY . 5.5 mt -78.67 -42.2 29.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 113.973 -1.467 . . . . 1.1399999999999999 110.551 -174.41 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.9 mm -46.48 -56.85 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.302 1.441 . . . . 1.3 111.67 175.08 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -58.76 -40.73 84.74 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.592 1.187 . . . . 3.0800000000000001 112.47 -177.145 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -77.24 -18.46 57.62 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.131 1.372 . . . . 3.4700000000000002 112.455 -175.776 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.57 -36.24 15.43 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.781 0.833 . . . . 2.4199999999999999 112.329 173.288 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -58.88 -35.99 73.91 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.3 0.955 . . . . 3.77 111.946 166.761 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -60.1 -15.97 27.95 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.846 1.424 . . . . 2.27 114.846 169.906 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -120.5 -14.53 8.66 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 115.573 1.694 . . . . 2.6899999999999999 115.573 -176.254 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -138.89 108.13 6.09 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.777 1.626 . . . . 3.8500000000000001 112.407 -166.73 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -76.77 56.15 1.14 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 128.357 2.663 . . . . 4.29 112.484 -169.501 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 67.87 -14.14 0.61 Allowed Glycine 0 N--CA 1.479 1.563 0 O-C-N 119.854 -1.779 . . . . 2.4900000000000002 114.145 -171.388 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.9 mmt-85 -73.1 141.89 47.54 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.83 1.652 . . . . 5.0499999999999998 107.726 164.797 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 40.6 mm -126.32 141.81 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.078 1.351 . . . . 2.3199999999999998 108.812 -168.879 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 70.8 m -99.74 155.13 17.79 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 117.891 0.314 . . . . 1.8100000000000001 111.68 173.839 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -63.32 -50.47 69.9 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.943 -1.098 . . . . 2.4100000000000001 110.509 172.585 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -70.19 -6.45 34.56 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.668 1.187 . . . . 4.46 113.203 -178.066 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -59.3 -57.78 11.53 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.196 0.998 . . . . 3.1499999999999999 109.937 171.551 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -52.11 -48.79 64.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.545 0.738 . . . . 2.1699999999999999 112.035 176.378 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 21.0 t-105 -59.0 -49.82 76.45 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 119.244 -0.407 . . . . 0.83999999999999997 111.729 178.979 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.5 m -55.32 -43.61 75.06 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.75 1.62 . . . . 1.76 111.865 174.611 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 48.9 mt -69.36 -38.37 78.06 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 118.177 -0.915 . . . . 0.75 113.271 179.745 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 30.2 mm -56.79 -41.34 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 120.542 1.519 . . . . 0.63 111.662 178.26 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.74 -18.8 57.43 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-O 119.365 -0.686 . . . . 0.70999999999999996 114.174 -179.258 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 188' ' ' GLY . . . . . 0.441 ' HA3' HD11 ' B' ' 165' ' ' LEU . . . -80.8 -11.7 83.6 Favored Glycine 0 CA--C 1.535 1.334 0 CA-C-N 118.866 1.333 . . . . 0.68000000000000005 114.076 175.133 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.7 mp -108.54 -45.04 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.657 1.183 . . . . 0.87 110.325 171.946 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 23.6 m -80.57 77.51 7.37 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 125.17 1.388 . . . . 1.3400000000000001 107.982 176.292 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -158.44 -74.39 0.02 OUTLIER Glycine 0 CA--C 1.53 1.03 0 C-N-CA 125.502 1.525 . . . . 0.81999999999999995 112.019 -172.084 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -63.11 -34.81 68.03 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.004 2.469 . . . . 1.0800000000000001 113.418 177.851 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.9 pt -83.67 -6.92 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 114.035 1.124 . . . . 0.91000000000000003 114.035 174.722 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -50.07 -55.26 15.58 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.093 1.357 . . . . 1.5700000000000001 113.919 -172.758 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 mtpp -66.51 -39.63 88.77 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-O 116.987 -1.483 . . . . 5.3700000000000001 112.86 174.336 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.5 tt -50.29 -41.81 51.39 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 120.783 1.629 . . . . 1.75 111.675 177.896 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 85.1 mt -52.15 -54.99 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.351 1.06 . . . . 1.1000000000000001 112.432 169.028 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 57.8 t60 -73.33 -20.15 60.86 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.454 0.909 . . . . 2.23 113.454 -178.067 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.07 -44.29 69.41 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.923 0.889 . . . . 3.7400000000000002 109.487 168.09 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -60.64 -44.07 96.81 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.755 1.222 . . . . 2.3300000000000001 113.387 -176.277 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -70.69 1.46 5.3 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 122.529 1.157 . . . . 2.5600000000000001 112.825 -179.235 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -116.21 -53.5 2.54 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 120.725 -1.234 . . . . 2.6499999999999999 109.755 175.38 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -14.74 54.62 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 114.598 -1.183 . . . . 4.1200000000000001 114.167 178.604 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 33.6 t -121.7 28.64 7.55 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.383 1.873 . . . . 8.4199999999999999 112.853 168.759 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 32.8 t -72.67 2.29 6.8 Favored 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 115.817 1.784 . . . . 11.449999999999999 115.817 -178.021 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 35.5 m . . . . . 0 C--O 1.253 1.278 0 C-N-CA 128.858 2.863 . . . . 13.77 111.063 179.277 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.7 m . . . . . 0 CA--C 1.506 -0.723 0 CA-C-O 119.6 -0.238 . . . . 11.279999999999999 110.515 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -95.86 -106.1 0.15 Allowed 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 106.868 -1.53 . . . . 7.9699999999999998 106.868 140.443 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 74.2 m -89.65 -36.06 15.47 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.933 1.693 . . . . 3.4199999999999999 112.081 169.621 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -56.12 133.71 52.29 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.592 0.757 . . . . 2.25 109.605 168.938 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.6 p -62.37 151.82 35.79 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.511 1.05 . . . . 0.96999999999999997 109.521 174.73 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -58.87 -49.61 77.13 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.876 0.735 . . . . 2.4900000000000002 109.169 177.717 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -43.92 -49.47 8.42 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.381 1.873 . . . . 1.0600000000000001 111.499 176.331 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -56.53 4.93 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.875 -0.516 . . . . 3.0299999999999998 111.807 -171.089 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.41 ' HA ' ' HB ' ' A' ' 13' ' ' ILE . 28.8 mmtt -59.15 -22.16 60.49 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.856 -1.153 . . . . 6.9199999999999999 113.455 170.163 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.907 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.06 -46.35 68.06 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 120.566 -1.334 . . . . 0.47999999999999998 112.181 168.105 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 96.5 t -59.58 -39.85 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 121.081 1.764 . . . . 0.89000000000000001 110.318 170.596 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.41 ' HB ' ' HA ' ' A' ' 10' ' ' LYS . 1.1 mt -55.47 -47.07 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 118.558 -0.734 . . . . 1.49 111.344 169.358 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.55 -37.64 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.137 1.375 . . . . 0.57999999999999996 112.753 175.978 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.43 -37.29 86.73 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.8 1.182 . . . . 0.93000000000000005 111.009 172.67 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 74.2 t -72.04 -40.9 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.833 0.853 . . . . 0.68000000000000005 110.697 174.661 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -55.51 -60.1 3.89 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.72 1.146 . . . . 3.04 110.709 172.325 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.514 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -63.85 -30.6 71.67 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.151 0.797 . . . . 2.9100000000000001 113.151 -170.101 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -67.98 -60.64 2.35 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.589 0.755 . . . . 2.0699999999999998 110.951 169.815 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -60.97 -26.12 67.33 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 118.146 -0.93 . . . . 2.1000000000000001 112.388 -176.158 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.514 ' HE2' ' HA ' ' A' ' 18' ' ' ASN . 10.7 ttmm -43.88 -42.17 5.59 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.805 2.042 . . . . 2.2400000000000002 112.81 167.596 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -82.69 -19.0 38.92 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.014 1.116 . . . . 2.96 114.014 178.315 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.7 t -85.08 169.43 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 126.57 1.948 . . . . 2.48 110.387 -179.101 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.7 m -85.05 -16.12 41.77 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 116.126 -1.892 . . . . 3.6099999999999999 116.088 175.375 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.1 tttp 110.51 -37.41 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 130.813 3.645 . . . . 5.3499999999999996 112.265 -167.705 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -95.68 142.43 28.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.256 1.422 . . . . 7.9100000000000001 111.507 -178.98 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 72.3 p -81.35 -115.77 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.079 0.952 . . . . 6.9800000000000004 110.872 175.205 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 40.9 mt 60.36 4.73 0.72 Allowed 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 116.321 1.971 . . . . 7.6900000000000004 116.321 163.135 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.0 t 68.4 98.12 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 131.144 3.778 . . . . 4.9699999999999998 111.716 174.212 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.64 2.63 8.25 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.347 1.24 . . . . 8.1199999999999992 114.347 -177.297 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 28.3 m-20 71.8 -3.24 2.24 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 127.314 2.246 . . . . 8.8599999999999994 114.485 173.059 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -64.21 -19.72 65.54 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.742 1.617 . . . . 10.210000000000001 114.409 -164.214 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.8 tt -128.51 152.71 37.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 126.306 1.842 . . . . 2.3999999999999999 107.578 156.068 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 t -147.84 -175.63 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 122.036 0.922 . . . . 4.0899999999999999 110.84 167.897 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -29.36 24.4 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.651 2.38 . . . . 2.0 114.498 -176.188 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.5 p -61.18 -26.27 67.6 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.157 1.383 . . . . 2.25 114.349 172.515 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.4 m -91.3 -40.9 11.23 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.316 1.228 . . . . 1.28 114.316 -175.932 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.418 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 42.5 t80 -54.82 -52.22 63.38 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.217 0.917 . . . . 2.1000000000000001 113.226 -167.06 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -54.37 -30.74 52.84 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.594 1.558 . . . . 2.9700000000000002 113.862 173.529 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -87.76 -50.83 6.21 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.574 1.149 . . . . 3.1099999999999999 109.782 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -47.49 -45.16 26.03 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.627 1.171 . . . . 1.5900000000000001 111.915 167.437 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 mt -54.85 -31.2 59.23 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.497 1.295 . . . . 1.1899999999999999 114.497 177.383 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.431 ' HB2' ' HE ' ' A' ' 56' ' ' ARG . 0.9 OUTLIER -87.97 -4.11 58.84 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 120.168 1.349 . . . . 2.2599999999999998 113.651 178.133 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.14 -43.68 7.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.004 1.321 . . . . 1.5900000000000001 111.373 168.243 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.465 ' OE2' ' HE3' ' A' ' 21' ' ' LYS . 7.4 mm-40 -97.71 -25.79 14.97 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.487 0.921 . . . . 2.9399999999999999 113.487 -166.231 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.63 34.71 5.08 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.211 1.404 . . . . 1.8899999999999999 110.621 -176.984 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -83.66 -5.95 59.32 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 117.243 2.312 . . . . 1.4199999999999999 117.243 -149.052 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -94.16 -50.27 5.36 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 120.223 1.374 . . . . 1.8100000000000001 109.93 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.9 tpp -46.46 -40.57 12.54 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.58 1.952 . . . . 1.96 112.527 164.751 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -84.59 91.29 7.86 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-O 122.834 1.302 . . . . 3.2999999999999998 110.159 177.297 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.9 t -91.04 -90.69 0.15 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.445 -1.252 . . . . 3.9900000000000002 109.926 -176.137 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -72.65 156.51 38.9 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.604 1.161 . . . . 3.8999999999999999 113.682 -178.452 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.7 m -63.87 -30.0 71.13 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.322 1.449 . . . . 2.6400000000000001 111.667 171.494 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.11 -37.7 92.03 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.296 1.427 . . . . 2.1699999999999999 112.525 168.066 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.34 -36.19 74.08 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.044 0.922 . . . . 3.5699999999999998 111.601 171.241 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.431 ' HE ' ' HB2' ' A' ' 43' ' ' GLN . 48.1 mtt85 -65.73 -24.26 66.93 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.509 0.929 . . . . 7.0499999999999998 113.509 176.169 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt -59.07 -17.21 23.82 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.868 -1.145 . . . . 4.21 113.725 166.121 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.47 -19.2 53.61 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.267 1.58 . . . . 1.3600000000000001 115.267 169.2 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.17 -55.29 4.84 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.739 1.216 . . . . 0.93999999999999995 110.422 163.565 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -64.08 -28.89 70.09 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 113.996 1.109 . . . . 2.77 113.996 -176.962 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.3 ptmm? -53.02 -33.58 52.39 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 120.074 1.306 . . . . 3.6000000000000001 112.596 167.688 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.5 mt -77.16 -41.43 41.74 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 122.138 -0.351 . . . . 0.92000000000000004 111.459 -179.839 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.3 mm -53.3 -56.12 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 C-N-CA 124.102 0.961 . . . . 1.1599999999999999 110.191 -179.827 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -57.44 -40.43 78.42 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.7 0.8 . . . . 1.8799999999999999 112.906 -179.018 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -64.34 -38.92 92.75 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 112.935 0.717 . . . . 4.0099999999999998 112.935 175.804 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.42 -38.92 16.87 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.412 0.685 . . . . 2.3399999999999999 111.962 -173.074 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.5 -22.52 66.18 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.829 0.851 . . . . 2.9199999999999999 112.826 177.137 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.37 -17.31 61.83 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.314 1.227 . . . . 2.8399999999999999 114.314 168.503 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -128.63 -8.93 5.08 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 115.158 1.54 . . . . 3.3500000000000001 115.158 -166.545 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -137.87 107.68 6.28 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.489 1.495 . . . . 4.25 111.929 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.0 p-10 -78.6 77.23 5.09 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.482 1.513 . . . . 4.0899999999999999 112.423 -174.714 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.86 10.7 77.52 Favored Glycine 0 N--CA 1.476 1.332 0 C-N-CA 124.117 0.865 . . . . 2.5499999999999998 114.587 175.197 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -64.87 153.64 39.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.557 1.543 . . . . 5.79 111.921 179.132 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -140.65 86.57 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 124.819 1.247 . . . . 4.2800000000000002 107.883 175.573 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.7 t -89.66 149.63 22.71 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 125.296 1.438 . . . . 1.5900000000000001 112.085 169.6 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -58.27 -41.51 84.48 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.756 -0.59 . . . . 2.7799999999999998 111.907 169.536 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -79.04 -23.2 44.43 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.084 0.772 . . . . 4.0999999999999996 113.084 -174.269 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -54.83 -59.04 5.26 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.262 -1.014 . . . . 3.4199999999999999 108.262 167.08 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -55.45 -43.78 75.75 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.234 -0.916 . . . . 3.02 113.006 179.57 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -65.76 -49.26 69.02 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.304 -0.873 . . . . 1.0600000000000001 112.957 -178.861 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 4.6 t -67.97 -25.65 65.54 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.114 0.87 . . . . 2.0299999999999998 112.498 178.379 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 89.5 mt -65.51 -49.61 68.32 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.277 -0.868 . . . . 0.67000000000000004 111.362 171.541 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 34.4 mm -54.85 -40.34 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 CA-C-N 120.561 1.528 . . . . 0.58999999999999997 113.538 -177.553 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.69 -28.24 71.23 Favored Glycine 0 CA--C 1.529 0.939 0 CA-C-O 119.477 -0.624 . . . . 0.65000000000000002 112.751 175.048 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.05 -14.66 74.36 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-O 117.63 -1.65 . . . . 0.83999999999999997 116.535 -174.683 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.4 mp -87.33 -31.36 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-N 119.637 1.719 . . . . 1.0800000000000001 110.795 163.193 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.1 m -71.55 168.92 16.56 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.195 1.798 . . . . 3.3399999999999999 108.712 176.342 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.69 -73.07 0.3 Allowed Glycine 0 CA--C 1.531 1.078 0 CA-C-O 117.821 -1.544 . . . . 1.3899999999999999 113.03 179.763 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -63.72 -43.64 16.05 Favored 'Trans proline' 0 C--N 1.351 0.666 0 CA-C-N 120.539 2.169 . . . . 1.4299999999999999 110.138 174.584 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.1 pt -67.43 -22.55 28.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 113.62 0.97 . . . . 1.3999999999999999 113.62 170.875 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.437 ' HA ' HD12 ' A' ' 94' ' ' ILE . . . -57.73 -55.7 31.53 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.976 1.262 . . . . 1.48 112.7 -171.79 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -29.3 70.23 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.831 -1.168 . . . . 3.8999999999999999 112.389 176.712 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.44 -41.45 72.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.343 1.457 . . . . 1.3600000000000001 110.572 -177.195 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.437 HD12 ' HA ' ' A' ' 91' ' ' ALA . 62.9 mt -48.98 -60.17 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 1.1899999999999999 109.585 165.256 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -55.9 -44.66 78.45 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-O 118.38 -0.819 . . . . 1.98 111.7 -177.978 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -55.36 -43.08 74.74 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.137 1.335 . . . . 4.1299999999999999 112.805 173.483 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 24.2 mm100 -79.26 -30.54 43.11 Favored 'General case' 0 CA--C 1.527 0.079 0 N-CA-C 113.95 1.092 . . . . 2.7000000000000002 113.95 -172.553 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -71.89 -32.92 67.91 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.873 1.215 . . . . 2.4300000000000002 111.15 170.317 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.57 -40.91 96.4 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 121.132 -0.98 . . . . 2.6200000000000001 110.674 173.778 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -68.88 -16.09 63.67 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 115.43 -0.805 . . . . 5.3399999999999999 112.279 171.517 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.0 m 47.64 48.95 16.82 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.565 2.346 . . . . 9.0199999999999996 112.1 -170.388 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.0 t -135.63 69.99 1.43 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.899 1.679 . . . . 12.66 108.293 -164.723 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 54.5 p . . . . . 0 C--O 1.254 1.294 0 C-N-CA 126.267 1.827 . . . . 16.710000000000001 112.706 -177.468 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 39.2 m . . . . . 0 CA--C 1.505 -0.754 0 CA-C-O 119.361 -0.352 . . . . 11.529999999999999 111.419 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -83.98 -118.67 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.133 0 O-C-N 124.755 1.285 . . . . 7.7199999999999998 107.54 144.558 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 73.8 m -106.52 -26.2 11.51 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.599 2.36 . . . . 3.8500000000000001 111.354 -176.426 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -56.14 139.11 48.46 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 118.722 -0.656 . . . . 2.3599999999999999 109.505 156.804 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 26.9 p -61.8 147.65 45.7 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.234 0.925 . . . . 1.0600000000000001 109.703 171.641 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.44 -48.09 72.11 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.772 -0.633 . . . . 2.8799999999999999 110.348 173.612 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -47.92 -49.91 28.58 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.797 1.639 . . . . 0.72999999999999998 111.976 177.183 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.42 -54.23 8.8 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.422 -0.799 . . . . 2.98 111.091 -171.727 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 28.0 mmtt -56.36 -24.79 46.47 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.883 -1.135 . . . . 7.4500000000000002 113.48 169.064 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.907 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.86 -45.27 75.05 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.652 -1.28 . . . . 0.53000000000000003 112.62 168.027 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 93.7 t -57.66 -38.08 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 CA-C-N 120.834 1.652 . . . . 0.77000000000000002 110.468 169.117 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 2.3 mt -59.71 -49.49 83.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 121.481 -0.762 . . . . 1.4099999999999999 112.23 170.031 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.9 t -60.81 -38.8 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.777 1.631 . . . . 0.56999999999999995 112.256 178.472 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.79 -40.47 97.42 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.401 1.0 . . . . 0.98999999999999999 111.048 172.438 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 66.8 t -66.67 -41.35 88.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-O 117.467 -1.254 . . . . 0.68999999999999995 110.957 177.156 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -67.56 -39.41 84.93 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 121.185 1.811 . . . . 4.4400000000000004 113.982 169.399 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -61.55 -24.39 66.6 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.35 -1.469 . . . . 3.4900000000000002 113.162 177.216 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -81.01 -66.19 0.92 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.736 1.214 . . . . 1.8799999999999999 112.559 164.345 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -60.29 -31.39 70.21 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 118.195 -0.907 . . . . 2.1099999999999999 112.774 -167.862 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -52.24 -31.72 33.63 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.278 1.399 . . . . 2.3399999999999999 113.4 175.034 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -82.66 -16.56 47.8 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.803 -1.185 . . . . 2.23 113.605 177.213 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 25.6 t -99.37 157.2 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 127.105 2.162 . . . . 2.5600000000000001 108.976 -176.981 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 65.1 m -101.15 56.89 0.85 Allowed 'General case' 0 N--CA 1.483 1.211 0 O-C-N 120.542 -1.349 . . . . 4.04 112.135 166.101 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 34.1 tttp 77.87 -44.24 0.41 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 116.126 1.899 . . . . 5.2599999999999998 116.126 151.341 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -86.66 148.9 25.26 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.349 1.46 . . . . 7.9299999999999997 112.389 179.16 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 68.8 p -85.74 -125.86 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.714 1.206 . . . . 7.3899999999999997 111.408 178.968 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 61.9 mt 64.0 -19.1 0.07 Allowed 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 127.608 2.363 . . . . 8.1500000000000004 116.284 173.478 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 48.7 t 99.64 125.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.345 1 C-N-CA 132.87 4.468 . . . . 4.7199999999999998 108.176 -174.972 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 21.3 mmmt -123.78 -16.71 6.58 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 115.561 1.689 . . . . 6.96 115.561 -169.373 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 55.0 m-20 57.61 19.96 5.86 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.5 1.52 . . . . 8.9399999999999995 112.717 -170.02 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -80.55 -29.27 37.12 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 120.59 -1.319 . . . . 9.9299999999999997 112.394 -168.364 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 10.2 tt -140.03 157.95 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 C-N-CA 126.75 2.02 . . . . 2.29 107.316 169.168 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 9.1 t -148.43 -175.19 4.82 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 122.759 1.266 . . . . 4.0899999999999999 111.157 171.229 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.17 -35.69 27.26 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.981 2.912 . . . . 2.0099999999999998 114.349 -177.824 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 26.8 p -58.83 -26.47 64.19 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.089 1.356 . . . . 2.0299999999999998 114.409 173.821 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 19.3 m -91.53 -40.33 11.42 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.394 1.078 . . . . 1.3400000000000001 113.756 -178.848 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 53.4 t80 -55.45 -51.59 66.41 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.789 1.177 . . . . 2.1600000000000001 113.473 -166.476 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.35 -32.29 48.47 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.202 1.401 . . . . 2.8300000000000001 114.024 171.28 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -84.06 -52.49 6.26 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.021 1.328 . . . . 3.02 109.459 -173.183 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 13.9 tmm? -44.96 -45.08 10.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.138 1.775 . . . . 1.52 112.395 165.501 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.2 mt -58.86 -27.91 65.59 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.614 1.166 . . . . 1.21 114.112 179.622 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -92.53 3.84 54.73 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.894 1.225 . . . . 2.1600000000000001 113.862 173.191 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -44.44 5.84 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.044 0.938 . . . . 1.49 111.614 165.605 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.01 -18.59 19.32 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 113.735 1.013 . . . . 2.8799999999999999 113.735 -170.935 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.85 26.77 8.03 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.311 1.845 . . . . 1.8300000000000001 111.574 -179.365 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -71.93 1.93 6.38 Favored 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 117.832 2.531 . . . . 1.4399999999999999 117.832 -157.94 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -99.64 -57.82 2.06 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.701 1.201 . . . . 1.8799999999999999 110.007 178.025 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 152' ' ' MET . . . . . 0.441 ' SD ' HD12 ' B' ' 193' ' ' ILE . 8.1 ttp -65.36 -27.65 68.73 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.28 1.032 . . . . 2.0499999999999998 113.058 168.223 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 6.1 mp -98.53 82.04 2.8 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.799 1.182 . . . . 4.1399999999999997 110.871 157.445 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 6.3 t -104.52 -64.06 1.15 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.892 2.077 . . . . 4.7699999999999996 110.785 178.345 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -72.57 140.93 48.38 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.15 0.98 . . . . 4.25 112.433 176.58 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 77.0 m -71.91 -26.09 62.17 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.572 1.949 . . . . 3.1099999999999999 112.72 175.98 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -61.61 -45.69 95.8 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-N 119.222 0.919 . . . . 2.0600000000000001 111.064 165.927 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.14 -37.41 82.74 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.796 0.839 . . . . 3.5499999999999998 111.739 169.598 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 -64.81 -25.56 67.96 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.779 1.172 . . . . 7.3600000000000003 113.642 177.881 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.7 mtmt -58.63 -17.78 25.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.141 1.337 . . . . 4.3200000000000003 113.465 167.739 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.6 -19.13 56.07 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 115.315 1.598 . . . . 1.54 115.315 168.511 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.82 -55.71 4.79 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.207 1.003 . . . . 1.0800000000000001 110.382 163.136 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -64.6 -28.96 69.98 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.734 1.013 . . . . 2.98 113.734 -175.425 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 5.5 ptmm? -52.53 -32.97 43.26 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 119.654 1.115 . . . . 3.8700000000000001 112.412 168.722 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 48.8 mt -76.96 -42.44 39.08 Favored 'General case' 0 C--O 1.224 -0.265 0 O-C-N 121.704 -0.622 . . . . 0.96999999999999997 111.675 -179.653 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 35.6 mm -52.01 -53.68 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 125.099 1.36 . . . . 1.3400000000000001 110.485 -179.179 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -59.53 -42.51 92.48 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.214 0.82 . . . . 1.96 113.214 -179.949 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -64.62 -30.0 71.02 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.293 0.637 . . . . 3.9900000000000002 112.709 175.682 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -85.8 -47.24 9.91 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.17 0.988 . . . . 2.6800000000000002 112.026 -176.8 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -63.78 -23.3 67.31 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.197 0.908 . . . . 3.0800000000000001 112.692 178.358 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -67.71 -15.01 63.43 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.63 1.344 . . . . 2.8500000000000001 114.63 170.656 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -136.53 -20.43 1.36 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.619 1.711 . . . . 3.4500000000000002 115.619 -169.009 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -122.46 99.75 6.58 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.716 -1.24 . . . . 4.9100000000000001 111.666 -167.758 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -77.6 76.95 4.13 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.818 1.247 . . . . 3.9199999999999999 113.687 -169.996 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 72.2 11.51 75.38 Favored Glycine 0 N--CA 1.477 1.37 0 O-C-N 120.943 -1.098 . . . . 2.6299999999999999 114.345 176.75 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -65.93 152.16 45.13 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.772 1.629 . . . . 5.6200000000000001 111.935 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 2.5 mp -140.23 78.64 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.779 1.232 . . . . 4.1799999999999997 108.353 174.605 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 27.7 t -82.61 151.67 26.24 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.5 1.12 . . . . 1.5800000000000001 112.171 169.261 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -57.84 -42.11 83.74 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.621 -0.674 . . . . 2.7599999999999998 111.545 170.04 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.95 -22.71 39.38 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.031 0.752 . . . . 3.8199999999999998 113.031 -173.061 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -56.59 -53.11 61.42 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.714 -0.847 . . . . 3.7200000000000002 108.714 166.276 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -58.16 -46.87 84.96 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.274 -0.891 . . . . 2.9900000000000002 112.484 176.505 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 49.7 t-105 -65.4 -47.78 75.11 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 120.924 -1.11 . . . . 0.96999999999999997 113.369 -176.373 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.6 t -63.44 -32.86 74.41 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.481 1.037 . . . . 1.9399999999999999 111.914 176.321 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.414 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 67.6 mt -61.54 -49.47 76.55 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.263 -0.898 . . . . 0.81999999999999995 112.249 173.711 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.2 mm -57.14 -40.12 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 CA-C-N 120.418 1.463 . . . . 0.78000000000000003 113.023 -176.712 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.02 -29.74 75.3 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 119.206 -0.774 . . . . 0.81999999999999995 112.735 174.803 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.84 -16.16 75.81 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.404 1.478 . . . . 0.83999999999999997 116.297 -173.807 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.1 mp -86.68 -31.41 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 CA-C-N 119.249 1.524 . . . . 0.98999999999999999 110.82 164.297 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.5 m -74.01 171.13 14.03 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.988 1.715 . . . . 3.0499999999999998 108.546 178.209 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . 115.43 -73.86 0.25 Allowed Glycine 0 N--CA 1.473 1.153 0 CA-C-O 117.752 -1.582 . . . . 1.2 113.399 179.532 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.27 -41.0 22.98 Favored 'Trans proline' 0 C--N 1.351 0.687 0 CA-C-N 121.276 2.538 . . . . 1.3 110.348 175.616 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 193' ' ' ILE . . . . . 0.441 HD12 ' SD ' ' B' ' 152' ' ' MET . 12.4 pt -69.26 -21.2 24.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 113.577 0.955 . . . . 1.3300000000000001 113.577 170.727 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 194' ' ' ALA . . . . . 0.454 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -60.26 -45.73 92.27 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.185 1.357 . . . . 1.27 112.628 -178.448 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -65.68 -35.52 81.01 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 120.68 -1.262 . . . . 3.5099999999999998 112.89 170.521 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.4 mt -64.35 -41.79 96.57 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.696 -1.145 . . . . 1.8600000000000001 111.172 179.317 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 197' ' ' ILE . . . . . 0.454 HD12 ' HA ' ' B' ' 194' ' ' ALA . 75.1 mt -49.57 -58.1 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 119.625 1.102 . . . . 1.28 110.1 164.569 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -58.44 -36.23 73.33 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 118.433 -0.794 . . . . 1.98 112.611 -172.372 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -68.57 -49.78 56.8 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.669 1.988 . . . . 4.0099999999999998 112.693 171.84 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -70.47 -32.17 69.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.368 1.067 . . . . 2.5899999999999999 113.466 -172.124 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -66.55 -35.71 80.9 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 119.951 1.251 . . . . 2.5 111.207 170.952 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -65.95 -42.38 90.07 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 120.643 -1.285 . . . . 2.25 110.588 178.146 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -68.72 -11.68 60.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.417 1.887 . . . . 4.3600000000000003 112.754 177.735 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 10.3 m 52.58 48.2 23.07 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.72 2.408 . . . . 8.7100000000000009 111.793 -173.991 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 32.4 t -145.34 69.89 1.25 Allowed 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 122.376 1.084 . . . . 12.550000000000001 109.648 -159.553 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 81.3 p . . . . . 0 C--O 1.251 1.166 0 CA-C-O 115.647 -2.12 . . . . 16.32 110.807 177.364 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 N--CA 1.476 0.866 0 CA-C-O 121.202 0.525 . . . . 10.23 109.624 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -112.91 61.27 0.64 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 124.758 2.218 . . . . 9.1099999999999994 111.361 -138.283 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 60.8 m -75.22 36.81 0.12 Allowed 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 110.271 -3.149 . . . . 3.6600000000000001 115.167 -169.328 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.92 159.93 22.29 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.442 2.297 . . . . 2.1200000000000001 108.376 163.543 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.47 153.25 35.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.458 -1.401 . . . . 1.04 110.425 178.385 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -63.96 -34.13 77.28 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 119.648 1.113 . . . . 2.0600000000000001 111.437 174.443 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.01 -45.81 87.29 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 120.108 1.322 . . . . 1.1000000000000001 109.375 177.049 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -66.13 -55.74 14.91 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.94 1.296 . . . . 3.02 112.057 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -58.64 -29.72 66.76 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 120.868 -1.145 . . . . 5.3799999999999999 112.099 172.284 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.789 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.38 -41.37 76.57 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 119.649 -1.907 . . . . 0.67000000000000004 112.488 169.078 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.437 ' HA ' ' HG ' ' A' ' 15' ' ' LEU . 85.9 t -56.66 -37.54 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 CA-C-N 119.733 1.151 . . . . 0.71999999999999997 110.773 167.887 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.1 mt -55.92 -56.75 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 CA-C-N 120.924 1.693 . . . . 1.05 111.852 166.073 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.1 t -52.85 -43.75 46.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 119.382 0.992 . . . . 1.0 112.218 -177.773 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.437 ' HG ' ' HA ' ' A' ' 12' ' ' VAL . 1.8 pp -71.44 -18.94 62.29 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.161 1.171 . . . . 4.2699999999999996 114.161 177.956 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.2 t -81.95 -43.52 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.291 0.95 . . . . 0.93999999999999995 110.261 179.177 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -56.68 -41.45 77.33 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.227 0.467 . . . . 3.3799999999999999 110.593 171.988 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -66.75 -23.8 66.13 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 115.397 1.629 . . . . 2.6299999999999999 115.397 -178.243 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -79.61 -52.91 7.39 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.567 -0.708 . . . . 1.9399999999999999 111.852 170.97 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.423 ' HA ' HG22 ' A' ' 23' ' ' VAL . 37.4 m-85 -68.22 -30.75 69.9 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 117.995 -1.002 . . . . 1.79 113.668 -172.065 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.39 -26.31 66.56 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.492 1.293 . . . . 3.7400000000000002 114.492 172.638 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -93.1 -31.14 14.93 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.76 1.022 . . . . 2.3100000000000001 113.76 177.847 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.423 HG22 ' HA ' ' A' ' 20' ' ' TYR . 18.9 m -88.36 -159.69 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 121.605 -0.684 . . . . 2.8199999999999998 110.736 174.68 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.9 m -73.36 -10.74 60.06 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 118.0 2.593 . . . . 5.3399999999999999 118.0 -164.212 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 46.8 tptt 112.72 -69.25 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 130.623 3.569 . . . . 5.04 109.63 -157.649 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -130.49 -82.52 0.54 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.555 1.142 . . . . 6.8600000000000003 111.487 -173.731 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.4 m -155.29 6.17 0.23 Allowed 'General case' 0 N--CA 1.479 1.024 0 O-C-N 120.59 -1.319 . . . . 7.4500000000000002 114.268 -178.733 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 90.8 mt -76.56 -17.53 59.17 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.47 1.285 . . . . 8.9700000000000006 114.47 -174.087 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . 0.276 2.7 t 41.45 65.71 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 127.451 2.3 . . . . 4.8399999999999999 114.357 -177.494 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -84.62 -8.11 59.01 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.364 -1.289 . . . . 9.8100000000000005 112.058 157.458 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -171.86 162.49 6.1 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 128.151 2.58 . . . . 7.3300000000000001 110.247 178.148 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 15.4 ptmm? -167.98 158.02 10.21 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.508 2.323 . . . . 6.8899999999999997 112.438 179.396 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 7.2 pt -74.13 162.16 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-O 122.459 1.123 . . . . 3.0 112.872 165.781 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.3 t -78.93 150.52 32.08 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.169 -0.923 . . . . 3.1000000000000001 110.576 154.762 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -43.55 -32.3 0.9 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.745 1.618 . . . . 2.2400000000000002 113.075 171.659 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 82.4 p -67.92 -18.09 64.67 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 115.68 1.733 . . . . 1.76 115.68 -178.952 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.7 m -65.61 -43.49 89.46 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 121.114 1.779 . . . . 1.24 112.128 177.986 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.489 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 10.8 t80 -50.4 -53.02 32.45 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.29 1.036 . . . . 2.02 112.866 -178.327 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -61.52 -17.93 56.91 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.318 0.858 . . . . 2.4500000000000002 113.318 179.481 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -95.66 -42.3 8.46 Favored 'General case' 0 C--O 1.225 -0.184 0 C-N-CA 124.699 1.2 . . . . 3.4399999999999999 112.329 178.438 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -44.39 -53.39 6.89 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.26 1.024 . . . . 1.71 109.544 162.363 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.489 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 11.8 mt -52.84 -15.88 0.86 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.12 2.168 . . . . 1.3100000000000001 116.568 174.071 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.21 1.09 10.78 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.667 1.576 . . . . 2.4300000000000002 114.187 174.746 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.92 -43.99 6.51 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.985 0.914 . . . . 1.8799999999999999 111.766 164.643 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -88.03 -40.36 13.91 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.977 1.711 . . . . 3.2400000000000002 112.496 -179.08 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.84 25.19 10.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.592 1.557 . . . . 2.21 112.253 -175.68 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -67.5 -23.84 65.51 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 120.917 -1.114 . . . . 1.74 113.708 -174.23 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -86.13 -20.55 28.49 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.245 0.93 . . . . 1.8400000000000001 112.128 -169.026 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.7 mtm -98.23 -8.24 27.72 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 114.954 1.464 . . . . 2.6200000000000001 114.954 168.275 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tp -77.72 71.47 4.2 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 120.445 1.475 . . . . 2.4399999999999999 111.821 -176.43 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.0 m -70.69 3.56 3.08 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 117.416 2.376 . . . . 4.2000000000000002 117.416 -166.587 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -177.32 158.39 1.44 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 127.333 2.253 . . . . 5.5899999999999999 110.502 -179.418 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 53.8 m -58.24 -30.47 66.56 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.783 2.033 . . . . 2.9399999999999999 112.405 171.939 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.8 -33.41 68.0 Favored Glycine 0 N--CA 1.472 1.085 0 CA-C-N 120.48 1.491 . . . . 2.3199999999999998 113.605 175.938 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -64.63 -45.69 85.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.327 0.651 . . . . 3.3700000000000001 110.938 171.684 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.1 mmm-85 -61.94 -43.87 97.95 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 120.662 -1.274 . . . . 5.25 113.638 169.082 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -53.35 -34.96 59.61 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 121.554 1.979 . . . . 3.4300000000000002 111.916 173.879 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.44 -17.55 60.77 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 115.013 1.486 . . . . 1.3200000000000001 115.013 174.858 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -80.22 -48.7 12.7 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.374 0.988 . . . . 0.93000000000000005 110.822 163.794 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -63.06 -39.6 95.2 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.352 1.061 . . . . 2.5899999999999999 111.943 -174.826 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.4 ptmm? -52.43 -29.12 22.88 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 113.841 1.052 . . . . 3.7400000000000002 113.841 172.588 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.1 mt -78.85 -36.45 42.32 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 124.045 0.938 . . . . 0.96999999999999997 111.986 -177.704 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.0 mm -57.69 -51.07 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.608 1.163 . . . . 1.1200000000000001 109.835 -178.199 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -70.55 -31.62 68.73 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.882 1.273 . . . . 1.8999999999999999 112.959 -179.708 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -65.47 -35.39 80.76 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.626 0.77 . . . . 3.0699999999999998 112.158 167.568 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.7 tp -75.11 -20.48 59.42 Favored 'General case' 0 C--O 1.221 -0.421 0 O-C-N 120.9 -1.125 . . . . 2.9199999999999999 111.562 174.216 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -70.43 -5.14 26.31 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 115.585 1.698 . . . . 2.7200000000000002 115.585 170.275 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.77 -2.83 31.65 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 113.444 0.905 . . . . 3.2599999999999998 113.444 157.321 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -143.02 179.61 6.94 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 127.264 2.225 . . . . 3.21 110.815 -169.662 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 26.9 t60 101.03 71.64 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 128.231 2.613 . . . . 5.8200000000000003 112.31 159.149 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.86 46.7 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 130.325 3.45 . . . . 6.4400000000000004 114.692 -169.534 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.28 -14.75 2.21 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 126.262 1.886 . . . . 3.3399999999999999 114.275 -176.074 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.2 mmt85 -90.37 -167.53 1.86 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.662 1.985 . . . . 7.0 112.059 -177.538 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.7 mm -139.65 132.06 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 127.637 2.375 . . . . 3.3500000000000001 106.542 175.434 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 71.0 m -113.26 146.83 38.7 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.833 0.853 . . . . 1.99 110.727 162.584 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -60.65 -38.02 83.48 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.348 0.87 . . . . 2.1299999999999999 113.348 -174.935 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -71.97 -8.83 56.77 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.317 1.047 . . . . 4.4800000000000004 112.883 -176.443 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.82 -56.33 18.42 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.119 0.872 . . . . 3.9900000000000002 111.095 175.526 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -58.58 -33.2 69.69 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.207 -1.558 . . . . 2.3100000000000001 112.212 176.007 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 23.5 t-105 -67.72 -59.49 3.28 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.951 0.723 . . . . 1.0800000000000001 112.951 178.108 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.9 t -60.28 -23.9 64.52 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.023 1.329 . . . . 1.72 112.147 178.181 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 65.0 mt -73.97 -46.67 42.46 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 117.807 -1.092 . . . . 0.63 113.44 169.355 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 8.2 mm -55.05 -40.8 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 CA-C-N 121.732 2.06 . . . . 0.89000000000000001 112.423 -178.298 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.74 -21.79 63.46 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-N 118.251 0.478 . . . . 0.59999999999999998 113.39 177.135 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.8 -19.45 76.79 Favored Glycine 0 CA--C 1.532 1.143 0 O-C-N 121.236 -1.155 . . . . 0.67000000000000004 114.068 177.963 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -110.2 -34.19 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.904 1.281 . . . . 1.05 111.502 170.495 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.5 m -77.4 85.18 3.8 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.285 1.434 . . . . 1.3700000000000001 108.226 177.667 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -170.33 -68.4 0.04 OUTLIER Glycine 0 CA--C 1.532 1.134 0 C-N-CA 126.077 1.799 . . . . 0.97999999999999998 111.846 -172.753 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -59.28 -67.83 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.654 2.903 . . . . 1.23 110.877 168.563 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.8 pt -65.84 -20.78 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 117.717 -1.135 . . . . 1.3899999999999999 113.614 177.677 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.54 71.19 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.632 1.56 . . . . 0.93000000000000005 112.32 173.677 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -63.67 -41.23 98.21 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.848 -1.157 . . . . 4.0899999999999999 112.585 173.9 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.81 -35.17 75.81 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.219 1.008 . . . . 1.3400000000000001 112.722 178.945 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.2 mt -55.45 -52.71 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 120.854 -1.154 . . . . 1.01 110.161 171.173 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -67.27 -35.71 80.08 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.683 0.623 . . . . 1.8100000000000001 112.683 -176.237 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.263 4.6 pt-20 -75.41 -19.67 59.37 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 119.582 1.083 . . . . 3.0499999999999998 112.514 174.748 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -79.49 -43.64 22.79 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 117.56 -1.209 . . . . 2.3399999999999999 114.212 172.72 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -61.65 -17.85 57.09 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 119.785 1.175 . . . . 2.3700000000000001 111.762 177.286 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.5 -66.38 0.9 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.325 1.45 . . . . 2.2599999999999998 110.058 176.175 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 57.31 -11.02 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.151 1 C-N-CA 133.235 4.614 . . . . 4.6900000000000004 116.075 173.499 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.1 t -123.35 3.45 9.13 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.57 0.952 . . . . 6.5899999999999999 113.57 -159.6 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 84.93 106.0 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.353 2.661 . . . . 8.6799999999999997 110.851 -172.781 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 5.5 p . . . . . 0 C--O 1.25 1.104 0 C-N-CA 129.775 3.23 . . . . 11.300000000000001 109.931 -172.887 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 70.1 m . . . . . 0 N--CA 1.477 0.893 0 N-CA-C 109.945 -0.391 . . . . 9.8000000000000007 109.945 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -117.3 62.56 0.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 125.031 2.348 . . . . 8.8100000000000005 111.188 -138.654 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 66.7 m -76.43 -5.54 47.81 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 109.755 -3.384 . . . . 3.6899999999999999 115.512 -168.14 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -75.54 137.74 41.05 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.29 1.036 . . . . 2.3799999999999999 109.59 167.309 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 22.3 p -70.48 152.55 43.9 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 119.81 1.186 . . . . 1.04 111.339 -172.931 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -59.31 -36.08 74.98 Favored 'General case' 0 C--O 1.221 -0.443 0 O-C-N 121.526 -0.734 . . . . 2.1299999999999999 111.851 -177.42 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -44.72 89.19 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.497 1.044 . . . . 1.3600000000000001 111.149 175.261 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -65.68 -56.46 12.0 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.077 0.951 . . . . 2.8399999999999999 111.004 -179.569 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.0 tmtt? -58.33 -27.72 64.41 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 120.941 -1.099 . . . . 4.6399999999999997 112.611 172.137 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.789 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.98 -42.14 76.96 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 119.344 -2.097 . . . . 0.58999999999999997 113.08 167.842 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 22.1 t -59.81 -31.08 46.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 CA-C-N 120.299 1.409 . . . . 0.71999999999999997 111.663 168.746 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 69.9 mt -58.57 -60.68 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 O-C-N 120.354 -1.467 . . . . 1.01 111.217 163.097 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 32.9 t -52.94 -44.28 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 124.41 1.084 . . . . 1.02 112.652 -175.601 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 2.6 pp -70.65 -25.11 62.85 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.32 -0.863 . . . . 4.1799999999999997 112.777 -179.007 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 42.4 t -78.0 -31.66 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 124.199 1.0 . . . . 0.93000000000000005 110.57 178.045 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -54.14 -49.86 68.25 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.719 0.808 . . . . 2.8399999999999999 110.284 164.801 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -63.82 -19.26 64.88 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 115.165 1.543 . . . . 2.2799999999999998 115.165 -178.804 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -80.97 -62.11 1.76 Allowed 'General case' 0 C--O 1.237 0.434 0 O-C-N 121.308 -0.87 . . . . 2.2799999999999998 112.266 173.471 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -69.61 -21.22 63.59 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 113.598 0.962 . . . . 1.77 113.598 -171.393 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.42 -20.8 66.53 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.429 1.27 . . . . 3.0699999999999998 114.429 168.497 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 14.3 m-30 -106.3 -36.68 6.78 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.707 1.203 . . . . 2.1600000000000001 114.055 177.785 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 15.8 m -79.94 -169.23 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.168 0.894 . . . . 3.0499999999999998 111.449 172.309 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 3.4 m -70.71 -7.28 43.55 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 118.972 2.952 . . . . 5.4000000000000004 118.972 -162.697 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 40.8 tptt 109.39 -73.66 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 130.591 3.556 . . . . 5.1600000000000001 110.87 -161.797 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -123.65 -87.88 0.62 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.051 0.94 . . . . 6.6600000000000001 112.111 -173.956 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 14.2 m -155.41 1.43 0.17 Allowed 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 115.312 1.597 . . . . 7.5199999999999996 115.312 178.989 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.41 -34.33 77.93 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.307 0.958 . . . . 9.0700000000000003 112.948 176.951 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . 0.263 7.5 t 61.21 71.49 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 127.423 2.289 . . . . 4.7699999999999996 112.401 -172.552 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -79.62 -17.42 53.86 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.192 0.997 . . . . 9.9000000000000004 112.864 164.981 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -173.14 170.77 4.28 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 129.507 3.123 . . . . 7.3799999999999999 109.337 176.108 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -165.29 161.98 19.49 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.612 1.965 . . . . 6.8799999999999999 113.079 -175.48 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 7.8 pt -75.6 161.09 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 122.248 1.023 . . . . 3.0499999999999998 112.041 162.645 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 36.0 t -82.48 154.11 25.28 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.189 -0.914 . . . . 3.02 109.907 157.601 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -49.49 -34.42 16.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.211 1.004 . . . . 2.2200000000000002 112.027 170.679 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 99.7 p -61.73 -15.75 43.4 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.194 1.183 . . . . 1.6200000000000001 114.194 177.669 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 69.7 m -65.89 -37.2 85.5 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.931 1.242 . . . . 1.28 112.208 169.442 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.42 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 17.8 t80 -58.42 -49.23 78.03 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.184 1.357 . . . . 2.6099999999999999 113.295 -173.793 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 16.2 ptt85 -57.54 -12.44 2.73 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.286 1.034 . . . . 3.2999999999999998 113.215 174.243 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -109.82 -42.79 4.16 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 125.93 1.692 . . . . 3.3100000000000001 114.303 179.374 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -40.95 -49.88 3.26 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.885 1.674 . . . . 2.0299999999999998 110.217 163.135 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.6 mt -61.63 -24.64 66.85 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 114.633 1.346 . . . . 1.2 114.633 177.849 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -103.83 2.78 33.13 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.411 1.46 . . . . 2.54 114.124 175.91 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.09 -44.17 4.44 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.448 1.099 . . . . 1.5700000000000001 113.22 167.246 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -96.9 -15.58 21.12 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.803 1.241 . . . . 3.6400000000000001 114.222 -178.777 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.91 26.17 8.28 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.286 1.834 . . . . 1.8200000000000001 112.271 176.265 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -68.76 -16.12 63.71 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 116.046 1.869 . . . . 1.3200000000000001 116.046 -167.868 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -93.54 -38.23 11.49 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 119.644 1.111 . . . . 1.74 110.509 -175.141 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 36.5 mtm -77.64 -10.19 59.38 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 113.914 1.079 . . . . 2.6299999999999999 113.914 167.808 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.49 44.04 0.07 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.692 1.997 . . . . 2.3799999999999999 111.946 167.413 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.78 29.72 0.26 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.84 1.656 . . . . 4.5599999999999996 113.598 -167.801 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -174.41 163.89 3.75 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.308 2.643 . . . . 6.6200000000000001 108.886 -161.991 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 47.2 m -107.43 -17.94 13.99 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 125.384 1.474 . . . . 2.75 112.816 178.054 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -65.77 -41.69 95.57 Favored Glycine 0 CA--C 1.528 0.878 0 CA-C-N 119.234 0.924 . . . . 2.2400000000000002 112.036 175.44 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -57.53 -43.25 84.18 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 117.816 0.808 . . . . 3.3300000000000001 112.643 174.066 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.39 -50.27 72.08 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 124.133 0.973 . . . . 4.9500000000000002 112.957 171.395 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -61.57 -33.01 73.14 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.835 0.743 . . . . 3.1200000000000001 112.02 177.838 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 161' ' ' ALA . . . . . 0.508 ' HA ' ' HG2' ' B' ' 164' ' ' LYS . . . -68.07 -15.74 63.72 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.395 1.257 . . . . 1.1699999999999999 114.395 173.722 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.44 -44.97 23.38 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.957 0.799 . . . . 0.92000000000000004 110.955 164.301 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -61.91 -40.23 94.74 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.978 0.911 . . . . 2.7200000000000002 112.375 -175.722 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 164' ' ' LYS . . . . . 0.508 ' HG2' ' HA ' ' B' ' 161' ' ' ALA . 2.9 ptmm? -52.95 -26.31 14.71 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.133 1.16 . . . . 4.0 114.133 170.053 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 44.5 mt -83.08 -29.96 28.37 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 118.08 -0.962 . . . . 1.55 112.797 176.886 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 41.0 mm -58.33 -55.01 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 118.922 0.783 . . . . 1.21 108.933 177.868 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -61.53 -34.14 75.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.777 1.029 . . . . 2.5800000000000001 113.777 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -70.24 -33.7 71.96 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.598 1.159 . . . . 3.1099999999999999 111.979 175.147 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 24.3 tp -78.5 -21.96 48.16 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 123.87 0.868 . . . . 2.7599999999999998 111.205 172.275 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.52 -8.85 50.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.939 1.696 . . . . 2.96 115.455 174.48 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -73.31 -3.45 27.11 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 113.84 1.052 . . . . 3.2000000000000002 113.84 158.874 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -142.87 179.72 6.85 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 127.187 2.195 . . . . 3.1099999999999999 111.402 -169.447 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 27.1 t60 100.71 80.42 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 128.461 2.704 . . . . 5.5199999999999996 112.027 160.364 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -72.57 42.57 0.1 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 129.036 2.935 . . . . 6.5 114.404 -167.773 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 75.93 -17.73 3.58 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 126.127 1.822 . . . . 3.29 114.671 -179.499 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -87.57 -155.89 0.32 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.8 1.64 . . . . 7.0599999999999996 111.727 177.91 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.4 mm -145.98 136.09 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 128.213 2.605 . . . . 3.29 106.134 178.406 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.5 m -113.88 153.14 29.71 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.606 0.762 . . . . 2.04 111.257 159.894 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -65.17 -42.43 93.68 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 112.743 0.646 . . . . 1.8700000000000001 112.743 -176.268 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -68.97 -14.27 62.94 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.877 1.271 . . . . 4.3300000000000001 113.087 -173.986 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -56.59 -57.98 10.02 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.8 0.84 . . . . 4.1100000000000003 109.822 174.157 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -54.12 -39.71 66.67 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.026 -1.047 . . . . 2.5099999999999998 112.611 178.354 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -70.68 -53.9 13.93 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.749 0.648 . . . . 1.3899999999999999 112.749 -179.259 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -62.75 -20.42 64.93 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.701 1.2 . . . . 1.6000000000000001 113.117 -178.24 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.42 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 95.9 mt -76.38 -41.11 49.08 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.83 -1.169 . . . . 0.60999999999999999 113.933 168.143 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 13.8 mm -58.39 -46.26 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 CA-C-N 120.935 1.698 . . . . 0.75 112.278 -173.976 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.65 -21.72 60.9 Favored Glycine 0 CA--C 1.533 1.2 0 CA-C-N 118.441 0.564 . . . . 0.67000000000000004 113.4 177.33 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.05 -8.78 65.45 Favored Glycine 0 CA--C 1.535 1.287 0 O-C-N 121.078 -1.248 . . . . 0.89000000000000001 114.183 175.845 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.2 mp -120.39 -37.76 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 126.035 1.734 . . . . 1.3200000000000001 111.544 166.222 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 8.0 m -78.87 78.76 5.3 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.223 1.809 . . . . 1.3999999999999999 108.088 177.974 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -169.06 -65.78 0.03 OUTLIER Glycine 0 CA--C 1.524 0.627 0 CA-C-O 118.282 -1.288 . . . . 0.91000000000000003 111.127 -174.644 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -57.74 -62.89 0.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.906 2.404 . . . . 0.93999999999999995 110.817 166.05 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.1 pp -74.96 -14.66 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.903 1.229 . . . . 1.0600000000000001 113.142 -177.535 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.28 -36.41 84.02 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.599 0.592 . . . . 1.0 112.599 176.514 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -62.93 -41.4 99.47 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 120.624 -1.298 . . . . 4.1600000000000001 111.454 171.417 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.97 -37.09 73.56 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.261 1.424 . . . . 1.5900000000000001 113.019 174.14 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 84.9 mt -54.35 -54.15 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 O-C-N 121.094 -1.004 . . . . 0.92000000000000004 110.755 169.032 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -67.71 -34.62 77.24 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.478 0.918 . . . . 1.71 113.478 -175.495 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -74.14 -20.24 60.3 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 118.521 -0.752 . . . . 3.6600000000000001 112.268 173.758 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -78.61 -40.85 33.28 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 114.996 1.48 . . . . 2.21 114.996 172.924 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -62.98 -13.65 37.79 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 120.72 1.6 . . . . 2.3599999999999999 112.144 174.133 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.08 -71.5 0.71 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.308 1.443 . . . . 2.4399999999999999 109.616 175.974 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 57.35 -14.73 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.229 1 C-N-CA 134.251 5.02 . . . . 4.4699999999999998 116.092 172.814 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 21.8 t -119.14 7.24 11.3 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 124.381 1.072 . . . . 6.4100000000000001 113.037 -159.911 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 4.9 t 85.98 108.12 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 128.667 2.787 . . . . 8.8200000000000003 110.51 -171.881 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 4.6 p . . . . . 0 C--O 1.25 1.1 0 C-N-CA 129.619 3.168 . . . . 10.84 110.983 -177.832 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 106.58 -1.637 . . . . 8.0999999999999996 106.58 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -62.02 -106.42 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 107.999 -1.112 . . . . 6.4000000000000004 107.999 110.811 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 88.7 m -119.89 -91.68 0.55 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.689 1.996 . . . . 3.96 109.001 157.137 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 137.62 157.54 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.227 1 C-N-CA 133.579 4.751 . . . . 2.3199999999999998 109.808 -177.511 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -88.16 146.01 25.62 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.893 -0.78 . . . . 1.0700000000000001 108.893 159.01 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -67.26 -23.9 65.74 Favored 'General case' 0 C--O 1.212 -0.899 0 CA-C-O 117.325 -1.322 . . . . 2.9300000000000002 112.172 177.978 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -49.82 72.96 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 121.828 2.104 . . . . 1.02 109.5 173.487 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -66.52 -55.13 16.95 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 119.294 -0.384 . . . . 2.8599999999999999 111.752 -176.45 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.2 tptt -63.33 -25.51 68.34 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.868 -1.145 . . . . 6.5599999999999996 113.823 175.121 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.754 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -67.7 -43.94 78.9 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.082 -1.637 . . . . 0.54000000000000004 112.571 166.072 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 19.0 t -56.89 -39.93 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.317 1.417 . . . . 0.68000000000000005 110.262 170.212 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.6 mt -58.61 -52.39 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-O 118.052 -0.975 . . . . 1.1100000000000001 111.281 169.623 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.3 t -57.39 -36.34 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 125.248 1.419 . . . . 0.56999999999999995 112.585 178.868 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.25 -41.01 74.07 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 121.268 -0.895 . . . . 0.95999999999999996 111.877 174.128 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.16 -44.82 95.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.077 0.551 . . . . 0.65000000000000002 111.041 176.076 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -62.72 -41.6 99.23 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 119.074 -0.488 . . . . 3.54 110.719 173.707 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.477 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 10.4 t30 -62.4 -23.91 67.1 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.408 1.262 . . . . 2.1499999999999999 114.408 -174.585 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -78.02 -59.13 2.91 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.206 1.002 . . . . 1.8799999999999999 111.063 169.666 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -62.31 -31.88 72.55 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.543 0.942 . . . . 2.1200000000000001 113.543 -174.967 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.477 ' HD3' ' HA ' ' A' ' 18' ' ' ASN . 9.2 ptmt -56.4 -22.14 29.62 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 120.241 1.382 . . . . 2.6699999999999999 114.148 176.746 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -88.72 -12.69 41.57 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.137 1.162 . . . . 2.73 114.137 175.98 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 28.8 m -117.43 169.85 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 120.094 1.316 . . . . 2.5699999999999998 111.78 -179.004 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.2 m -85.75 137.61 32.68 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.214 -0.929 . . . . 3.77 113.203 177.193 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.6 tptm 14.74 62.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 128.45 2.7 . . . . 5.9800000000000004 115.786 157.129 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 63.69 9.63 4.49 Favored 'General case' 0 CA--C 1.557 1.212 0 C-N-CA 127.598 2.359 . . . . 7.0899999999999999 113.983 171.084 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.2 m -90.94 49.43 1.65 Allowed 'General case' 0 CA--C 1.542 0.668 0 O-C-N 119.957 -1.715 . . . . 4.7000000000000002 114.389 -156.618 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -60.51 21.48 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 130.785 3.634 . . . . 7.5800000000000001 117.868 -167.995 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.6 p -157.72 -36.7 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 C-N-CA 130.027 3.331 . . . . 4.4800000000000004 111.56 -176.463 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.88 -25.65 34.84 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 115.031 1.493 . . . . 8.5 115.031 177.489 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -164.23 151.8 12.16 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.009 1.324 . . . . 6.6799999999999997 111.62 172.721 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.54 163.32 27.43 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.128 1.158 . . . . 7.0899999999999999 114.128 -163.553 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 31.6 pt -87.62 151.95 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.646 0.778 . . . . 2.8999999999999999 110.147 161.023 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.5 m -88.07 159.14 18.38 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.055 -1.028 . . . . 2.6699999999999999 111.347 171.611 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -43.2 -35.07 1.27 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.365 1.866 . . . . 2.3999999999999999 115.574 -179.451 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.5 m -56.42 -29.98 62.23 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.897 1.443 . . . . 2.04 114.897 174.153 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.1 m -81.33 -18.88 44.16 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.754 1.02 . . . . 1.24 113.754 -173.362 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 63.8 t80 -64.85 -51.7 60.62 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.421 1.01 . . . . 2.1000000000000001 110.932 174.164 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.4 ptt180 -65.23 -31.77 73.09 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.319 0.647 . . . . 2.1699999999999999 112.458 179.673 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -70.45 -52.28 23.27 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.494 1.118 . . . . 3.8999999999999999 110.057 174.741 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -50.25 -43.23 52.98 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 121.179 -0.951 . . . . 1.3 111.88 172.072 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.403 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 12.6 mt -62.28 -15.31 46.7 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 115.921 1.823 . . . . 1.04 115.921 174.617 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -106.66 -7.75 17.21 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.314 1.416 . . . . 2.6200000000000001 114.144 169.705 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -56.26 4.33 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.647 1.112 . . . . 3.1200000000000001 110.97 160.809 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -85.64 -48.42 8.89 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.26 0.624 . . . . 2.6299999999999999 111.624 -167.868 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 tt -106.14 50.24 0.78 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.14 1.376 . . . . 2.0299999999999998 110.841 -168.993 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -94.5 -20.96 19.2 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 117.267 2.321 . . . . 1.3500000000000001 117.267 -170.758 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.15 -26.8 39.18 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 121.786 2.085 . . . . 1.6599999999999999 112.962 -177.071 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.1 tpp -65.94 24.84 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 128.965 2.906 . . . . 1.6799999999999999 115.66 175.949 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.2 mp -109.62 128.3 55.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 128.108 2.563 . . . . 3.3999999999999999 110.874 -173.611 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.7 m -106.22 -17.68 14.23 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.741 1.216 . . . . 4.1799999999999997 112.789 172.765 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -177.15 166.58 2.39 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 129.24 3.016 . . . . 4.2999999999999998 108.289 -173.389 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -27.59 -50.32 0.06 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 128.787 2.835 . . . . 2.2799999999999998 112.754 156.415 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.31 -38.48 49.76 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.725 1.631 . . . . 1.5600000000000001 114.484 -176.943 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -60.78 -33.01 72.32 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.317 1.058 . . . . 3.8799999999999999 112.003 178.55 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.72 -39.7 18.2 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.754 1.222 . . . . 8.1400000000000006 112.876 171.016 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.3 mmmt -61.38 -30.41 70.52 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.902 1.228 . . . . 3.2799999999999998 112.814 179.862 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -48.78 -47.49 41.85 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.954 0.902 . . . . 1.21 112.789 165.73 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.41 -41.66 98.72 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.077 1.351 . . . . 0.72999999999999998 112.241 174.692 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -61.41 -36.68 80.99 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.348 0.659 . . . . 2.27 112.566 178.077 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.9 mtmt -52.3 -37.77 56.65 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.437 1.017 . . . . 3.4199999999999999 112.499 174.378 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.5 mt -72.27 -31.53 65.85 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.551 1.54 . . . . 0.84999999999999998 112.992 -179.024 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.46 -36.26 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 118.555 0.616 . . . . 0.92000000000000004 111.125 175.476 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -64.76 -50.25 67.56 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.29 1.436 . . . . 2.5699999999999998 111.047 173.596 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -56.05 -29.95 61.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.99 0.916 . . . . 3.4199999999999999 112.301 178.147 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.5 mt -89.25 -18.2 27.51 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 114.763 1.394 . . . . 2.77 114.763 177.189 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.36 -22.18 66.87 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.382 0.992 . . . . 3.8500000000000001 112.665 169.999 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.9 -18.74 46.17 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.363 1.616 . . . . 2.6499999999999999 115.363 168.892 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -129.95 -19.1 3.29 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 116.179 1.918 . . . . 2.8399999999999999 116.179 -166.008 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -144.28 154.44 43.07 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.6 1.091 . . . . 4.8799999999999999 113.267 -155.037 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.7 t0 99.38 158.38 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 129.848 3.259 . . . . 8.3800000000000008 108.903 -176.404 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 74.1 -54.68 2.26 Favored Glycine 0 CA--C 1.533 1.186 0 O-C-N 120.561 -1.337 . . . . 3.5800000000000001 110.999 -160.417 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -105.32 142.82 34.42 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.429 1.492 . . . . 6.0899999999999999 110.541 158.311 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.6 mm -104.67 149.05 8.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 N-CA-C 107.769 -1.197 . . . . 2.46 107.769 163.229 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.4 t -125.41 145.55 50.01 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.28 1.032 . . . . 1.54 108.563 174.064 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -72.63 -51.72 18.4 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 122.418 1.104 . . . . 2.02 111.475 -170.51 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -42.66 -38.01 1.9 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 129.866 3.266 . . . . 3.2400000000000002 114.416 170.799 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -67.53 -37.82 83.32 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.658 0.984 . . . . 4.9299999999999997 113.658 -177.288 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -60.83 -47.92 84.15 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 120.54 1.518 . . . . 1.8 111.248 172.437 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -63.44 -39.59 94.89 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 119.102 -0.475 . . . . 0.54000000000000004 110.817 -179.509 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 95.2 m -57.22 -52.74 64.12 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.425 1.49 . . . . 1.95 110.296 171.15 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 27.8 mt -52.5 -44.33 65.61 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 118.247 -0.882 . . . . 0.83999999999999997 113.293 178.378 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 30.3 mm -55.49 -37.0 43.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 120.072 1.305 . . . . 0.58999999999999997 111.955 -175.585 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.09 -15.68 58.8 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.031 0.824 . . . . 0.59999999999999998 114.447 176.773 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.73 -16.2 77.88 Favored Glycine 0 CA--C 1.534 1.236 0 CA-C-N 118.699 1.25 . . . . 0.85999999999999999 113.682 172.006 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 mp -103.42 -53.31 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-N 118.638 1.219 . . . . 0.98999999999999999 109.368 167.669 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.1 m -73.92 61.75 0.81 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 128.002 2.521 . . . . 1.3799999999999999 109.326 171.25 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -139.14 -78.3 0.06 OUTLIER Glycine 0 CA--C 1.527 0.812 0 C-N-CA 125.87 1.7 . . . . 0.89000000000000001 110.017 174.066 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -58.8 -49.19 12.16 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.122 2.548 . . . . 0.98999999999999999 111.669 179.034 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -75.95 -10.98 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 114.105 1.15 . . . . 1.02 114.105 176.32 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.59 -38.12 74.01 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.213 -0.929 . . . . 1.1599999999999999 112.641 -176.155 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -59.94 -39.73 86.54 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 120.432 1.469 . . . . 2.6600000000000001 111.165 165.309 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.78 -38.13 74.92 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 124.301 1.041 . . . . 1.28 111.374 -178.667 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.5 mt -50.17 -57.77 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.623 1.101 . . . . 1.02 111.076 169.963 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 79.1 t60 -75.68 -5.15 44.17 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 114.148 1.166 . . . . 1.76 114.148 -176.852 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.265 1.9 pt-20 -107.52 -11.43 15.49 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 119.841 -1.787 . . . . 3.2000000000000002 114.014 167.461 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -83.63 -45.45 13.45 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.877 1.671 . . . . 2.5800000000000001 110.13 171.144 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -73.71 11.49 0.83 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 123.879 1.799 . . . . 2.8799999999999999 111.524 176.185 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -120.35 -70.81 0.77 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.862 2.065 . . . . 2.0099999999999998 110.411 165.878 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 50.13 7.65 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 130.316 3.446 . . . . 3.8700000000000001 115.566 -178.184 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 33.4 t -157.84 19.88 0.26 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.836 1.254 . . . . 6.7400000000000002 111.933 -164.624 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.1 p -83.08 0.9 42.9 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.469 1.907 . . . . 8.7799999999999994 115.992 -172.39 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 41.0 m . . . . . 0 N--CA 1.481 1.111 0 C-N-CA 122.916 0.486 . . . . 11.220000000000001 110.653 -142.783 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 12.2 m . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 106.248 -1.76 . . . . 7.7400000000000002 106.248 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -65.36 -100.33 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 117.937 -1.505 . . . . 6.2999999999999998 107.168 110.83 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 67.1 m -122.59 -84.68 0.66 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.513 1.925 . . . . 3.9300000000000002 109.413 159.84 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 124.08 165.79 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.366 1 C-N-CA 134.321 5.048 . . . . 2.54 108.806 -174.648 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.3 p -99.63 150.37 22.33 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.068 0.849 . . . . 1.0 109.477 162.343 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -69.57 -22.6 63.52 Favored 'General case' 0 C--O 1.212 -0.88 0 CA-C-O 117.545 -1.217 . . . . 2.96 112.643 178.232 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -53.79 53.38 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 121.954 2.161 . . . . 1.0 109.084 171.915 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -53.45 52.4 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 122.763 0.425 . . . . 2.5600000000000001 110.897 -177.367 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -65.35 -27.37 68.53 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 120.969 -1.082 . . . . 7.4000000000000004 113.858 177.045 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.754 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -66.19 -39.89 90.01 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.042 -1.661 . . . . 0.52000000000000002 113.156 165.217 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 34.8 t -57.54 -39.79 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 120.718 1.599 . . . . 0.63 110.126 169.354 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 2.9 mt -58.38 -54.05 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-O 118.332 -0.842 . . . . 1.25 112.254 169.041 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 20.4 t -56.47 -44.04 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 125.903 1.681 . . . . 0.68000000000000005 112.922 179.467 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.2 mp -64.46 -44.73 90.16 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.492 1.117 . . . . 1.0800000000000001 110.967 178.244 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 55.8 t -65.73 -40.97 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 118.692 -0.67 . . . . 0.69999999999999996 111.157 179.409 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.64 -42.76 84.07 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.773 0.715 . . . . 3.3799999999999999 111.608 168.292 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.35 -23.98 67.09 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.016 1.487 . . . . 2.1499999999999999 115.016 -175.344 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -79.36 -59.4 2.77 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.4 0.68 . . . . 2.1200000000000001 111.065 168.71 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -61.98 -31.71 72.1 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.563 0.949 . . . . 2.1200000000000001 113.563 -173.69 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -55.68 -21.25 17.33 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.318 1.447 . . . . 2.4700000000000002 114.159 176.708 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -89.06 -15.38 34.16 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.096 1.147 . . . . 2.5499999999999998 114.096 175.796 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 33.0 m -115.59 169.48 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-N 119.723 1.147 . . . . 2.6099999999999999 111.919 -178.12 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 16.3 m -85.58 131.39 34.37 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 121.353 -0.842 . . . . 3.8199999999999998 112.755 176.09 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 19.4 tptm 27.71 56.95 0.09 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.731 2.012 . . . . 5.96 115.272 147.579 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 66.51 7.77 5.3 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 127.589 2.356 . . . . 6.9800000000000004 113.781 171.155 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 58.7 m -89.93 49.26 1.69 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.141 -1.599 . . . . 4.71 114.043 -156.42 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 3.8 mt -61.97 23.38 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 130.525 3.53 . . . . 7.6600000000000001 117.41 -169.149 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 2.5 p -158.65 -36.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 C-N-CA 129.851 3.26 . . . . 4.4100000000000001 111.622 -177.568 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.83 -25.29 32.77 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 115.066 1.506 . . . . 8.4199999999999999 115.066 177.817 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -163.79 152.75 13.96 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.032 1.333 . . . . 6.7800000000000002 111.865 173.358 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 135' ' ' LYS . . . . . 0.417 ' HZ3' ' CG ' ' B' ' 174' ' ' ASP . 0.0 OUTLIER -163.87 161.48 23.08 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.551 1.315 . . . . 7.04 114.551 -164.13 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 30.8 pt -85.85 155.32 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.708 0.803 . . . . 2.98 109.468 159.191 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 47.0 m -92.85 163.63 13.64 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.939 -1.101 . . . . 2.6800000000000002 111.704 172.161 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -39.28 -41.05 0.84 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.691 1.996 . . . . 2.6499999999999999 115.338 178.393 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.1 m -57.92 -29.56 65.21 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.349 1.24 . . . . 1.99 114.349 179.154 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 36.8 m -79.58 -21.13 45.43 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.777 1.029 . . . . 1.3300000000000001 113.777 -173.866 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.434 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 56.0 t80 -64.7 -52.42 57.26 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.187 0.903 . . . . 1.8 110.829 174.517 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -65.87 -31.72 72.83 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 122.974 0.51 . . . . 2.4399999999999999 112.296 179.487 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -69.05 -51.22 41.18 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.888 0.875 . . . . 3.9700000000000002 110.409 174.163 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -51.8 -42.82 62.77 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.552 1.141 . . . . 1.1399999999999999 112.434 173.107 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 15.2 mt -60.12 -13.59 12.77 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.87 1.668 . . . . 1.0600000000000001 115.492 173.415 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.26 -2.85 15.56 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.367 1.439 . . . . 2.6499999999999999 114.061 170.488 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.52 -56.38 3.77 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.381 0.991 . . . . 3.1499999999999999 110.756 159.653 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -88.38 -43.41 11.52 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 122.011 -0.43 . . . . 2.6299999999999999 111.358 -166.578 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 tt -111.33 46.95 1.05 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.067 1.747 . . . . 2.0600000000000001 110.643 -169.795 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -93.7 -14.21 26.6 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 116.303 1.964 . . . . 1.3799999999999999 116.303 -170.872 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.57 -19.06 26.81 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 121.082 1.765 . . . . 1.46 112.311 -178.67 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.7 tpp -72.48 24.38 0.05 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 127.405 2.282 . . . . 1.6899999999999999 114.158 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 9.6 mp -110.51 128.42 55.62 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.681 2.392 . . . . 3.3300000000000001 110.761 -169.809 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 4.2 m -103.33 -21.58 13.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.665 1.186 . . . . 4.2800000000000002 112.327 171.737 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -173.66 167.94 4.45 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.126 2.971 . . . . 4.5700000000000003 107.978 -173.98 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -27.7 -49.64 0.05 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 128.491 2.716 . . . . 2.4700000000000002 112.546 156.265 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.59 -38.83 36.5 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 126.017 1.77 . . . . 1.6200000000000001 114.825 -177.63 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -62.1 -35.42 78.63 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.517 1.158 . . . . 3.8700000000000001 111.855 179.567 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 159' ' ' ARG . . . . . 0.42 ' HA ' HH11 ' B' ' 159' ' ' ARG . 0.0 OUTLIER -84.01 -36.43 23.14 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.623 1.169 . . . . 8.5700000000000003 112.544 172.37 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -61.06 -30.35 70.28 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.725 1.148 . . . . 3.3900000000000001 113.171 175.566 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -52.7 -44.07 66.07 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.193 0.997 . . . . 1.1000000000000001 112.816 167.577 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -65.01 -42.84 94.1 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.161 1.384 . . . . 0.67000000000000004 111.446 173.323 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -61.29 -35.95 78.73 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.582 0.956 . . . . 2.0499999999999998 113.582 178.314 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -51.95 -37.98 54.87 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.411 1.005 . . . . 3.3300000000000001 112.192 172.786 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 17.9 mt -72.03 -39.21 69.29 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 125.28 1.432 . . . . 0.68000000000000005 113.015 -178.14 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 30.7 mm -52.27 -34.68 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 125.101 1.361 . . . . 0.90000000000000002 111.98 175.825 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -61.94 -52.24 64.85 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.715 1.206 . . . . 2.71 111.617 173.953 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -63.2 -32.44 73.84 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.608 1.163 . . . . 3.5699999999999998 112.478 177.649 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.09 -26.0 64.71 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.661 1.984 . . . . 3.1899999999999999 111.947 172.43 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.06 -25.35 64.41 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.866 1.061 . . . . 3.6899999999999999 113.866 172.242 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.65 -24.1 39.22 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.076 1.139 . . . . 2.6099999999999999 114.076 174.23 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -121.92 -19.36 6.72 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 116.248 1.944 . . . . 2.7200000000000002 116.248 -167.138 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -138.49 158.41 44.31 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.08 1.309 . . . . 4.7699999999999996 114.147 -157.276 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 174' ' ' ASP . . . . . 0.417 ' CG ' ' HZ3' ' B' ' 135' ' ' LYS . 5.5 t0 98.35 157.9 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 129.698 3.199 . . . . 8.2699999999999996 108.633 -179.231 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.65 -58.23 2.1 Favored Glycine 0 CA--C 1.532 1.113 0 O-C-N 120.635 -1.291 . . . . 3.6099999999999999 110.716 -159.493 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 -101.06 139.14 37.16 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.639 1.176 . . . . 6.0999999999999996 110.662 157.886 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 42.0 mm -102.17 144.74 12.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 107.623 -1.251 . . . . 2.7000000000000002 107.623 164.599 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.1 t -117.53 144.07 45.46 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.321 -0.992 . . . . 1.5700000000000001 108.321 172.192 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -74.31 -52.84 11.05 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 122.891 1.329 . . . . 2.1099999999999999 111.163 -171.867 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -42.89 -35.34 1.17 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 129.979 3.312 . . . . 3.1899999999999999 114.927 168.056 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -67.31 -38.5 85.05 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.904 0.705 . . . . 4.6600000000000001 112.904 -178.968 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -58.81 -48.34 81.63 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.122 -1.612 . . . . 1.9099999999999999 111.168 172.202 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 27.7 t-105 -63.38 -41.29 98.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.85 0.46 . . . . 0.56999999999999995 110.898 -178.706 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 90.1 m -56.06 -52.44 64.27 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.391 1.477 . . . . 1.97 110.354 172.102 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.434 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 25.8 mt -56.6 -43.37 80.07 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 113.684 0.994 . . . . 0.70999999999999996 113.684 179.635 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 28.5 mm -53.33 -38.85 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-N 120.22 1.373 . . . . 0.57999999999999996 111.685 -178.254 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.61 -16.89 59.43 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.17 0.891 . . . . 0.56000000000000005 114.295 177.89 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.72 -13.88 80.71 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 118.682 1.241 . . . . 0.89000000000000001 113.713 172.685 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -102.57 -54.85 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-N 118.758 1.279 . . . . 0.98999999999999999 109.007 165.16 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 24.7 m -73.71 64.52 0.93 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 127.316 2.246 . . . . 1.54 108.935 171.582 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -143.64 -79.78 0.05 OUTLIER Glycine 0 CA--C 1.524 0.6 0 C-N-CA 125.601 1.572 . . . . 0.94999999999999996 109.892 177.396 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -60.33 -46.72 16.9 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.027 2.485 . . . . 1.1399999999999999 111.894 178.57 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.9 pt -77.42 -10.29 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 N-CA-C 114.023 1.12 . . . . 1.0 114.023 176.764 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 194' ' ' ALA . . . . . 0.405 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -68.45 -39.21 81.54 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 120.791 -1.193 . . . . 1.0700000000000001 113.022 -176.804 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -59.4 -46.15 89.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.911 -1.118 . . . . 2.79 111.289 167.291 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 9.3 tt -53.07 -41.81 65.24 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 124.013 0.925 . . . . 1.8 111.487 179.199 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 197' ' ' ILE . . . . . 0.405 HD12 ' HA ' ' B' ' 194' ' ' ALA . 88.9 mt -49.76 -59.39 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-N 119.521 1.055 . . . . 1.0700000000000001 111.544 171.2 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -70.94 -15.92 62.62 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.809 -1.182 . . . . 1.71 113.429 -178.361 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -78.97 -12.67 60.04 Favored 'General case' 0 CA--C 1.551 0.984 0 O-C-N 120.468 -1.395 . . . . 3.6899999999999999 112.187 167.534 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -111.72 -31.75 6.87 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.954 1.702 . . . . 3.6000000000000001 114.439 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -63.77 -6.65 6.02 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 121.241 1.837 . . . . 2.6200000000000001 111.922 164.37 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -108.12 -80.16 0.57 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.356 1.462 . . . . 2.0299999999999998 111.272 168.206 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 57.91 -10.53 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 130.783 3.633 . . . . 3.8399999999999999 115.433 -178.028 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 28.6 t -130.37 8.69 5.08 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.06 1.744 . . . . 6.5099999999999998 112.154 -173.238 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 32.7 p -76.25 -7.12 54.18 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.811 1.244 . . . . 8.5899999999999999 114.036 175.642 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 24.1 m . . . . . 0 N--CA 1.477 0.911 0 C-N-CA 123.364 0.666 . . . . 10.65 110.136 -146.5 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.572 0.225 . . . . 11.720000000000001 110.59 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -129.12 -9.6 4.79 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 122.125 0.965 . . . . 9.2300000000000004 113.587 -161.134 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.4 m 139.6 -47.01 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 1 C-N-CA 135.204 5.401 . . . . 3.6499999999999999 106.28 -162.721 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.83 12.48 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 127.848 2.459 . . . . 3.0299999999999998 117.13 -175.426 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.3 p 53.19 -172.4 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.33 2.652 . . . . 2.0600000000000001 111.21 -162.465 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -94.04 -40.63 9.98 Favored 'General case' 0 C--O 1.222 -0.388 0 O-C-N 120.902 -1.124 . . . . 2.77 110.865 158.044 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.12 -38.83 74.02 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.763 0.825 . . . . 0.93000000000000005 111.02 -171.087 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -69.53 -62.92 1.19 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 118.631 -0.7 . . . . 2.5299999999999998 111.105 -178.66 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -54.43 -29.76 50.38 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 120.429 1.468 . . . . 6.1399999999999997 113.743 172.495 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.83 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -70.36 -43.78 69.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 120.186 1.357 . . . . 0.52000000000000002 111.254 173.341 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.0 t -57.24 -42.61 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 121.008 1.731 . . . . 0.81000000000000005 110.429 168.089 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.7 mt -55.32 -46.87 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-N 119.712 1.142 . . . . 1.0900000000000001 111.55 171.344 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.0 t -64.41 -41.34 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 120.234 1.379 . . . . 0.63 112.57 178.541 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.7 mp -64.21 -35.84 82.13 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.384 0.673 . . . . 0.96999999999999997 111.308 175.01 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.1 t -73.66 -35.72 44.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.707 1.603 . . . . 0.90000000000000002 112.176 175.018 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -61.04 -58.02 10.17 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.309 1.044 . . . . 3.73 109.987 176.435 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -55.77 -14.96 2.62 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.17 1.544 . . . . 2.29 115.17 179.764 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -80.03 -66.07 0.92 Allowed 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.367 -1.458 . . . . 2.0899999999999999 111.613 162.592 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -62.41 -26.95 68.76 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.174 1.176 . . . . 2.54 114.174 -172.724 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.567 ' HE3' ' CE1' ' A' ' 22' ' ' TYR . 5.7 ttpp -50.47 -19.94 1.0 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.802 2.041 . . . . 5.1500000000000004 115.108 174.793 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.567 ' CE1' ' HE3' ' A' ' 21' ' ' LYS . 91.5 m-85 -103.7 -11.73 17.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.103 1.361 . . . . 2.77 114.103 177.15 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.4 m -91.54 -174.83 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 118.927 0.785 . . . . 3.0699999999999998 110.877 176.036 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.4 m -141.2 124.64 16.67 Favored 'General case' 0 C--O 1.238 0.476 0 O-C-N 120.501 -1.374 . . . . 4.8700000000000001 109.665 152.543 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.8 tptt 51.25 28.16 4.01 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.059 1.344 . . . . 7.4000000000000004 113.166 174.317 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 81.19 2.74 1.59 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 127.765 2.426 . . . . 8.4399999999999995 115.058 168.449 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.8 t -144.41 -41.05 0.26 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.436 1.273 . . . . 5.8799999999999999 114.436 -175.739 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -17.88 63.6 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.896 1.073 . . . . 10.859999999999999 113.896 -172.622 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.1 t 21.4 70.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 129.575 3.15 . . . . 8.2599999999999998 114.256 -173.232 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.1 mmmm -61.7 -37.87 85.75 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.311 -0.868 . . . . 11.140000000000001 113.333 -170.213 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -78.76 -32.83 46.79 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 118.74 -0.648 . . . . 10.74 111.403 -178.972 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 34.0 mttp 73.73 72.87 0.12 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.493 1.917 . . . . 9.1999999999999993 109.416 179.436 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.8 tt -75.93 66.92 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 123.207 1.48 . . . . 2.71 108.961 174.2 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -64.44 165.64 9.52 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 114.803 -1.089 . . . . 2.73 109.06 169.42 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.488 ' HB3' HG23 ' A' ' 63' ' ' ILE . 3.6 mppt? -45.37 -33.75 2.68 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.941 1.089 . . . . 2.5099999999999998 113.941 173.486 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 6.9 m -58.44 -33.76 70.07 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.893 1.442 . . . . 2.0299999999999998 114.893 174.707 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.0 m -85.62 -37.64 19.29 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.087 0.858 . . . . 1.3100000000000001 111.72 -177.859 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.487 ' CE2' HD11 ' A' ' 42' ' ' LEU . 79.7 t80 -58.57 -49.52 77.12 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.295 -0.878 . . . . 2.4399999999999999 111.818 179.177 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -59.78 -29.65 68.35 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.107 1.151 . . . . 3.1499999999999999 114.107 177.771 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -86.29 -51.1 6.46 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.746 1.618 . . . . 3.3900000000000001 110.312 -176.242 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 15.4 tmm? -51.25 -37.27 46.16 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.751 1.22 . . . . 1.5 112.439 170.411 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.487 HD11 ' CE2' ' A' ' 38' ' ' PHE . 16.8 mt -70.29 -4.44 22.0 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 116.282 1.956 . . . . 1.55 116.282 174.618 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -103.7 -4.29 23.92 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.489 1.495 . . . . 2.23 114.009 163.11 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -54.11 3.53 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.19 0.996 . . . . 1.8799999999999999 113.027 168.776 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -84.91 -22.45 29.28 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.199 1.555 . . . . 3.1400000000000001 115.199 -166.205 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.403 HD23 ' HG3' ' B' ' 112' ' ' GLU . 1.9 mt -126.73 50.55 1.93 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.889 2.076 . . . . 1.8899999999999999 108.504 -177.488 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -91.13 -23.14 20.37 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.519 1.303 . . . . 1.5900000000000001 114.519 -166.323 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.423 ' NE2' ' HA ' ' B' ' 108' ' ' TYR . 22.7 m-70 -90.91 -33.93 15.41 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.285 1.034 . . . . 1.45 112.464 -170.785 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.7 ptp -66.91 -4.51 9.61 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.343 1.457 . . . . 3.21 114.275 173.756 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.3 tp -76.11 117.57 17.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 125.961 1.704 . . . . 3.0099999999999998 111.837 -161.163 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.1 m -75.61 56.62 0.91 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.89 -1.131 . . . . 5.1399999999999997 111.348 161.19 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.565 ' CG ' ' H ' ' A' ' 53' ' ' THR . 33.4 t70 52.32 -150.52 0.32 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 127.806 2.443 . . . . 4.6600000000000001 113.913 175.467 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.565 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 52.7 p -54.82 -32.46 60.47 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 127.953 2.501 . . . . 2.5299999999999998 112.092 170.192 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.91 -50.89 52.9 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 124.431 1.015 . . . . 1.6699999999999999 111.583 174.949 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.23 -36.95 82.75 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 117.492 0.646 . . . . 3.5299999999999998 112.603 173.481 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.475 HH22 ' HB3' ' A' ' 42' ' ' LEU . 2.0 mmp_? -56.01 -34.15 65.54 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.417 -1.427 . . . . 5.5 113.089 -178.369 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -64.37 -22.25 66.89 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.858 1.429 . . . . 4.0300000000000002 114.858 173.165 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.83 -17.93 59.65 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.589 1.156 . . . . 1.1100000000000001 114.081 169.143 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -79.41 -51.04 9.91 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.257 0.935 . . . . 0.75 110.804 163.971 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -70.49 -23.31 62.65 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.757 1.021 . . . . 2.3199999999999998 113.757 -174.918 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -56.43 -30.06 62.37 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.524 1.511 . . . . 3.1800000000000002 112.464 167.091 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.475 ' HB3' HD22 ' A' ' 82' ' ' LEU . 15.7 mt -81.01 -32.65 34.12 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.663 0.785 . . . . 1.1299999999999999 112.109 -179.039 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.488 HG23 ' HB3' ' A' ' 35' ' ' LYS . 27.0 mm -60.36 -49.68 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.115 1.366 . . . . 1.02 111.489 174.858 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -64.05 -38.01 89.5 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.347 0.659 . . . . 2.2200000000000002 112.074 175.794 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -61.97 -30.95 71.27 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.95 0.9 . . . . 3.3300000000000001 112.876 175.221 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.7 mt -88.51 -19.4 26.47 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 114.847 1.425 . . . . 2.4900000000000002 114.847 169.992 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -20.26 64.13 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.884 1.674 . . . . 3.6400000000000001 112.122 170.481 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.37 -17.68 51.23 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.556 1.687 . . . . 2.1800000000000002 115.556 166.61 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -118.22 -21.83 7.99 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.673 1.578 . . . . 2.8799999999999999 114.476 -174.272 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.05 160.61 42.98 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.503 1.047 . . . . 4.3499999999999996 112.115 -162.674 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -98.27 -116.05 0.14 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.432 1.893 . . . . 6.1200000000000001 111.829 -175.108 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -90.24 -3.33 72.73 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 125.425 1.488 . . . . 4.6299999999999999 113.471 159.07 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.4 mmt-85 -84.48 165.44 18.1 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.314 1.557 . . . . 8.3599999999999994 112.304 164.538 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.3 pp -149.56 156.06 7.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 130.264 3.426 . . . . 3.46 107.787 174.109 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.4 t -97.77 175.32 6.21 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.588 1.155 . . . . 1.71 112.27 167.047 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -66.51 -54.61 21.97 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.366 1.066 . . . . 2.52 112.643 178.295 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.52 -30.42 70.62 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 126.232 1.813 . . . . 2.98 111.655 -175.936 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -64.3 -54.38 34.09 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 117.79 -1.1 . . . . 3.9399999999999999 111.014 175.415 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -50.9 -48.14 60.53 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 120.642 1.564 . . . . 2.4399999999999999 111.955 177.854 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.8 t-105 -60.94 -43.13 99.08 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 119.292 -0.385 . . . . 0.68999999999999995 111.54 179.659 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 87.2 m -60.87 -39.5 89.4 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.398 1.479 . . . . 1.8200000000000001 111.966 173.17 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.475 HD22 ' HB3' ' A' ' 62' ' ' LEU . 94.1 mt -60.68 -55.39 33.81 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-O 118.121 -0.942 . . . . 0.82999999999999996 110.35 177.013 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.4 mm -47.52 -42.36 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 CA-C-N 119.583 1.083 . . . . 0.82999999999999996 112.919 -176.82 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.15 -30.06 69.77 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-O 118.943 -0.92 . . . . 0.71999999999999997 113.292 177.479 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.14 -21.64 64.81 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 118.259 -1.301 . . . . 0.57999999999999996 115.423 -177.366 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.0 mp -86.14 -39.67 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 CA-C-N 119.231 1.515 . . . . 1.3200000000000001 110.587 168.537 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 33.8 m -69.73 -39.91 76.53 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.979 1.711 . . . . 3.2599999999999998 111.549 -174.671 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -27.49 -67.02 0.07 OUTLIER Glycine 0 CA--C 1.535 1.332 0 C-N-CA 128.241 2.829 . . . . 1.0900000000000001 116.391 -175.396 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.8 -33.56 2.18 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.147 2.565 . . . . 0.96999999999999997 113.41 -173.626 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.4 pt -82.72 -20.97 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 118.981 0.81 . . . . 1.3999999999999999 113.177 -175.987 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -52.68 -50.29 63.58 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.072 2.149 . . . . 0.93999999999999995 113.107 -178.175 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.407 ' HE3' ' CD2' ' B' ' 129' ' ' TYR . 49.9 mtpt -48.11 -53.7 15.73 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.744 0.783 . . . . 3.6000000000000001 110.981 172.888 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.95 -38.35 76.1 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 118.211 -0.9 . . . . 2.1000000000000001 111.549 -172.925 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 25.7 mt -47.6 -62.87 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.458 1.103 . . . . 1.9099999999999999 111.4 165.996 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -59.8 -42.37 93.28 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.959 0.8 . . . . 1.8600000000000001 111.245 -177.164 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.394 3.3 pt-20 -77.32 -9.01 58.57 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 121.226 -0.921 . . . . 2.8700000000000001 112.534 -178.505 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -88.17 -26.59 22.34 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 116.589 2.07 . . . . 2.3399999999999999 116.589 165.096 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -68.74 0.25 4.51 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 120.62 1.554 . . . . 2.9399999999999999 111.576 169.866 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -129.01 -64.11 0.93 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.682 2.393 . . . . 3.2599999999999998 110.84 -176.213 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . 0.263 2.5 pt20 55.32 21.42 4.14 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 128.5 2.72 . . . . 4.4699999999999998 115.529 173.037 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.1 m -152.54 37.32 0.52 Allowed 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.361 -1.462 . . . . 6.6200000000000001 111.496 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.5 t -112.95 15.62 19.64 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.481 1.112 . . . . 8.8200000000000003 112.872 176.771 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 75.0 m . . . . . 0 C--O 1.246 0.878 0 C-N-CA 129.815 3.246 . . . . 10.26 109.151 -177.3 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 9.2 m . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 110.158 -0.312 . . . . 11.99 110.158 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -129.01 -11.0 4.79 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 113.971 1.1 . . . . 8.9800000000000004 113.971 -157.958 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 63.5 m 116.94 -27.92 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.903 1 C-N-CA 133.339 4.655 . . . . 3.6699999999999999 108.126 -156.777 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.423 ' HA ' ' NE2' ' A' ' 48' ' ' HIS . 0.3 OUTLIER -70.82 19.91 0.05 OUTLIER 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 128.085 2.554 . . . . 3.04 115.446 179.538 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 14.2 p 47.41 -161.0 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 127.974 2.509 . . . . 2.3900000000000001 111.081 -153.93 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -102.28 -33.99 9.39 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 120.082 1.31 . . . . 2.6200000000000001 111.487 149.071 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.11 -42.17 72.61 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.337 0.655 . . . . 0.87 109.763 -169.727 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 112' ' ' GLU . . . . . 0.403 ' HG3' HD23 ' A' ' 46' ' ' LEU . 17.1 tt0 -64.43 -64.11 0.96 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.499 -1.238 . . . . 2.5499999999999998 111.485 176.464 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -51.84 -31.79 29.18 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 121.762 2.074 . . . . 6.75 114.095 177.155 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.83 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -74.55 -41.34 60.75 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.789 1.177 . . . . 0.71999999999999997 112.501 174.983 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 39.5 t -60.0 -42.91 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-N 120.55 1.523 . . . . 1.0700000000000001 110.107 166.71 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 6.3 mt -54.36 -48.79 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-O 117.812 -1.089 . . . . 1.28 109.919 171.061 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.6 t -60.59 -43.06 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 120.643 1.565 . . . . 0.81000000000000005 112.859 177.677 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 3.6 mp -60.44 -41.99 95.19 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.958 0.799 . . . . 1.1599999999999999 111.997 173.939 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 40.2 t -69.39 -41.23 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 125.477 1.511 . . . . 1.1100000000000001 111.985 177.659 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.91 -57.07 14.18 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 124.401 1.081 . . . . 4.1100000000000003 108.326 179.235 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -52.43 -24.75 8.41 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.461 1.282 . . . . 2.29 114.461 -178.775 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -74.08 -62.96 1.33 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.453 1.024 . . . . 2.25 112.079 168.672 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -62.49 -25.77 68.18 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.298 0.851 . . . . 2.6200000000000001 113.298 -176.294 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -43.56 -30.27 0.57 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.345 2.658 . . . . 3.0099999999999998 115.338 172.062 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -96.21 -13.3 23.58 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.999 1.111 . . . . 2.6699999999999999 113.999 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' B' ' 132' ' ' VAL 0.256 4.4 m -87.38 -161.74 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 121.893 0.854 . . . . 3.0299999999999998 111.898 -174.179 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 3.3 m -156.4 124.42 5.63 Favored 'General case' 0 C--O 1.238 0.489 0 O-C-N 120.341 -1.474 . . . . 4.9500000000000002 108.963 154.105 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 36.2 tptt 44.39 31.59 0.61 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.341 1.856 . . . . 7.6200000000000001 113.566 -179.483 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 129' ' ' TYR . . . . . 0.407 ' CD2' ' HE3' ' A' ' 92' ' ' LYS . 16.0 m-85 75.87 6.66 3.8 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.101 2.16 . . . . 8.4600000000000009 114.453 171.085 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 11.6 t -143.7 -41.95 0.28 Allowed 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 115.007 1.484 . . . . 5.9400000000000004 115.007 -177.246 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.09 -30.01 67.12 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.246 -0.909 . . . . 11.02 112.456 -173.738 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 132' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' B' ' 126' ' ' VAL . 9.0 t 42.22 69.77 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 127.377 2.271 . . . . 8.3699999999999992 112.788 -179.412 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 6.8 mmmm -61.18 -36.98 81.3 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.584 0.957 . . . . 11.17 113.584 -169.597 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -26.01 40.55 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.805 0.73 . . . . 10.94 111.688 179.539 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 32.6 mttp 70.58 63.95 0.19 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.202 1.801 . . . . 9.2799999999999994 109.655 176.373 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 4.4 tt -72.99 66.49 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.173 1.389 . . . . 2.5299999999999998 110.12 179.52 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 10.5 m -61.79 160.63 11.55 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.188 -0.914 . . . . 2.8100000000000001 109.406 165.192 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 138' ' ' LYS . . . . . 0.548 ' HB3' HG23 ' B' ' 166' ' ' ILE . 2.4 mppt? -43.71 -31.83 0.88 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 115.461 1.652 . . . . 2.48 115.461 177.103 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.7 m -55.07 -34.88 63.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.628 1.571 . . . . 1.9399999999999999 115.067 173.836 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.5 m -78.55 -41.54 31.8 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.726 1.148 . . . . 1.3100000000000001 111.947 -179.936 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.489 ' CE2' HD11 ' B' ' 145' ' ' LEU . 79.9 t80 -57.74 -45.84 85.28 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 120.997 -1.064 . . . . 2.21 112.401 -177.191 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -63.24 -27.84 69.63 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.929 1.085 . . . . 3.3700000000000001 113.929 177.675 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -87.19 -49.67 7.13 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 124.445 1.098 . . . . 3.3799999999999999 109.629 -177.681 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 14.4 tmm? -50.21 -37.65 36.38 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.741 2.017 . . . . 1.3799999999999999 113.127 171.63 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 145' ' ' LEU . . . . . 0.489 HD11 ' CE2' ' B' ' 141' ' ' PHE . 17.5 mt -68.7 -0.6 5.48 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 116.799 2.148 . . . . 1.72 116.799 174.037 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -114.94 11.2 16.5 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.087 1.143 . . . . 2.0499999999999998 114.087 161.221 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.44 -56.8 2.21 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.816 1.246 . . . . 1.8400000000000001 112.993 166.806 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -75.97 -27.21 57.42 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.009 -1.057 . . . . 2.6299999999999999 113.704 -173.014 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 2.2 mt -128.3 56.1 1.64 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 127.023 2.129 . . . . 1.8500000000000001 107.929 -172.307 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -102.58 -15.76 16.29 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.481 1.512 . . . . 1.3300000000000001 115.022 -166.398 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -94.96 -34.9 12.2 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 120.96 -1.087 . . . . 1.3999999999999999 110.957 179.394 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 9.6 ptp -68.0 -3.06 8.85 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.533 0.938 . . . . 3.1299999999999999 113.533 166.129 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 28.5 tp -71.72 105.5 3.75 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.124 -0.985 . . . . 2.8500000000000001 111.049 -170.116 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 5.4 m -79.78 54.25 1.8 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.157 0.98 . . . . 4.75 111.323 169.556 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 155' ' ' ASP . . . . . 0.583 ' CG ' ' H ' ' B' ' 156' ' ' THR . 27.4 t70 53.23 -153.75 0.25 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 128.551 2.74 . . . . 4.7800000000000002 115.018 171.786 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 156' ' ' THR . . . . . 0.583 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 41.4 p -54.9 -36.36 65.09 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 128.671 2.789 . . . . 2.8300000000000001 112.176 175.61 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.8 -46.73 89.65 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 123.811 0.719 . . . . 1.8500000000000001 111.604 175.75 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -72.26 -34.36 68.18 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.042 0.937 . . . . 3.4399999999999999 113.188 174.059 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 159' ' ' ARG . . . . . 0.458 HH22 ' HB3' ' B' ' 145' ' ' LEU . 2.1 mmp_? -58.49 -35.02 71.57 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.252 -1.53 . . . . 5.54 112.596 177.182 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -63.34 -25.65 68.4 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.23 1.567 . . . . 4.2699999999999996 115.23 171.5 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -76.37 -18.38 58.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.134 1.161 . . . . 1.05 114.134 170.787 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.33 -52.75 7.7 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.179 0.9 . . . . 0.83999999999999997 110.708 163.043 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -68.39 -25.05 64.86 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.335 0.865 . . . . 2.0899999999999999 113.335 -174.091 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -57.87 -30.39 65.78 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.327 -1.483 . . . . 2.9300000000000002 112.615 168.747 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 165' ' ' LEU . . . . . 0.453 ' HB3' HD22 ' B' ' 185' ' ' LEU . 15.9 mt -80.79 -29.87 36.03 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.314 0.646 . . . . 1.1000000000000001 112.104 -177.879 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 166' ' ' ILE . . . . . 0.548 HG23 ' HB3' ' B' ' 138' ' ' LYS . 36.2 mm -61.13 -51.06 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.172 1.389 . . . . 1.0 111.049 174.77 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -66.01 -35.81 81.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.76 0.824 . . . . 2.1600000000000001 112.604 176.348 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -62.4 -35.91 80.67 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.81 0.844 . . . . 3.2400000000000002 112.03 173.763 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.6 tp -86.71 -21.39 26.65 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.593 0.96 . . . . 3.1699999999999999 113.593 178.211 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -63.05 -23.65 67.55 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.894 0.877 . . . . 3.6699999999999999 112.376 173.458 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.13 -11.24 60.75 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.761 1.393 . . . . 2.3300000000000001 114.761 169.623 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -125.46 -23.39 4.11 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.274 1.213 . . . . 2.8599999999999999 114.274 -172.417 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.26 158.16 43.5 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.433 -0.792 . . . . 4.2000000000000002 112.743 -160.229 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -103.19 -118.13 0.2 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 127.392 2.277 . . . . 6.0199999999999996 111.737 -172.392 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -87.41 -4.88 80.03 Favored Glycine 0 CA--C 1.534 1.279 0 CA-C-O 118.265 -1.297 . . . . 4.5599999999999996 113.703 159.869 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.6 mmt-85 -83.17 164.82 19.95 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 119.783 1.791 . . . . 8.4700000000000006 112.282 162.62 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 1.6 pp -146.67 153.89 12.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 129.628 3.171 . . . . 3.7200000000000002 107.099 173.02 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 8.4 t -97.98 176.51 5.75 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.974 0.909 . . . . 1.6200000000000001 111.43 166.246 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -74.35 -52.29 12.63 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.428 0.899 . . . . 2.4100000000000001 113.428 -176.39 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -58.6 -29.28 66.33 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.453 1.901 . . . . 3.1699999999999999 111.548 -179.485 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -64.5 -55.93 17.42 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-O 118.027 -0.987 . . . . 4.0 110.811 175.345 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -50.24 -49.01 54.29 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.422 1.464 . . . . 2.4100000000000001 112.497 178.949 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -62.52 -40.66 97.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.926 0.49 . . . . 0.68999999999999995 111.708 179.958 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 97.9 m -64.09 -37.6 88.03 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.434 1.494 . . . . 1.8999999999999999 111.706 173.298 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 185' ' ' LEU . . . . . 0.453 HD22 ' HB3' ' B' ' 165' ' ' LEU . 87.5 mt -60.13 -51.22 70.52 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.21 0.914 . . . . 0.77000000000000002 110.523 175.624 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 47.4 mm -46.3 -42.26 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-N 119.631 1.105 . . . . 0.68999999999999995 113.078 -177.589 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.14 -31.65 79.65 Favored Glycine 0 CA--C 1.533 1.212 0 CA-C-O 119.193 -0.781 . . . . 0.81999999999999995 113.467 178.732 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.38 -24.75 69.93 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-N 118.826 1.313 . . . . 0.68999999999999995 114.528 -177.011 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -87.8 -37.51 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 CA-C-N 118.682 1.241 . . . . 1.48 111.471 169.03 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 22.8 m -80.81 -40.0 25.7 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.482 1.113 . . . . 3.3100000000000001 112.612 -169.325 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -45.08 -48.18 9.92 Favored Glycine 0 CA--C 1.538 1.526 0 CA-C-O 117.416 -1.769 . . . . 0.93999999999999995 116.249 -172.926 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.52 -32.88 7.4 Favored 'Trans proline' 0 C--N 1.353 0.809 0 CA-C-N 121.05 2.425 . . . . 1.0900000000000001 113.05 -179.738 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 41.2 pt -85.14 -20.44 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 113.218 0.822 . . . . 1.25 113.218 179.979 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -51.89 -45.78 64.29 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 127.399 2.28 . . . . 0.87 111.967 -178.033 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -55.27 -49.18 72.73 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.11 0.564 . . . . 3.7599999999999998 111.222 175.399 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.09 -35.49 61.78 Favored 'General case' 0 C--O 1.222 -0.373 0 O-C-N 121.228 -0.92 . . . . 2.1000000000000001 111.675 -175.469 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 27.2 mt -48.75 -62.43 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.82 1.248 . . . . 1.75 110.421 166.457 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -60.25 -45.04 94.63 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.931 -0.481 . . . . 1.8999999999999999 111.041 -176.242 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.383 3.1 pt-20 -78.39 -8.06 58.04 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.406 0.521 . . . . 2.7799999999999998 112.406 -174.401 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -78.88 -27.8 44.04 Favored 'General case' 0 C--N 1.346 0.452 0 C-N-CA 126.551 1.941 . . . . 2.3300000000000001 115.324 162.905 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -74.19 5.52 4.36 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 121.055 1.752 . . . . 2.4300000000000002 111.159 172.57 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -127.94 -67.85 0.8 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.435 2.294 . . . . 2.4399999999999999 110.144 -176.991 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 56.2 12.01 0.89 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 129.806 3.242 . . . . 4.4199999999999999 115.803 167.441 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 72.1 m -155.95 33.12 0.35 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.566 1.146 . . . . 6.4800000000000004 111.838 -176.377 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 33.3 t -104.89 8.15 34.58 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.926 -1.109 . . . . 8.7899999999999991 112.96 169.108 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 34.8 m . . . . . 0 C--O 1.248 0.976 0 C-N-CA 127.685 2.394 . . . . 9.9000000000000004 108.963 -179.843 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 112.246 0.462 . . . . 10.119999999999999 112.246 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -88.09 -120.69 0.05 OUTLIER 'General case' 0 CA--C 1.559 1.327 0 O-C-N 124.896 1.373 . . . . 7.2000000000000002 109.137 140.968 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 94.5 m -95.75 33.19 1.7 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.481 2.313 . . . . 3.98 114.23 -167.233 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -57.74 130.36 46.09 Favored 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 126.163 1.785 . . . . 2.4300000000000002 113.45 -161.86 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.4 p -70.81 159.37 34.7 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 125.275 1.43 . . . . 1.2 111.928 -174.692 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -61.76 -39.5 91.82 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 120.469 1.486 . . . . 2.3700000000000001 112.904 -178.425 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.19 -47.25 81.73 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.671 0.748 . . . . 0.77000000000000002 110.469 175.082 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.66 -52.4 31.6 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.835 0.854 . . . . 2.8999999999999999 111.726 -177.044 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -56.73 -32.09 65.19 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 119.842 -1.786 . . . . 5.0300000000000002 113.765 169.731 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.868 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.63 -39.88 91.96 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 120.745 -1.222 . . . . 0.5 111.634 172.693 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 95.4 t -59.0 -33.67 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-N 119.401 1.001 . . . . 0.64000000000000001 111.074 166.063 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.7 mt -58.54 -59.08 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 CA-C-N 120.469 1.486 . . . . 0.93999999999999995 111.558 164.139 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 23.1 t -55.02 -38.6 46.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.149 1.38 . . . . 0.64000000000000001 112.926 -176.945 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -65.7 -27.61 68.46 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.465 -1.397 . . . . 0.92000000000000004 112.563 174.36 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.0 t -94.87 -19.72 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.137 1.375 . . . . 1.03 111.343 -179.552 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -59.8 -54.24 48.52 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 120.342 1.428 . . . . 4.0099999999999998 110.083 153.573 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.434 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 25.8 t30 -54.18 -34.29 60.15 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 118.921 0.782 . . . . 2.2400000000000002 112.948 -178.344 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -80.32 -48.51 12.88 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.243 0.831 . . . . 2.1899999999999999 113.243 174.144 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -73.5 -22.29 60.18 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 114.23 1.196 . . . . 2.6200000000000001 114.23 -173.039 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.434 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 9.3 ptmt -48.86 -34.98 13.64 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 120.872 1.669 . . . . 2.77 113.064 176.134 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -74.4 -40.27 62.14 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 114.03 1.122 . . . . 2.52 114.03 178.529 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.454 ' HB ' ' H ' ' A' ' 28' ' ' LEU . 16.6 m -79.98 -16.4 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 118.921 0.782 . . . . 3.0299999999999998 112.244 177.025 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.3 m 68.69 -59.61 0.46 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 128.973 2.909 . . . . 5.5999999999999996 111.995 -173.211 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 tmtm? -178.73 -38.78 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 127.486 2.314 . . . . 6.0 112.149 -169.136 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -118.01 -23.95 7.24 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.911 1.819 . . . . 7.46 115.911 -171.516 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.8 m -67.0 -37.73 84.73 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.109 1.322 . . . . 6.6900000000000004 113.438 -170.435 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.454 ' H ' ' HB ' ' A' ' 23' ' ' VAL . 90.2 mt 48.45 -79.97 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 129.216 3.006 . . . . 6.9900000000000002 113.778 172.608 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -140.5 -19.6 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 126.775 2.03 . . . . 3.6899999999999999 113.359 175.706 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.417 ' O ' ' HE2' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -57.05 -33.82 67.63 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.9 -1.125 . . . . 8.6799999999999997 112.896 166.456 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -132.26 68.7 1.49 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 122.605 1.193 . . . . 7.0199999999999996 111.594 166.739 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.16 159.94 32.03 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 126.516 1.926 . . . . 6.5199999999999996 113.849 176.067 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.7 pt -71.71 -173.21 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 127.16 2.184 . . . . 2.1299999999999999 115.123 -174.722 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 97.6 p -101.02 140.75 34.89 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 120.692 -1.255 . . . . 3.5299999999999998 108.375 152.879 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.413 ' HE2' HD12 ' A' ' 66' ' ' LEU . 14.8 mttt -71.44 -18.95 62.29 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.19 -0.944 . . . . 2.75 112.582 -171.846 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.9 m -48.43 -30.34 4.97 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.264 1.026 . . . . 2.29 113.621 159.323 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 t -65.28 -35.16 80.17 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 117.477 -1.249 . . . . 2.6000000000000001 111.761 176.443 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -59.3 -48.89 79.94 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 120.929 1.695 . . . . 1.8 111.844 174.881 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.0 ptt85 -62.97 -29.74 71.04 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.346 0.976 . . . . 4.3899999999999997 111.463 176.606 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -83.96 -39.84 19.25 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 114.008 1.114 . . . . 3.1099999999999999 114.008 -175.874 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.7 tmm? -51.67 -47.8 63.68 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 126.331 1.853 . . . . 1.7 110.67 162.379 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -55.47 -50.82 68.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.487 0.585 . . . . 1.05 112.393 169.227 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -79.14 -9.17 59.48 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 115.758 1.762 . . . . 3.0299999999999998 115.758 -175.786 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -98.16 -51.68 3.93 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.256 1.423 . . . . 1.4399999999999999 114.078 167.724 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -89.67 -43.21 10.89 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.093 0.957 . . . . 2.8999999999999999 111.966 -168.9 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.58 38.55 2.13 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.049 1.34 . . . . 1.8999999999999999 110.742 -168.526 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -96.55 -17.78 20.24 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 116.085 1.883 . . . . 2.3599999999999999 116.085 -149.257 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 -92.17 -38.9 11.87 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.446 1.498 . . . . 1.9399999999999999 113.142 -162.939 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 68.4 mtm -77.0 -18.9 57.89 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.021 -1.049 . . . . 2.75 113.367 170.479 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.1 tt -56.52 -31.24 63.93 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.128 0.971 . . . . 5.7999999999999998 112.68 -155.401 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.1 m 83.5 109.66 0.06 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.349 2.26 . . . . 5.1500000000000004 111.494 169.477 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 t70 66.42 -163.14 0.24 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.904 1.682 . . . . 4.4400000000000004 113.669 168.169 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.4 m -87.14 -31.56 20.34 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.274 1.429 . . . . 2.2400000000000002 109.913 157.03 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.2 -42.21 72.22 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.793 1.187 . . . . 1.98 114.154 -174.773 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -76.38 -20.62 56.98 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.902 1.351 . . . . 4.7300000000000004 112.955 177.983 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.6 mtt85 -69.72 -37.92 76.72 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.0 -1.688 . . . . 7.0599999999999996 112.43 164.279 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 mmmt -59.07 -40.35 84.94 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.417 1.008 . . . . 4.2699999999999996 111.373 170.411 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.48 ' HA ' ' HE3' ' A' ' 61' ' ' LYS . . . -59.14 -40.44 85.48 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 117.833 -1.08 . . . . 1.6699999999999999 113.739 173.143 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.412 ' HB2' HG12 ' A' ' 86' ' ' ILE . . . -58.04 -46.88 84.64 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.663 1.185 . . . . 1.01 112.368 167.32 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -62.79 -34.06 76.49 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.036 0.934 . . . . 2.4300000000000002 112.891 -175.681 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.48 ' HE3' ' HA ' ' A' ' 58' ' ' ALA . 8.0 mtmp? -47.69 -44.0 27.1 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 122.979 1.371 . . . . 2.9900000000000002 113.102 169.488 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.1 mt -69.36 -43.05 74.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 113.615 -1.629 . . . . 1.01 110.491 -174.708 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.1 mm -53.8 -54.57 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.669 1.588 . . . . 1.27 110.56 178.806 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -64.13 -37.75 88.58 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 123.699 0.799 . . . . 2.8300000000000001 112.377 -178.001 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -44.34 82.46 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 121.512 0.672 . . . . 3.77 112.232 168.355 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.413 HD12 ' HE2' ' A' ' 35' ' ' LYS . 0.2 OUTLIER -72.21 -34.06 68.08 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.012 0.925 . . . . 2.3900000000000001 110.922 -174.429 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -77.78 -30.92 51.64 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.829 1.048 . . . . 3.5699999999999998 113.829 171.26 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.27 -31.63 58.38 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.852 1.056 . . . . 2.8500000000000001 113.852 176.833 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.51 57.94 1.19 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.484 1.113 . . . . 4.3099999999999996 113.084 -173.49 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.77 5.05 0.06 Allowed 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 116.594 2.072 . . . . 4.4100000000000001 116.594 167.301 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.0 t70 59.65 -150.36 0.43 Allowed 'General case' 0 CA--C 1.557 1.216 0 CA-C-N 120.004 1.274 . . . . 4.0 110.102 -175.959 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -93.91 11.63 70.6 Favored Glycine 0 CA--C 1.533 1.183 0 O-C-N 119.962 -1.711 . . . . 2.48 112.603 158.231 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.2 mmt-85 -80.28 70.71 6.98 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.524 1.662 . . . . 4.6200000000000001 111.452 -176.931 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.8 mt -63.33 139.47 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 124.766 1.226 . . . . 2.1699999999999999 109.814 174.614 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.5 m -117.23 158.74 23.79 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.321 1.048 . . . . 1.6399999999999999 109.817 168.351 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -46.23 -47.73 17.91 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 123.151 1.453 . . . . 1.8400000000000001 112.247 172.689 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.21 -16.99 63.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 129.4 3.08 . . . . 3.1499999999999999 112.74 -175.303 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -58.47 -59.27 5.63 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.466 1.106 . . . . 4.2800000000000002 110.812 175.335 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -55.33 -47.67 75.32 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.567 -0.708 . . . . 1.9199999999999999 111.152 -178.473 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -62.56 -47.01 85.72 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.485 0.55 . . . . 0.55000000000000004 112.485 -178.365 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.3 t -69.78 -39.61 76.55 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.503 0.721 . . . . 1.5600000000000001 111.758 -179.538 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 44.2 mt -58.1 -46.13 86.05 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 118.001 -0.999 . . . . 0.82999999999999996 111.85 175.442 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 20.9 mm -50.56 -37.26 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 CA-C-N 119.549 1.068 . . . . 0.94999999999999996 112.775 -178.007 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.01 -20.07 47.74 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 119.686 1.13 . . . . 0.93999999999999995 114.189 176.258 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.99 0.78 82.12 Favored Glycine 0 CA--C 1.532 1.124 0 O-C-N 120.743 -1.445 . . . . 0.96999999999999997 114.48 175.32 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.412 HG12 ' HB2' ' A' ' 59' ' ' ALA . 0.7 OUTLIER -134.72 -45.44 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 126.193 1.797 . . . . 1.0 110.668 174.752 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 95.5 m -76.18 71.3 2.9 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.677 1.991 . . . . 1.45 107.131 163.024 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -149.77 -77.98 0.02 OUTLIER Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.212 1.387 . . . . 0.95999999999999996 111.077 -179.711 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -62.23 -34.14 79.21 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 123.227 2.618 . . . . 1.46 113.617 -176.634 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -82.95 0.06 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 114.549 1.314 . . . . 1.3700000000000001 114.549 179.839 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -35.88 -61.06 0.5 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.329 2.651 . . . . 2.3399999999999999 115.756 -176.158 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.51 -40.33 65.33 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.024 -1.047 . . . . 4.4299999999999997 111.719 176.296 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.3 tt -66.73 -42.29 86.52 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.432 0.693 . . . . 2.1400000000000001 109.898 -176.704 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.7 mt -51.29 -54.5 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.0 0.92 . . . . 2.8199999999999998 110.2 169.788 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -41.08 96.21 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.614 -0.679 . . . . 2.9900000000000002 112.733 -179.606 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -93.63 0.66 56.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.951 0.901 . . . . 3.2000000000000002 112.666 -169.051 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -29.82 70.3 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 125.821 1.649 . . . . 5.7199999999999998 112.501 163.856 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.475 ' CD ' HG21 ' B' ' 116' ' ' ILE . 3.2 mm-40 -74.09 8.09 2.3 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.415 1.086 . . . . 3.8399999999999999 111.957 171.529 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.58 -61.16 1.55 Allowed 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.947 1.299 . . . . 4.21 109.644 174.754 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.57 11.36 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 131.417 3.887 . . . . 8.1600000000000001 116.873 170.886 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.9 t -163.76 25.61 0.08 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.417 1.487 . . . . 6.0199999999999996 110.687 -167.948 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.6 t -113.97 18.14 17.44 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.469 1.108 . . . . 7.5 113.673 -177.271 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.253 1.258 1 C-N-CA 132.316 4.246 . . . . 9.7699999999999996 108.426 -177.494 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 45.3 m . . . . . 0 N--CA 1.471 0.575 0 N-CA-C 108.759 -0.83 . . . . 7.79 108.759 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -64.26 -119.91 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 108.226 -1.027 . . . . 6.8799999999999999 108.226 133.105 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 34.7 t -94.64 -99.37 0.15 Allowed 'General case' 0 CA--C 1.543 0.697 0 O-C-N 120.794 -1.191 . . . . 4.5999999999999996 111.241 165.831 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 63.47 97.97 0.04 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 127.604 2.362 . . . . 2.4199999999999999 110.28 -155.524 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 20.8 p -71.11 163.38 27.72 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.468 1.507 . . . . 1.24 111.458 -173.892 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.51 -34.73 78.95 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 117.875 -1.059 . . . . 2.98 112.621 178.857 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.09 -50.2 64.89 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.971 1.26 . . . . 0.90000000000000002 109.119 172.621 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -67.51 -54.02 23.63 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.158 0.799 . . . . 2.54 113.158 -176.194 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -57.42 -30.55 65.07 Favored 'General case' 0 C--O 1.225 -0.187 0 O-C-N 120.759 -1.213 . . . . 4.4400000000000004 113.215 172.313 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 114' ' ' ALA . . . . . 0.868 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.36 -43.09 78.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 118.211 -0.899 . . . . 0.56999999999999995 112.326 169.134 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 77.2 t -54.95 -36.12 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 120.353 1.433 . . . . 0.68999999999999995 110.452 167.267 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 116' ' ' ILE . . . . . 0.475 HG21 ' CD ' ' A' ' 98' ' ' GLU 0.265 34.7 mt -60.9 -60.27 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 117.085 -1.436 . . . . 0.98999999999999999 112.129 166.972 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 21.9 t -51.74 -38.56 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 121.124 1.784 . . . . 0.57999999999999996 112.576 -179.685 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 9.8 mp -63.62 -36.74 84.8 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.096 -1.002 . . . . 0.93999999999999995 111.895 173.424 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 72.3 t -90.22 -29.55 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 117.4 -1.286 . . . . 1.0 112.456 -177.708 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 120' ' ' GLU . . . . . 0.418 ' CD ' ' HZ2' ' B' ' 124' ' ' LYS . 9.3 tm-20 -53.01 -50.44 64.21 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 121.359 1.89 . . . . 3.29 108.724 157.684 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 121' ' ' ASN . . . . . 0.511 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 26.9 t30 -65.22 -25.16 67.57 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.837 1.051 . . . . 2.1600000000000001 113.837 -173.447 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -77.48 -50.13 13.29 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 120.963 -1.086 . . . . 2.4500000000000002 112.242 165.369 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -64.87 -27.13 68.66 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 117.134 -1.413 . . . . 2.6200000000000001 113.788 -170.148 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 124' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 2.6 ptmt -52.63 -32.83 43.8 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 121.841 2.11 . . . . 2.0099999999999998 112.911 174.792 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -73.32 -23.87 60.31 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.43 1.27 . . . . 2.4199999999999999 114.43 179.252 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 126' ' ' VAL . . . . . 0.454 ' HB ' ' H ' ' B' ' 131' ' ' LEU . 31.3 m -100.7 -14.94 7.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 CA-C-N 119.067 0.849 . . . . 2.7400000000000002 112.99 170.46 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 6.6 m 68.84 -53.36 0.57 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 129.759 3.224 . . . . 4.79 112.846 -172.883 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 1.7 mmtm 163.39 -33.1 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 129.056 2.943 . . . . 6.1299999999999999 111.959 -160.526 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -130.78 -21.0 2.79 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.719 1.748 . . . . 7.5599999999999996 115.719 -167.914 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 15.6 m -70.39 -44.17 68.55 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 120.882 -1.136 . . . . 6.7300000000000004 111.672 -176.78 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 131' ' ' LEU . . . . . 0.454 ' H ' ' HB ' ' B' ' 126' ' ' VAL . 92.8 mt 57.9 -68.86 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 129.698 3.199 . . . . 6.8799999999999999 114.378 167.301 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -160.9 -23.82 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 128.43 2.692 . . . . 3.6899999999999999 111.231 179.142 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 133' ' ' LYS . . . . . 0.414 ' HE2' ' O ' ' B' ' 133' ' ' LYS . 0.0 OUTLIER -54.44 -26.57 31.66 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.23 -0.919 . . . . 8.7699999999999996 113.016 161.974 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -138.66 80.82 1.81 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.753 1.263 . . . . 6.7999999999999998 111.687 156.059 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.65 152.23 44.68 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 127.25 2.22 . . . . 6.6600000000000001 113.085 169.081 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 34.8 pt -76.19 -155.42 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 125.878 1.671 . . . . 2.6499999999999999 113.731 179.791 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 90.3 p -108.4 142.57 38.57 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 119.446 -2.034 . . . . 3.1099999999999999 107.74 153.212 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 138' ' ' LYS . . . . . 0.469 ' CD ' ' HB3' ' B' ' 169' ' ' LEU . 20.8 mttp -67.53 -21.96 65.45 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.054 -1.029 . . . . 2.79 110.99 179.895 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 2.9 m -50.2 -23.07 1.99 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.324 1.602 . . . . 2.1800000000000002 115.324 162.1 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 21.7 t -70.35 -34.58 72.81 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 120.309 -1.495 . . . . 2.2799999999999998 112.761 169.92 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -64.52 -44.52 90.62 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 118.299 -0.858 . . . . 2.1699999999999999 112.334 178.805 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 16.4 ptt85 -57.88 -34.04 69.35 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.681 1.128 . . . . 4.0300000000000002 110.821 172.014 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 143' ' ' GLU . . . . . 0.472 ' HA ' ' HG2' ' B' ' 146' ' ' GLN . 6.2 tt0 -86.75 -38.55 16.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 113.977 1.103 . . . . 2.9900000000000002 113.977 -169.144 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.6 tmm? -62.31 -37.58 86.1 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.856 -0.528 . . . . 1.1899999999999999 110.941 165.927 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 12.6 mt -64.81 -41.67 95.6 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 120.658 -1.276 . . . . 1.0800000000000001 113.844 169.778 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 146' ' ' GLN . . . . . 0.5 ' HB2' ' HE ' ' B' ' 159' ' ' ARG . 14.3 pt20 -73.71 -19.91 60.68 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 114.05 1.13 . . . . 3.1800000000000002 114.05 -175.665 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -91.29 -68.54 0.79 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.826 2.05 . . . . 2.3700000000000001 113.005 168.954 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -65.96 -27.22 68.0 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.655 1.57 . . . . 3.6400000000000001 113.792 -167.233 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.25 6.1 42.79 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.245 1.018 . . . . 2.3399999999999999 112.87 -179.817 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -52.09 -36.68 51.57 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.773 1.768 . . . . 2.4700000000000002 115.773 -160.833 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -67.25 -53.02 33.83 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.11 0.868 . . . . 1.8899999999999999 112.699 -168.318 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 38.0 mtm -73.2 -23.81 60.45 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.414 1.264 . . . . 2.9500000000000002 114.414 173.565 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 8.8 tt -50.76 -38.09 45.92 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-O 118.141 -0.933 . . . . 5.6500000000000004 112.823 -160.927 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 50.2 m 81.58 102.81 0.06 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.235 1.814 . . . . 5.1500000000000004 112.28 172.237 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 14.1 t70 69.8 -173.43 0.18 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.541 1.536 . . . . 4.6200000000000001 114.5 165.32 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 62.2 m -73.23 -38.61 65.97 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.939 1.696 . . . . 2.6099999999999999 110.0 162.579 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.49 -45.71 89.12 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.407 1.003 . . . . 1.97 113.742 -172.692 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -72.66 -20.01 61.33 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 118.813 1.306 . . . . 4.6399999999999997 112.71 178.909 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 159' ' ' ARG . . . . . 0.5 ' HE ' ' HB2' ' B' ' 146' ' ' GLN . 38.7 mtt85 -70.4 -38.06 74.58 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 120.057 -1.652 . . . . 7.3700000000000001 112.83 167.652 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -61.97 -37.64 85.56 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.174 -0.954 . . . . 4.4299999999999997 111.26 169.596 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 161' ' ' ALA . . . . . 0.47 ' HA ' ' HE3' ' B' ' 164' ' ' LYS . . . -60.5 -38.49 84.48 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 117.668 -1.158 . . . . 1.3100000000000001 113.602 170.428 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -58.12 -48.05 81.41 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.454 1.025 . . . . 0.81999999999999995 111.84 168.6 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -61.67 -32.87 73.07 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.062 1.134 . . . . 2.2999999999999998 114.062 -177.681 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 164' ' ' LYS . . . . . 0.47 ' HE3' ' HA ' ' B' ' 161' ' ' ALA . 8.2 mtmp? -46.64 -44.63 18.57 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-O 123.131 1.443 . . . . 3.1800000000000002 113.206 171.777 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 5.6 mt -72.8 -39.7 66.47 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.199 -1.819 . . . . 1.1499999999999999 111.274 -170.386 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 26.1 mm -53.66 -55.16 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 126.096 1.758 . . . . 1.4199999999999999 109.651 178.437 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -66.48 -38.4 87.22 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.254 1.022 . . . . 2.7599999999999998 112.832 -179.262 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -57.57 -15.05 6.23 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.625 1.17 . . . . 3.54 113.939 169.19 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 169' ' ' LEU . . . . . 0.469 ' HB3' ' CD ' ' B' ' 138' ' ' LYS . 3.4 mm? -108.63 -38.93 5.53 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.686 1.194 . . . . 2.0800000000000001 113.346 170.046 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -77.82 -25.57 48.92 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 119.443 -2.036 . . . . 3.9300000000000002 113.787 -177.674 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.32 -20.13 44.99 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.723 1.147 . . . . 3.75 113.782 176.09 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -159.82 20.79 0.17 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.083 1.512 . . . . 4.9400000000000004 115.083 -161.407 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.44 15.35 4.51 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 120.597 -1.314 . . . . 5.2000000000000002 113.915 171.922 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 14.3 t70 60.56 -155.05 0.36 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.701 1.6 . . . . 3.8999999999999999 110.649 177.517 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -94.09 15.95 62.03 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 120.278 -1.513 . . . . 2.3900000000000001 112.857 165.609 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 53.6 mmt-85 -78.02 51.41 0.97 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.099 1.45 . . . . 4.7999999999999998 112.39 -177.696 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 177' ' ' ILE . . . . . 0.402 HG12 ' HE3' ' B' ' 138' ' ' LYS . 39.7 mt -58.04 127.71 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.212 1.005 . . . . 2.8199999999999998 110.316 -175.394 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.3 m -113.23 168.57 9.61 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.141 1.163 . . . . 2.1099999999999999 114.141 -173.21 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -63.38 -58.49 6.93 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.01 1.324 . . . . 1.8700000000000001 111.13 170.695 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -67.92 -22.45 65.06 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.246 2.219 . . . . 3.5299999999999998 111.482 -172.134 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -57.6 -58.72 7.09 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 125.56 1.544 . . . . 3.27 110.882 169.833 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -50.46 -50.44 52.35 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.971 -0.456 . . . . 2.2400000000000002 110.824 179.418 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.3 t-105 -62.82 -46.39 88.15 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.396 0.679 . . . . 0.56000000000000005 112.762 -179.672 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.1 t -68.77 -33.89 74.64 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 118.638 0.654 . . . . 1.4399999999999999 111.387 -178.68 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 75.9 mt -61.69 -43.07 99.57 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 117.449 -1.262 . . . . 0.68999999999999995 112.143 172.065 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 46.8 mm -48.39 -43.19 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 CA-C-N 121.077 1.762 . . . . 0.70999999999999996 112.122 -179.253 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.89 -19.06 58.3 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.179 0.895 . . . . 0.66000000000000003 114.311 -179.981 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -76.78 -4.85 82.9 Favored Glycine 0 CA--C 1.534 1.241 0 O-C-N 120.776 -1.426 . . . . 0.93999999999999995 114.274 174.775 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -123.17 -45.28 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.851 1.66 . . . . 0.85999999999999999 110.188 170.686 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 92.6 m -74.64 71.91 1.93 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.983 1.713 . . . . 1.52 107.739 165.574 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -144.43 -78.35 0.04 OUTLIER Glycine 0 CA--C 1.529 0.926 0 C-N-CA 125.535 1.54 . . . . 0.87 111.14 178.668 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -63.77 -32.29 67.71 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.344 2.696 . . . . 1.02 113.684 -176.894 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.4 pt -78.38 -3.13 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 114.306 1.224 . . . . 1.1100000000000001 114.306 178.846 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -35.61 -64.83 0.27 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 127.704 2.402 . . . . 2.2200000000000002 115.516 -176.889 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -57.64 -33.41 68.25 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.616 -1.303 . . . . 4.8700000000000001 113.202 177.101 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 10.4 tt -70.15 -41.36 73.94 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 117.991 -1.004 . . . . 2.8300000000000001 110.468 177.487 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 83.9 mt -52.58 -50.27 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 119.15 0.887 . . . . 2.79 110.71 172.181 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -61.28 -47.1 87.55 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.964 0.906 . . . . 2.96 113.301 175.019 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -92.44 2.44 56.66 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 120.713 -1.242 . . . . 3.3599999999999999 113.257 -169.074 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -22.37 61.06 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.636 1.574 . . . . 5.1200000000000001 113.301 161.571 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -87.88 15.31 7.29 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 123.784 1.754 . . . . 3.2799999999999998 111.152 172.891 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -121.75 -67.99 0.93 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.04 1.336 . . . . 4.0499999999999998 109.062 168.118 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.52 13.34 0.2 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 129.243 3.017 . . . . 8.0299999999999994 116.873 165.012 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 45.9 t -170.92 24.01 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.088 1.755 . . . . 6.25 110.574 -166.336 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 31.1 t -108.19 7.94 27.71 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.882 1.273 . . . . 7.8700000000000001 112.857 -178.647 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 42.7 t . . . . . 0 C--O 1.256 1.41 1 C-N-CA 131.892 4.077 . . . . 9.7400000000000002 108.624 -165.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.496 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 119.369 -0.348 . . . . 2.26 110.489 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.17 150.27 4.66 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 118.914 0.779 . . . . 1.1 111.165 -173.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -59.26 -48.59 81.06 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 118.914 0.779 . . . . 2.58 110.301 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.67 -47.69 14.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.594 1.558 . . . . 1.04 110.941 172.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -74.26 -50.59 18.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 118.005 -0.997 . . . . 2.79 113.235 -173.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 mtmm -50.4 -37.89 39.96 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 120.931 1.696 . . . . 6.02 113.48 164.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.866 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.39 -44.95 85.89 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.206 -1.378 . . . . 0.56 111.928 175.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.483 ' O ' HG23 ' A' ' 16' ' ' VAL . 69.1 t -60.14 -36.14 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 CA-C-N 121.339 1.882 . . . . 0.63 110.59 172.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 52.6 mt -58.49 -51.99 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 O-C-N 121.179 -0.95 . . . . 0.83 111.766 167.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.2 t -61.97 -39.58 84.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.486 1.515 . . . . 0.6 112.019 -177.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.3 mp -63.59 -43.12 97.87 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.798 0.839 . . . . 1.01 111.187 172.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 12' ' ' VAL . 89.0 t -62.34 -41.94 93.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 118.126 -0.94 . . . . 0.69 109.864 177.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -65.88 -41.68 91.28 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.111 1.323 . . . . 4.49 114.111 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -16.52 20.28 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 120.336 -1.478 . . . . 3.58 113.48 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -98.8 -61.59 1.35 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.767 1.627 . . . . 1.9 113.189 166.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -60.46 -24.4 65.21 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.462 1.483 . . . . 1.85 114.365 -171.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -46.32 -26.63 0.85 Allowed 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.094 1.316 . . . . 2.66 113.815 167.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -91.18 7.12 42.24 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.808 2.043 . . . . 2.37 115.99 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 N--CA 1.477 0.908 0 CA-C-N 119.711 1.141 . . . . 2.37 109.587 170.065 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 22.9 pt . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 121.812 0.815 . . . . 2.96 111.441 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.6 t -78.74 134.7 37.04 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.571 -0.9 . . . . 2.75 108.571 159.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -55.25 -25.11 31.45 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.154 -0.966 . . . . 2.38 112.346 172.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.6 m -61.97 -12.98 21.17 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.013 1.486 . . . . 2.92 115.013 169.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.6 m -82.96 -23.95 33.2 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.59 1.541 . . . . 1.69 114.273 168.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -52.76 -53.96 40.63 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.298 1.863 . . . . 2.13 111.9 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 27.0 ptt180 -61.66 -17.17 54.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.767 2.027 . . . . 2.63 114.874 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -101.64 -52.42 3.22 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 126.969 2.108 . . . . 3.18 109.179 -175.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 17.1 tmm? -53.75 -36.4 62.28 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.174 1.39 . . . . 1.89 112.535 170.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 mt -54.12 -30.06 47.36 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.027 1.331 . . . . 1.02 113.983 169.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.79 -3.69 58.05 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.416 1.007 . . . . 3.09 112.869 176.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -56.5 2.19 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.691 1.596 . . . . 1.6 112.346 170.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -90.46 -14.8 32.08 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.215 1.191 . . . . 3.09 114.215 -167.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 mt -123.22 45.27 2.46 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.008 2.123 . . . . 1.61 109.852 174.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -78.8 -21.01 48.4 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 115.343 1.608 . . . . 1.42 115.343 -170.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.506 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 59.9 m-70 -83.43 -22.54 32.63 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 121.211 1.823 . . . . 1.66 114.364 -168.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 73.6 mtm -91.6 -12.92 32.93 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.88 1.672 . . . . 1.9 113.028 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.2 tp -99.06 117.87 34.54 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.768 1.227 . . . . 3.3 111.016 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.7 m -159.19 -47.21 0.06 Allowed 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.569 -1.332 . . . . 5.37 110.337 171.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -37.72 -26.78 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.631 2.772 . . . . 5.94 115.471 160.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.7 m 71.79 -25.01 0.18 Allowed 'General case' 0 C--N 1.342 0.257 0 C-N-CA 128.758 2.823 . . . . 2.63 112.73 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.26 -44.16 75.24 Favored Glycine 0 N--CA 1.473 1.103 0 C-N-CA 127.043 2.259 . . . . 1.89 113.604 172.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -55.03 -42.74 73.0 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.498 1.119 . . . . 3.42 111.774 171.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.7 ttt-85 -68.29 -40.07 81.91 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.534 -1.354 . . . . 5.22 113.249 170.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.1 mtmt -55.32 -29.94 59.26 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 122.16 2.255 . . . . 4.81 112.58 173.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.42 -10.22 59.26 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.984 1.476 . . . . 1.39 114.984 173.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -82.43 -52.89 6.45 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.796 1.238 . . . . 0.89 111.233 162.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.89 -33.47 74.27 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.316 0.647 . . . . 2.24 112.655 -173.271 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -54.66 -32.0 58.5 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.719 1.007 . . . . 3.06 113.719 169.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.0 mt -81.16 -40.19 24.34 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.618 1.167 . . . . 1.08 110.735 -177.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.1 mm -48.7 -55.42 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.644 1.177 . . . . 1.36 110.66 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -66.01 -38.81 89.38 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.417 1.087 . . . . 1.87 113.174 -177.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -32.82 70.61 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.873 1.269 . . . . 3.19 112.699 170.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.77 -41.57 14.0 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.142 0.977 . . . . 2.53 110.593 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -47.95 -48.4 32.14 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.263 1.425 . . . . 2.73 112.111 172.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -53.51 -22.19 7.69 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.873 1.434 . . . . 2.06 114.873 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.1 m-80 -113.81 5.62 16.39 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.066 1.346 . . . . 2.68 113.539 -175.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 20.0 t60 -149.16 101.68 3.17 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 117.216 2.302 . . . . 3.69 117.216 -153.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -20.75 3.24 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 128.239 2.616 . . . . 4.62 115.341 170.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 95.87 22.9 19.39 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 118.84 -0.978 . . . . 2.86 113.015 -166.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 58.9 mmt-85 -75.45 88.18 2.63 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.608 1.704 . . . . 4.45 106.61 153.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.94 143.41 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 108.875 -0.787 . . . . 2.75 108.875 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.87 149.2 39.04 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.526 1.131 . . . . 1.83 108.538 174.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.36 -38.18 88.56 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 120.1 1.318 . . . . 2.0 110.896 176.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.31 -22.83 63.64 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.924 2.09 . . . . 2.94 113.905 175.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.96 -61.2 2.75 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.795 1.238 . . . . 3.61 110.969 -178.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -56.0 -44.87 79.04 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.392 -0.818 . . . . 2.38 112.789 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -61.72 -44.39 97.0 Favored 'General case' 0 C--O 1.239 0.552 0 O-C-N 121.844 -0.535 . . . . 0.6 111.247 -178.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.59 -21.35 59.53 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 117.421 -1.276 . . . . 1.61 112.804 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.8 mt -70.59 -44.22 67.78 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 120.176 1.353 . . . . 0.9 112.662 165.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.8 mm -56.21 -37.3 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 CA-C-N 120.869 1.668 . . . . 0.7 112.452 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.28 -14.33 63.93 Favored Glycine 0 CA--C 1.533 1.208 0 CA-C-O 118.935 -0.925 . . . . 0.84 114.502 178.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.02 -19.7 58.83 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-N 119.085 1.442 . . . . 0.81 113.901 175.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.4 mp -90.76 -44.97 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 118.524 1.162 . . . . 1.11 109.509 167.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.2 m -76.4 85.78 3.15 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 107.595 -1.261 . . . . 1.25 107.595 -178.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -167.79 -75.82 0.04 OUTLIER Glycine 0 CA--C 1.532 1.098 0 CA-C-O 117.918 -1.49 . . . . 0.89 113.993 -170.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -59.91 -44.48 30.05 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 123.134 2.556 . . . . 1.0 111.496 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.8 pt -76.27 -12.73 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 114.487 1.292 . . . . 1.51 114.487 169.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.84 -49.09 77.86 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.788 1.631 . . . . 1.13 112.599 -175.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -50.49 68.95 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.078 0.854 . . . . 3.41 112.051 170.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.9 tt -53.75 -39.05 65.02 Favored 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 125.273 1.429 . . . . 1.45 112.399 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 80.4 mt -55.82 -63.22 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 119.623 1.101 . . . . 1.03 111.068 171.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -53.49 -30.48 41.34 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 118.596 0.635 . . . . 1.8 112.63 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -83.8 -21.03 32.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.45 1.1 . . . . 3.24 112.54 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 -73.03 -38.15 66.63 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 120.938 -1.101 . . . . 2.29 112.13 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -69.34 0.85 4.44 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.303 1.441 . . . . 2.45 112.798 175.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 . . . . . 0 N--CA 1.465 0.292 0 C-N-CA 126.229 1.811 . . . . 2.26 111.32 179.02 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.506 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 0.2 OUTLIER . . . . . 0 CA--C 1.542 0.642 0 CA-C-O 119.465 -0.302 . . . . 2.36 110.522 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.53 150.18 7.13 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-N 118.958 0.799 . . . . 1.08 111.371 -173.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -58.56 -49.21 78.27 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.458 1.026 . . . . 2.76 110.238 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.38 -47.23 13.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.383 1.473 . . . . 1.02 111.129 172.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -74.71 -50.83 16.07 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 117.928 -1.034 . . . . 2.7 113.071 -172.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -50.11 -37.0 31.91 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 120.965 1.712 . . . . 5.54 113.245 164.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.866 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.91 -41.63 82.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 117.438 -1.268 . . . . 0.58 112.777 176.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . 0.477 ' O ' HG23 ' B' ' 119' ' ' VAL . 75.2 t -62.36 -37.63 79.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-N 121.122 1.783 . . . . 0.64 110.396 170.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 55.8 mt -56.29 -53.42 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 119.398 0.999 . . . . 0.79 111.197 167.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 7.5 t -61.19 -39.66 83.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 125.206 1.402 . . . . 0.54 112.1 -176.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.5 mp -63.32 -44.49 94.81 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.128 0.876 . . . . 0.99 111.431 172.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . 0.477 HG23 ' O ' ' B' ' 115' ' ' VAL . 91.0 t -62.85 -40.54 89.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 118.056 -0.974 . . . . 0.67 109.852 178.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -67.52 -42.95 81.93 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.676 1.125 . . . . 4.1 113.286 172.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.61 -18.99 23.02 Favored 'General case' 0 CA--C 1.552 1.027 0 O-C-N 120.447 -1.408 . . . . 3.61 113.561 176.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -95.17 -63.75 1.13 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.629 1.172 . . . . 2.0 113.083 166.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -59.06 -23.82 62.35 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.656 1.571 . . . . 1.83 114.833 -170.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -46.89 -25.04 0.69 Allowed 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 120.259 1.391 . . . . 2.46 113.884 167.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -93.23 8.78 38.85 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.298 2.239 . . . . 2.29 116.153 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.1 m . . . . . 0 N--CA 1.477 0.899 0 CA-C-N 120.141 1.337 . . . . 2.43 110.146 168.447 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 9.0 pt . . . . . 0 N--CA 1.475 0.805 0 CA-C-O 121.816 0.817 . . . . 2.98 111.475 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 32.5 t -84.99 138.35 32.52 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.7 -0.852 . . . . 2.54 108.7 163.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -58.78 -20.01 45.88 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 120.56 -1.337 . . . . 2.21 112.522 172.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 50.8 m -66.01 -16.76 64.18 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.237 1.415 . . . . 2.58 114.586 167.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 61.6 m -80.41 -29.97 37.7 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.887 1.221 . . . . 1.2 113.098 176.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.411 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 70.1 t80 -50.91 -57.37 8.68 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.651 1.114 . . . . 1.9 112.146 176.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -61.86 -17.79 57.74 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.57 1.948 . . . . 2.86 114.606 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -97.52 -54.76 3.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.962 2.105 . . . . 3.33 109.07 -177.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -53.31 -35.67 60.4 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.803 1.641 . . . . 1.81 112.701 172.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.0 mt -54.31 -30.0 49.56 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.004 1.322 . . . . 1.06 113.898 169.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.84 -3.43 56.78 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.611 1.096 . . . . 3.29 112.891 176.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.64 -57.27 2.05 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.874 1.67 . . . . 1.47 112.341 171.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -89.67 -15.78 31.89 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.682 0.993 . . . . 3.06 113.682 -167.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.3 mt -121.97 44.98 2.44 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.334 1.854 . . . . 1.62 110.088 174.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -79.04 -23.67 44.13 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.344 1.609 . . . . 1.38 115.344 -169.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . 0.496 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 64.6 m-70 -81.3 -22.36 38.63 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 121.115 1.78 . . . . 1.63 114.343 -167.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 73.2 mtm -91.19 -11.44 38.32 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.677 1.591 . . . . 1.97 113.102 171.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 40.0 tp -100.74 120.15 39.66 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.15 1.38 . . . . 3.24 111.091 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 23.0 m -160.94 -47.29 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 O-C-N 120.524 -1.36 . . . . 5.14 110.019 170.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -37.72 -27.69 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 128.995 2.918 . . . . 5.91 115.527 161.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 100.0 m 71.71 -22.17 0.2 Allowed 'General case' 0 C--N 1.342 0.245 0 C-N-CA 128.471 2.708 . . . . 2.8 112.969 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.84 -44.89 92.01 Favored Glycine 0 N--CA 1.471 1.008 0 C-N-CA 126.181 1.848 . . . . 1.93 113.038 171.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -54.97 -41.34 71.05 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.823 1.249 . . . . 3.43 111.731 172.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.6 ttt-85 -68.9 -41.36 78.36 Favored 'General case' 0 C--N 1.345 0.374 0 O-C-N 120.482 -1.387 . . . . 4.87 113.121 170.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 19.5 mtmt -57.37 -26.49 61.1 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 121.65 2.023 . . . . 3.99 112.885 173.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -74.54 -11.0 60.09 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.853 1.427 . . . . 1.41 114.853 172.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.13 -56.89 3.52 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.307 1.443 . . . . 0.89 111.145 163.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -34.18 69.0 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 113.255 0.835 . . . . 2.23 113.255 -176.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -55.14 -32.2 61.91 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 121.047 -1.033 . . . . 3.12 113.765 170.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . 0.45 HD11 ' HA3' ' B' ' 188' ' ' GLY . 17.3 mt -79.97 -40.09 28.73 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.254 1.022 . . . . 1.07 110.416 -176.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 39.6 mm -49.74 -54.42 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.101 1.36 . . . . 1.31 110.733 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -65.4 -37.85 88.2 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.517 1.127 . . . . 1.89 113.369 -178.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -34.18 74.36 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.1 1.36 . . . . 3.14 112.988 170.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.81 -41.0 18.01 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.738 1.215 . . . . 2.65 110.282 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -51.39 -46.61 62.88 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.676 1.59 . . . . 2.65 112.817 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -55.22 -20.71 11.53 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.72 1.378 . . . . 2.14 114.72 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -112.64 4.57 17.29 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.021 1.328 . . . . 2.71 113.459 -176.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -151.51 100.71 2.74 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 117.52 2.415 . . . . 3.48 117.52 -153.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -19.08 4.1 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.49 2.716 . . . . 4.64 115.793 171.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 96.15 26.46 11.25 Favored Glycine 0 CA--C 1.53 0.987 0 CA-C-O 118.915 -0.936 . . . . 2.95 113.087 -167.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 54.3 mmt-85 -78.63 84.16 4.76 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.35 1.575 . . . . 4.5 107.154 154.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 11.3 mt -62.05 132.59 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 CA-C-N 118.795 0.725 . . . . 2.86 109.324 -173.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 21.2 m -94.39 158.45 15.56 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 122.012 -0.43 . . . . 1.56 110.33 166.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -63.63 -37.86 88.95 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 119.521 -0.872 . . . . 2.0 111.474 166.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -21.63 65.53 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.652 1.581 . . . . 2.94 114.266 177.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -62.43 -59.21 5.3 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.94 0.896 . . . . 3.49 110.933 -177.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -54.51 -46.81 73.57 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.437 -0.789 . . . . 2.5 112.856 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 40.7 t-105 -61.96 -45.72 92.43 Favored 'General case' 0 C--O 1.239 0.542 0 O-C-N 121.998 -0.439 . . . . 0.62 111.078 -176.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -72.27 -23.19 61.16 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-O 117.317 -1.325 . . . . 1.61 112.436 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.411 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 30.9 mt -69.91 -42.61 73.14 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 120.081 1.31 . . . . 0.85 112.844 167.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 32.2 mm -56.81 -36.08 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 CA-C-N 120.928 1.694 . . . . 0.66 112.497 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.21 -19.16 67.99 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.043 -0.865 . . . . 0.7 114.077 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . 0.45 ' HA3' HD11 ' B' ' 165' ' ' LEU . . . -80.84 -20.55 65.35 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-N 119.356 1.578 . . . . 0.85 113.751 176.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.2 mp -90.86 -43.21 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 CA-C-N 118.497 1.149 . . . . 1.11 110.25 168.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 4.1 m -78.13 83.89 4.38 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 107.86 -1.163 . . . . 1.31 107.86 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -165.31 -74.55 0.03 OUTLIER Glycine 0 CA--C 1.533 1.16 0 CA-C-O 118.128 -1.373 . . . . 0.88 114.109 -172.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.68 -42.55 38.34 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.158 2.572 . . . . 1.02 111.617 176.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.9 pt -77.11 -12.4 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 114.93 1.456 . . . . 1.57 114.93 169.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.45 -52.17 66.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.75 1.614 . . . . 1.09 112.605 -175.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.66 -48.8 69.09 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.523 -0.736 . . . . 3.51 112.284 170.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 10.2 tt -56.52 -37.64 70.73 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 125.318 1.447 . . . . 1.7 111.979 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 75.4 mt -56.56 -61.94 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 119.648 1.113 . . . . 1.0 111.069 169.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -55.71 -28.42 55.6 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.726 -0.609 . . . . 1.88 112.585 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -83.66 -23.76 31.63 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.33 1.052 . . . . 3.12 112.35 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -76.55 -42.31 43.45 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.961 1.305 . . . . 2.25 112.838 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.58 3.01 6.79 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 122.659 1.219 . . . . 2.57 112.548 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -120.23 -57.8 1.91 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 126.959 2.103 . . . . 2.68 110.572 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.28 6.5 pt20 . . . . . 0 N--CA 1.476 0.85 0 C-N-CA 130.678 3.591 . . . . 5.19 115.506 171.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.1 m-30 . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 111.809 0.3 . . . . 2.3 111.809 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.2 t -76.26 134.83 39.69 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 108.184 -1.043 . . . . 2.08 108.184 153.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -61.7 -28.66 69.57 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 122.683 0.393 . . . . 2.93 110.638 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.03 -40.82 67.41 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.541 -0.725 . . . . 1.01 110.991 175.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -67.16 -61.3 1.99 Allowed 'General case' 0 C--N 1.337 0.058 0 O-C-N 121.909 -0.494 . . . . 2.53 109.971 176.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.4 tptt -54.56 -26.94 35.33 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.416 1.265 . . . . 5.71 114.416 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.794 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -73.7 -44.5 56.36 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.258 1.423 . . . . 0.72 112.254 170.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 77.6 t -59.46 -39.53 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 120.547 1.521 . . . . 0.85 110.025 168.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.5 mt -55.57 -50.42 66.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-O 117.689 -1.148 . . . . 0.8 110.516 170.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.7 t -58.43 -40.68 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-N 120.42 1.464 . . . . 0.55 111.685 178.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.23 -51.53 65.86 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.071 0.85 . . . . 0.94 111.914 173.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.1 t -60.63 -46.8 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.5 1.52 . . . . 0.83 112.883 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -66.6 -44.34 82.41 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 3.33 110.111 -176.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.5 t30 -65.59 -34.66 78.76 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.085 0.772 . . . . 3.0 113.085 177.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -63.63 -50.65 68.51 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 120.556 -1.34 . . . . 2.26 112.459 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -63.34 -42.91 98.98 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 117.491 -1.242 . . . . 2.44 113.037 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.8 ptmt -63.0 -29.58 70.94 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.251 1.841 . . . . 4.7 112.932 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -74.5 -49.23 22.96 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.043 -1.036 . . . . 2.63 112.719 172.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.4 t . . . . . 0 N--CA 1.48 1.054 0 CA-C-N 119.371 0.987 . . . . 3.66 112.903 -179.401 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.4 tt . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 108.236 -1.024 . . . . 2.52 108.236 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.4 m -118.05 156.3 28.84 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.402 -0.811 . . . . 2.55 110.825 164.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -64.96 -19.27 65.88 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.237 -1.539 . . . . 2.01 113.145 -177.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.1 p -65.34 -28.96 69.66 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.112 1.365 . . . . 1.89 114.079 164.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.9 m -68.3 -30.78 69.86 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.383 -1.448 . . . . 1.16 112.815 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.443 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 14.4 t80 -59.24 -57.86 11.16 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 120.579 1.536 . . . . 2.16 111.819 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -55.27 -25.06 31.51 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.589 1.155 . . . . 2.3 112.152 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.405 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 26.2 mt-10 -90.34 -50.13 6.14 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 125.774 1.629 . . . . 3.79 112.662 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 59.7 ttp -45.37 -45.57 12.64 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 124.12 0.968 . . . . 2.41 110.243 162.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.1 mt -58.16 -50.49 73.33 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 125.264 1.426 . . . . 1.21 112.732 171.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -20.86 59.78 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 120.427 1.467 . . . . 3.0 113.972 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 1.4 mppt? -87.41 -48.55 7.87 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.778 1.231 . . . . 2.85 110.237 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -74.64 -74.35 0.2 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.267 1.027 . . . . 3.82 111.615 171.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.0 mt -74.77 32.68 0.09 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.69 1.596 . . . . 2.48 113.422 -173.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -59.25 -22.79 61.66 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.675 1.59 . . . . 1.63 113.47 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -77.5 -62.55 1.62 Allowed 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.181 0.901 . . . . 1.67 110.279 -178.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 6.8 ptp -62.23 -29.87 70.7 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.583 1.083 . . . . 3.2 113.362 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.83 -61.62 1.79 Allowed 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.88 -0.785 . . . . 3.22 108.88 170.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.9 m 54.86 -82.52 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.09 1.756 . . . . 4.74 111.45 -169.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.2 161.12 24.13 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.7 2.0 . . . . 3.8 113.97 -174.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.5 m -69.61 -23.81 63.57 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.864 1.666 . . . . 2.61 112.377 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.86 -52.17 54.56 Favored Glycine 0 N--CA 1.471 1.018 0 C-N-CA 126.188 1.851 . . . . 1.53 112.784 173.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -61.5 -27.0 68.28 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.052 0.541 . . . . 3.48 112.15 172.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 94.0 mtm-85 -80.74 -17.06 52.23 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 114.055 1.132 . . . . 6.12 114.055 170.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt -66.45 -36.05 81.82 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 119.055 -2.278 . . . . 3.68 110.918 169.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.8 -18.74 34.84 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 114.859 1.429 . . . . 1.03 114.859 163.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -80.72 -53.26 6.67 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 119.913 1.233 . . . . 0.86 110.896 166.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -57.44 -40.55 78.69 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.889 1.275 . . . . 2.8 113.873 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.0 ptmt -53.3 -30.96 41.62 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.905 0.882 . . . . 3.16 112.542 178.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 30.1 mt -80.21 -44.69 19.31 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 118.503 -0.761 . . . . 0.74 111.067 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 6.2 mm -54.47 -48.14 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-O 118.624 -0.703 . . . . 0.79 109.783 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -67.36 -28.76 68.22 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 114.162 1.171 . . . . 1.76 114.162 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -73.89 -35.52 64.7 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.307 0.643 . . . . 3.63 112.244 171.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -72.43 -29.08 63.38 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.607 1.163 . . . . 2.36 111.515 172.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -62.52 -21.6 65.66 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.83 1.652 . . . . 3.42 113.355 175.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.15 -10.91 59.78 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.748 1.388 . . . . 1.93 114.748 169.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -135.99 -34.28 0.81 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 116.206 1.928 . . . . 2.35 116.206 -166.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.6 m170 -115.64 115.89 27.16 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.421 -1.425 . . . . 4.02 112.105 -170.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -140.95 152.88 45.33 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.187 1.395 . . . . 5.82 110.342 162.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.32 -41.6 0.78 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 127.309 2.385 . . . . 2.91 114.353 -177.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.3 mmt85 -98.41 139.92 33.44 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 127.949 2.5 . . . . 5.38 111.414 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 45.3 mm -101.41 145.67 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 N-CA-C 107.803 -1.184 . . . . 2.1 107.803 148.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 t -101.62 152.93 20.22 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.518 -0.739 . . . . 1.5 111.759 169.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -58.23 -51.66 68.84 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.021 0.828 . . . . 2.43 110.96 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -61.06 -15.14 29.16 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.119 1.368 . . . . 3.21 112.565 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -64.51 -57.85 8.03 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.468 1.107 . . . . 3.05 111.963 -174.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.56 -42.32 78.39 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.012 -1.68 . . . . 2.02 111.768 176.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 30.0 t-105 -63.96 -48.54 76.06 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 119.247 -0.406 . . . . 0.69 111.907 -177.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 36.5 p -62.59 -44.71 95.62 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.777 1.231 . . . . 2.72 111.064 175.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.443 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 93.3 mt -62.28 -38.69 90.31 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 118.389 -0.815 . . . . 0.8 112.852 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 23.3 mm -55.22 -46.67 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 CA-C-N 120.397 1.453 . . . . 0.93 111.585 175.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.55 -29.23 72.93 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 119.458 -0.634 . . . . 0.83 113.186 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.42 -22.82 77.79 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-O 118.676 -1.069 . . . . 0.59 114.163 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.7 mp -88.24 -47.62 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 118.959 1.38 . . . . 0.9 110.323 162.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.6 m -75.97 31.89 0.12 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 127.017 2.127 . . . . 1.77 112.355 -169.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.61 -85.39 1.16 Allowed Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.3 0.952 . . . . 0.99 111.095 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -64.23 -36.16 47.93 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.743 2.295 . . . . 1.51 111.974 -176.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.62 -17.63 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 113.579 0.955 . . . . 1.18 113.579 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.54 -44.31 94.55 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 120.037 1.289 . . . . 1.07 112.846 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.25 -36.83 84.96 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 120.753 -1.217 . . . . 3.32 110.643 176.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.32 -46.87 88.38 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.579 1.152 . . . . 1.13 111.355 173.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 83.4 mt -50.69 -58.87 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.732 0.813 . . . . 1.15 110.636 172.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -63.92 -37.13 86.29 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.859 -0.526 . . . . 1.91 112.251 -176.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.291 3.9 pt-20 -76.83 -13.99 59.95 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.041 -1.037 . . . . 3.05 112.239 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.61 -29.18 30.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.44 1.896 . . . . 2.46 114.643 167.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -76.23 3.94 9.74 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 123.104 1.43 . . . . 2.44 111.995 173.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 . . . . . 0 C--N 1.327 -0.413 0 C-N-CA 126.119 1.768 . . . . 2.6 111.06 -175.906 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 111.783 0.29 . . . . 2.27 111.783 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 7.2 t -75.4 137.64 41.17 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.093 -1.077 . . . . 2.06 108.093 153.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -60.77 -28.67 68.9 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 122.568 0.347 . . . . 2.86 110.573 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -39.25 69.42 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.131 -0.981 . . . . 1.14 111.006 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -68.43 -60.67 2.27 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-O 119.319 -0.372 . . . . 2.55 110.359 176.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -55.87 -27.24 50.83 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.341 1.237 . . . . 6.51 114.341 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.794 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -72.14 -45.61 59.84 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.193 1.397 . . . . 0.81 111.821 169.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 63.2 t -59.63 -39.62 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-N 120.892 1.678 . . . . 0.86 110.442 170.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 10.6 mt -53.9 -50.21 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-O 117.605 -1.188 . . . . 0.79 110.962 169.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 3.7 t -59.07 -43.23 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.072 1.306 . . . . 0.55 111.671 178.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.3 mp -61.25 -45.76 93.2 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.06 0.845 . . . . 1.03 111.615 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 38.6 t -66.89 -44.38 88.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.262 1.425 . . . . 0.72 113.141 178.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -66.43 -42.17 88.12 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.346 1.058 . . . . 3.13 110.359 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -62.76 -31.02 71.89 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.625 0.972 . . . . 2.63 113.625 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -71.32 -55.32 8.26 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.478 -1.389 . . . . 2.36 111.949 176.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -61.13 -39.6 90.63 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.86 -1.15 . . . . 2.41 113.191 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.65 -32.43 72.59 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.179 1.354 . . . . 4.59 112.798 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -76.32 -43.62 40.41 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.76 -1.213 . . . . 2.52 112.128 172.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 54.0 t . . . . . 0 N--CA 1.481 1.089 0 C-N-CA 124.462 1.105 . . . . 3.58 113.173 -177.452 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.5 tt . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 107.476 -1.305 . . . . 2.59 107.476 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 66.8 m -142.96 161.36 38.32 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 119.769 -1.832 . . . . 2.59 110.198 173.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -68.4 -20.7 64.69 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 120.907 -1.12 . . . . 2.08 112.806 -175.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 7.8 p -66.77 -31.25 71.77 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.262 1.425 . . . . 1.95 113.371 164.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 6.1 m -67.51 -35.56 79.34 Favored 'General case' 0 C--O 1.225 -0.229 0 O-C-N 120.574 -1.329 . . . . 1.29 112.344 -177.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.455 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 12.9 t80 -57.72 -58.8 6.74 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 119.606 1.094 . . . . 1.95 111.434 -177.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -54.81 -26.07 32.44 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.618 1.167 . . . . 2.16 112.373 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . 0.405 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 24.6 mt-10 -90.38 -50.88 5.71 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 125.739 1.616 . . . . 3.54 112.703 -174.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 63.5 ttp -45.53 -45.14 13.19 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 124.247 1.019 . . . . 2.62 110.176 162.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 5.3 mt -57.85 -50.48 73.16 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 125.281 1.432 . . . . 1.27 112.759 170.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -75.12 -21.96 58.51 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.411 1.46 . . . . 3.13 114.139 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 1.5 mppt? -85.02 -49.43 8.3 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.895 1.278 . . . . 2.6 110.068 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -74.27 -74.23 0.2 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.092 0.957 . . . . 3.85 111.442 172.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 10.7 mt -75.11 33.61 0.1 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.946 1.699 . . . . 2.56 113.214 -173.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -59.01 -23.03 61.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.641 1.576 . . . . 1.51 113.286 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -79.34 -61.42 2.01 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.226 0.921 . . . . 1.63 110.687 -177.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 ptp -63.14 -26.73 68.95 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.564 1.075 . . . . 3.22 113.848 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.08 -62.25 1.46 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.433 0.561 . . . . 3.24 109.696 167.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 32.3 m 56.75 -82.13 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.894 1.678 . . . . 4.64 111.995 -169.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -85.22 161.65 19.5 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.368 1.867 . . . . 3.9 113.779 -170.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 44.0 m -70.8 -25.58 62.93 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 125.684 1.594 . . . . 2.92 112.164 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -59.01 -52.62 52.31 Favored Glycine 0 N--CA 1.469 0.889 0 C-N-CA 126.204 1.859 . . . . 1.71 112.345 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -60.34 -30.75 69.73 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.208 -0.584 . . . . 3.63 112.101 172.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -77.61 -15.85 58.96 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 120.915 -1.116 . . . . 6.14 113.878 171.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -65.54 -35.55 81.19 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 119.165 -2.209 . . . . 3.9 111.192 169.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.61 -19.23 36.87 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 114.901 1.445 . . . . 1.01 114.901 164.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.69 -54.0 6.28 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.632 1.106 . . . . 0.9 111.151 166.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -57.57 -40.41 78.91 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.487 1.115 . . . . 2.71 113.468 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -52.9 -32.71 46.68 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.897 0.879 . . . . 3.22 112.456 178.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 39.7 mt -77.98 -45.14 24.65 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 118.708 -0.663 . . . . 0.74 110.543 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.81 -47.83 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.36 -0.829 . . . . 0.8 109.575 -177.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -66.84 -32.38 73.62 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.961 1.097 . . . . 1.76 113.961 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -69.22 -35.71 76.47 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.555 -0.716 . . . . 3.75 112.003 171.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -74.28 -28.54 61.24 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.829 1.252 . . . . 2.65 111.943 173.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -63.73 -21.48 66.42 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.095 1.758 . . . . 3.48 113.266 175.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.57 -9.42 59.78 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.701 1.371 . . . . 1.95 114.701 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -136.34 -35.02 0.76 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.104 1.89 . . . . 2.37 116.104 -166.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -109.54 108.1 18.44 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.47 -1.394 . . . . 3.91 111.469 -174.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -121.04 156.32 32.45 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.32 1.448 . . . . 5.14 110.309 161.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 64.91 -5.13 1.33 Allowed Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.647 1.594 . . . . 3.16 116.615 169.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 21.8 mmt85 -144.88 152.73 40.69 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 126.902 2.081 . . . . 5.11 111.214 -165.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 32.7 mm -122.01 150.18 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.528 1.531 . . . . 2.32 107.44 156.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.3 t -108.03 157.97 17.79 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.632 0.773 . . . . 1.58 112.226 169.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -60.01 -50.86 72.06 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 121.109 -0.995 . . . . 2.31 111.353 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -61.7 -16.24 47.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.796 1.238 . . . . 3.39 112.637 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -64.2 -55.25 22.98 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.115 0.966 . . . . 2.97 112.188 -175.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -57.22 -44.17 83.48 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.185 -1.572 . . . . 2.06 111.848 175.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -64.01 -48.04 77.92 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 119.258 -0.401 . . . . 0.7 112.031 -177.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 40.3 p -62.42 -44.52 96.22 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.659 1.184 . . . . 2.68 111.286 175.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.455 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 93.8 mt -62.91 -38.8 92.42 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 118.164 -0.922 . . . . 0.7 112.599 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 23.2 mm -54.36 -46.18 69.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 CA-C-N 120.514 1.506 . . . . 0.89 111.389 174.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.46 -29.1 72.4 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 118.569 0.622 . . . . 0.77 113.035 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.69 -22.49 78.68 Favored Glycine 0 CA--C 1.535 1.304 0 CA-C-O 118.651 -1.083 . . . . 0.6 114.264 178.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.6 mp -87.29 -48.67 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 CA-C-N 119.132 1.466 . . . . 0.94 109.879 162.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 2.6 m -75.38 33.62 0.11 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 127.209 2.204 . . . . 1.68 111.913 -169.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -88.95 -87.17 1.24 Allowed Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.54 1.067 . . . . 0.98 110.758 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.78 -34.29 62.08 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.799 2.333 . . . . 1.45 111.954 -175.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.29 -20.98 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 118.703 -0.665 . . . . 1.17 112.764 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.01 87.71 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 120.159 1.345 . . . . 1.0 112.911 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.37 -36.83 83.5 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 120.825 -1.172 . . . . 3.32 110.231 177.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -46.68 88.54 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.751 1.221 . . . . 1.49 111.886 173.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 77.8 mt -50.61 -59.35 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.9 0.88 . . . . 1.18 110.515 171.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -65.02 -35.95 82.83 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.935 -0.478 . . . . 1.85 112.269 -175.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.264 4.3 pt-20 -77.08 -15.89 59.41 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 117.951 -1.024 . . . . 3.28 112.139 177.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -81.12 -32.04 33.98 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.944 1.697 . . . . 2.4 114.392 168.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -73.47 5.04 4.07 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 123.212 1.482 . . . . 2.31 112.177 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -134.29 -61.46 0.78 Allowed 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 126.644 1.977 . . . . 2.6 111.24 -174.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.919 0 C-N-CA 129.202 3.001 . . . . 4.32 115.729 163.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 120.989 0.423 . . . . 2.57 112.029 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 47.3 p -81.23 155.41 26.13 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 121.323 -0.861 . . . . 1.3 109.792 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -61.21 -35.44 77.2 Favored 'General case' 0 C--O 1.223 -0.307 0 O-C-N 120.556 -1.34 . . . . 2.13 111.641 -177.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -49.56 76.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.507 1.523 . . . . 0.91 110.9 174.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -69.0 -53.06 22.55 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.217 1.807 . . . . 2.74 111.27 -177.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.07 -34.82 45.42 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.256 1.022 . . . . 5.48 110.356 169.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.832 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -77.04 -39.28 50.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 117.343 -1.313 . . . . 0.46 112.992 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.7 t -52.72 -45.28 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 121.111 1.778 . . . . 0.61 110.719 164.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.06 -50.55 77.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.124 0.874 . . . . 0.79 111.148 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.9 t -60.07 -34.95 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.63 1.172 . . . . 0.53 112.702 176.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 mp -72.09 -43.03 65.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.8 1.182 . . . . 0.94 110.967 174.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.3 t -58.6 -45.7 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 125.456 1.503 . . . . 0.57 110.99 173.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.3 tm-20 -67.01 -45.76 76.57 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.867 1.267 . . . . 2.9 111.12 174.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.429 ' HA ' ' HD2' ' A' ' 21' ' ' LYS 0.285 1.5 t30 -71.1 -7.32 45.69 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 115.143 1.534 . . . . 2.83 115.143 179.244 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -82.82 -66.79 0.85 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.547 0.739 . . . . 2.24 111.892 153.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -59.73 -32.8 70.88 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.266 1.21 . . . . 2.11 114.266 -167.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.429 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 10.0 ptmt -54.76 -25.88 30.68 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 119.723 -1.861 . . . . 2.5 113.756 175.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -82.66 -1.36 50.88 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.719 1.377 . . . . 2.79 114.719 178.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.476 0.836 0 CA-C-N 119.84 1.2 . . . . 3.85 109.808 170.016 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.4 tt . . . . . 0 CA--C 1.548 0.878 0 N-CA-C 109.374 -0.602 . . . . 2.8 109.374 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.1 t -102.43 141.98 34.37 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.916 -1.115 . . . . 3.24 109.526 164.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 73.4 mttt -61.24 -17.8 55.18 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.054 -1.654 . . . . 2.22 113.026 174.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.3 t -61.4 -33.2 73.28 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.466 -0.771 . . . . 3.86 112.578 166.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -65.02 -37.5 87.83 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 120.878 -1.138 . . . . 1.64 113.185 -173.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.497 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 67.8 t80 -62.15 -54.75 36.61 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.887 1.221 . . . . 2.04 111.899 176.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 24.7 ptt180 -65.64 -5.91 9.71 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.203 1.001 . . . . 2.22 113.187 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.414 ' HB3' ' HE2' ' A' ' 44' ' ' LYS . 6.5 mt-10 -102.27 -43.1 5.8 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 126.657 1.983 . . . . 2.82 111.851 176.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 4.9 ttm -52.65 -43.29 65.4 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.766 1.27 . . . . 1.89 109.968 168.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.497 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 72.1 mt -74.72 11.92 0.94 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 127.889 2.476 . . . . 2.22 115.402 169.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -125.74 -11.38 6.67 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 125.7 1.6 . . . . 2.95 113.023 166.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.414 ' HE2' ' HB3' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -109.0 -76.48 0.61 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.278 1.431 . . . . 1.82 110.983 176.51 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.47 -19.67 66.03 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 120.624 1.557 . . . . 3.1 115.026 -175.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.34 7.02 22.82 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.427 1.269 . . . . 1.82 114.427 177.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -50.32 -33.9 21.82 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 117.615 2.45 . . . . 2.07 117.615 -165.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -68.47 -25.12 64.82 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 121.102 1.773 . . . . 3.38 112.214 -177.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.2 tpp -73.12 -7.44 51.37 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.673 1.989 . . . . 1.75 113.144 175.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.28 21.98 4.81 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.91 1.684 . . . . 3.69 114.317 -162.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.5 t -35.31 -63.45 0.34 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 126.132 1.773 . . . . 4.47 112.426 164.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -81.53 95.97 7.29 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 124.335 1.054 . . . . 6.14 108.167 -177.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.2 p -51.42 -18.12 0.95 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.563 1.945 . . . . 3.44 115.831 -168.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -58.02 -35.07 74.71 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.39 0.995 . . . . 1.72 112.63 171.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 74.1 m-80 -59.22 -38.41 79.87 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 117.83 0.815 . . . . 3.85 111.535 172.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.94 -27.15 49.27 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 114.498 1.296 . . . . 4.9 114.498 172.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -59.56 -37.01 77.32 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 119.546 -1.971 . . . . 3.18 110.971 167.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.3 -11.5 42.33 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.952 1.464 . . . . 1.12 114.952 169.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.69 -52.03 6.38 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 120.502 1.501 . . . . 0.66 112.173 164.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.94 -35.32 76.42 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 118.951 0.796 . . . . 2.31 112.268 -176.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -24.67 67.73 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.892 1.071 . . . . 4.61 113.892 177.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.6 mt -73.98 -34.66 64.3 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 122.662 0.385 . . . . 0.77 111.067 176.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 37.8 mm -58.27 -50.36 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.064 0.946 . . . . 1.01 110.982 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.36 -38.18 89.29 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.016 0.926 . . . . 2.22 112.645 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.38 -41.51 76.34 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.845 0.858 . . . . 3.02 112.12 166.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -73.16 -40.97 64.41 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 123.437 0.695 . . . . 3.1 111.449 -178.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -49.57 -41.99 43.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.893 1.277 . . . . 2.56 112.723 175.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.82 -16.93 62.5 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.322 1.601 . . . . 2.16 115.322 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -133.68 16.04 3.97 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.505 1.298 . . . . 3.8 114.505 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -119.48 107.05 12.84 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.897 1.279 . . . . 5.07 110.97 -174.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -73.63 0.23 13.38 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.467 1.907 . . . . 5.54 114.223 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.59 -2.43 57.31 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 117.785 -1.564 . . . . 2.82 113.54 -167.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.532 ' HG2' HH11 ' A' ' 73' ' ' ARG . 0.0 OUTLIER -70.89 77.03 0.64 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.134 1.967 . . . . 5.25 109.804 164.306 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -55.46 125.79 11.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 107.763 -1.199 . . . . 3.17 107.763 164.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 36.9 t -137.31 146.19 44.34 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 124.792 1.237 . . . . 1.82 111.594 -170.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -53.09 -41.6 65.09 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.95 1.093 . . . . 2.18 113.95 -171.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -76.62 -14.46 59.98 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.837 0.681 . . . . 4.29 112.837 -174.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -64.84 -49.31 71.1 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.146 -0.971 . . . . 2.98 109.453 172.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -53.68 -48.18 69.73 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.261 -1.524 . . . . 2.05 111.929 171.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 30.5 t-105 -68.97 -46.15 68.85 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.843 0.683 . . . . 0.56 112.843 -171.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 57.5 p -59.73 -45.91 90.73 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.994 0.918 . . . . 2.5 111.027 171.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 91.6 mt -62.19 -38.46 89.21 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 117.31 -1.329 . . . . 0.6 112.323 -179.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.4 mm -50.61 -44.02 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 121.294 1.861 . . . . 0.66 111.261 174.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.11 -22.25 72.37 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 125.194 1.378 . . . . 0.57 114.308 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.14 -20.0 70.66 Favored Glycine 0 CA--C 1.532 1.123 0 CA-C-N 118.362 1.081 . . . . 0.6 113.193 173.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.5 mp -102.84 -45.49 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.768 1.227 . . . . 1.05 110.947 163.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.0 m -80.88 72.45 7.88 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 127.108 2.163 . . . . 1.48 108.635 -176.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -158.92 -71.23 0.02 OUTLIER Glycine 0 CA--C 1.525 0.664 0 C-N-CA 127.467 2.461 . . . . 0.9 109.052 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -55.77 -55.63 2.84 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.187 2.591 . . . . 1.11 111.64 170.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.8 pt -74.27 -17.33 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 N-CA-C 114.361 1.245 . . . . 1.01 114.361 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.74 -48.06 82.43 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.91 0.777 . . . . 1.08 112.435 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.69 -47.65 76.43 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.217 -0.927 . . . . 2.95 111.804 169.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.4 tt -57.01 -45.35 83.13 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-O 117.722 -1.132 . . . . 1.69 111.403 -178.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.9 mt -46.32 -55.28 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 120.009 1.277 . . . . 0.88 111.005 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -61.73 -49.98 74.25 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.296 0.638 . . . . 1.81 111.305 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -61.9 -36.58 81.73 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.891 0.876 . . . . 3.68 111.434 -178.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -68.13 -44.6 75.73 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 127.896 2.478 . . . . 2.19 111.314 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -68.2 -21.86 64.84 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.31 1.414 . . . . 3.33 111.714 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.604 0 C-N-CA 123.535 0.734 . . . . 2.24 111.191 172.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 . . . . . 0 N--CA 1.483 1.213 0 N-CA-C 114.039 1.126 . . . . 2.35 114.039 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.1 p -81.83 155.23 25.49 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.866 -1.146 . . . . 1.34 109.754 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -61.05 -36.51 79.79 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 120.728 1.604 . . . . 2.36 111.752 -178.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -47.86 84.43 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.615 1.166 . . . . 0.91 110.34 176.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -68.15 -54.1 20.41 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.314 1.446 . . . . 2.98 111.645 -177.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -33.91 66.6 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.517 1.127 . . . . 4.54 109.96 172.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.832 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.96 -45.33 67.63 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 117.199 -1.381 . . . . 0.54 112.201 173.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 22.5 t -53.78 -41.27 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-N 121.154 1.797 . . . . 0.68 110.625 170.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 70.3 mt -58.48 -54.47 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.405 -0.807 . . . . 0.98 112.172 169.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.4 t -58.34 -42.88 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 119.405 1.002 . . . . 0.69 112.103 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.5 mp -64.87 -47.1 79.1 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.796 1.238 . . . . 1.2 111.469 176.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.9 t -57.65 -48.22 83.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 123.292 0.637 . . . . 0.7 110.514 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -62.89 -34.18 76.86 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.532 1.133 . . . . 2.87 111.738 175.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.0 -25.24 64.41 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.596 1.544 . . . . 2.65 113.465 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -72.63 -52.86 13.62 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.566 -0.708 . . . . 2.0 111.0 165.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -65.9 -43.59 87.74 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.545 -0.722 . . . . 2.14 112.923 -173.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 7.9 ptmt -58.01 -16.58 13.08 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 120.274 -1.516 . . . . 3.43 114.941 177.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -89.61 -4.25 57.9 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.737 1.384 . . . . 3.25 114.737 173.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.482 1.167 0 CA-C-N 120.593 1.542 . . . . 3.9 111.188 173.099 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 16.6 tt . . . . . 0 CA--C 1.545 0.776 0 N-CA-C 106.991 -1.485 . . . . 2.95 106.991 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 29.6 t -100.18 144.56 29.06 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 120.735 -1.228 . . . . 3.06 109.559 161.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -58.16 -21.64 47.91 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.572 -1.33 . . . . 2.09 112.766 171.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 5.1 t -63.43 -34.46 77.8 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.756 0.65 . . . . 3.68 112.756 170.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 14.7 m -63.17 -42.66 99.44 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 120.942 -1.099 . . . . 1.78 112.05 -175.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.463 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 65.4 t80 -51.33 -60.28 3.3 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.174 0.99 . . . . 2.09 112.061 171.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.1 ptt180 -65.18 -14.7 61.24 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.604 0.964 . . . . 2.3 113.604 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . 0.445 ' HB3' ' HE2' ' B' ' 147' ' ' LYS . 7.6 mt-10 -94.21 -40.91 9.76 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 126.467 1.907 . . . . 2.84 113.398 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.3 tmm? -59.77 -39.44 84.86 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.342 -0.614 . . . . 2.31 109.342 167.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . 0.436 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 94.5 mt -66.76 9.15 0.2 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.275 2.23 . . . . 2.83 115.352 164.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -128.6 -21.84 3.39 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.465 1.283 . . . . 3.08 114.465 168.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' B' ' 143' ' ' GLU . 0.0 OUTLIER -108.19 -42.44 4.63 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.758 1.223 . . . . 1.81 113.56 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -106.77 -26.07 11.45 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.723 2.009 . . . . 2.77 112.67 -163.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.93 18.8 20.84 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.881 1.672 . . . . 1.85 111.996 167.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -59.5 -35.46 74.18 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 116.04 1.867 . . . . 2.36 116.04 -159.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -60.95 -45.48 94.55 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 120.002 1.273 . . . . 3.2 111.159 -178.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 tpp -59.8 -17.03 32.6 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.042 1.737 . . . . 1.79 113.174 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.07 26.25 9.78 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.836 2.055 . . . . 3.98 112.686 -174.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 43.4 t -64.85 -16.69 63.48 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.161 1.541 . . . . 4.65 115.161 177.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -100.98 125.41 47.58 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 120.019 1.281 . . . . 5.09 108.354 161.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 58.0 p -64.43 -21.51 66.67 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.802 1.038 . . . . 3.28 113.802 -173.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -61.64 -37.1 93.66 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-N 119.646 1.112 . . . . 1.91 111.89 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -62.66 -38.71 91.41 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 119.01 -0.519 . . . . 4.03 111.688 174.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -77.19 -27.45 53.6 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 119.739 1.154 . . . . 4.69 114.018 173.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -57.68 -40.29 79.07 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 119.601 -1.937 . . . . 3.37 111.473 166.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.06 -12.9 43.06 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.31 1.596 . . . . 1.31 115.31 170.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.53 -50.04 8.65 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 120.368 1.44 . . . . 0.81 112.337 165.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.55 -35.1 76.81 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.617 0.644 . . . . 2.16 112.173 -177.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.8 -23.11 67.08 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 114.13 1.159 . . . . 4.64 114.13 176.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 22.1 mt -74.13 -33.85 63.69 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 122.579 0.352 . . . . 0.81 111.46 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 29.1 mm -59.71 -50.08 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 124.349 1.06 . . . . 0.9 110.527 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -65.52 -36.04 82.65 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.471 0.653 . . . . 2.1 112.671 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -57.14 -43.46 82.47 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.672 0.789 . . . . 3.15 112.232 165.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 4.9 tp -69.79 -42.23 74.02 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 118.485 0.584 . . . . 3.16 111.287 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -51.5 -40.83 60.33 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.196 1.398 . . . . 2.67 112.173 174.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.46 -15.25 62.44 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.914 1.82 . . . . 2.1 115.914 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -135.08 14.71 3.55 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 115.199 1.555 . . . . 3.81 115.199 -175.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -122.68 110.0 14.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.934 1.294 . . . . 5.07 110.908 -171.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -73.47 -27.04 61.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.876 2.07 . . . . 5.46 113.634 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 125.36 -8.33 7.91 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-O 117.953 -1.471 . . . . 2.88 113.728 -169.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -68.51 76.7 0.28 Allowed 'General case' 0 C--N 1.346 0.421 0 CA-C-N 120.411 2.106 . . . . 7.53 109.522 157.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.73 137.4 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 107.922 -1.14 . . . . 3.48 107.922 164.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 16.9 t -142.24 147.25 36.18 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.623 0.601 . . . . 1.92 112.623 -173.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -48.9 -48.53 42.38 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.793 1.237 . . . . 2.12 113.751 -172.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -74.36 -12.71 60.6 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 113.636 0.976 . . . . 4.39 113.636 -174.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -60.96 -51.45 69.21 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.135 -0.978 . . . . 3.06 109.399 171.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -52.29 -49.13 64.75 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.746 -1.221 . . . . 1.98 112.494 172.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 26.7 t-105 -69.1 -45.13 71.02 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 118.576 -0.726 . . . . 0.66 112.457 -172.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 46.3 p -59.34 -45.36 91.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.458 1.103 . . . . 2.56 110.808 170.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.463 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 58.7 mt -59.06 -40.91 86.61 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 117.36 -1.305 . . . . 0.53 112.584 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 22.5 mm -53.69 -40.8 44.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 121.382 1.901 . . . . 0.61 112.074 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -65.18 -25.84 71.25 Favored Glycine 0 N--CA 1.473 1.107 0 C-N-CA 124.407 1.004 . . . . 0.56 113.545 177.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -62.25 -19.68 59.86 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 118.391 1.095 . . . . 0.72 113.986 173.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.2 mp -110.27 -36.78 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 CA-C-N 118.449 1.125 . . . . 1.18 111.733 166.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 22.7 m -82.32 73.79 9.33 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 125.948 1.699 . . . . 1.52 108.04 -178.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -161.85 -67.78 0.02 OUTLIER Glycine 0 CA--C 1.529 0.947 0 C-N-CA 127.283 2.373 . . . . 0.79 110.026 -175.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -58.27 -61.28 0.28 Allowed 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.307 2.671 . . . . 0.96 111.178 168.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.9 pt -66.48 -28.09 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 CA-C-N 119.242 0.928 . . . . 1.18 112.975 177.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . 0.445 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -56.57 -46.01 80.98 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.889 0.768 . . . . 1.05 112.826 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -65.98 -30.17 70.69 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.171 -0.955 . . . . 4.77 113.488 172.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 35.4 mt -68.14 -41.02 82.26 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.589 1.086 . . . . 4.86 111.943 176.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . 0.445 HD12 ' HA ' ' B' ' 194' ' ' ALA . 70.5 mt -53.53 -42.88 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 119.278 0.944 . . . . 1.12 110.805 171.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -61.98 -47.77 83.33 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 117.835 -1.078 . . . . 2.11 111.93 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -52.57 -49.32 65.2 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.368 1.067 . . . . 3.47 110.666 171.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -46.52 66.55 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.036 1.334 . . . . 4.52 112.761 -177.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -77.8 -4.7 47.78 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.614 0.643 . . . . 2.7 112.527 -177.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -98.82 -49.04 4.7 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.061 0.945 . . . . 3.32 111.261 170.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 CA--C 1.535 0.377 0 C-N-CA 128.019 2.527 . . . . 5.64 112.967 179.913 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.408 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 5.3 m-30 . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 118.652 -0.69 . . . . 2.44 111.916 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.9 p -61.84 156.58 20.27 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 118.967 0.803 . . . . 1.15 110.403 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -63.19 -27.78 69.6 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.047 0.758 . . . . 2.16 113.047 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt -69.36 -47.87 63.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.728 1.211 . . . . 1.32 109.984 172.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -49.74 62.8 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 122.837 0.455 . . . . 2.55 111.367 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.94 -36.49 17.48 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.729 1.612 . . . . 5.53 111.124 172.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.19 -21.33 56.6 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.184 -1.572 . . . . 0.68 113.716 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.1 t -60.89 -38.03 78.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 CA-C-N 121.143 1.792 . . . . 1.22 110.066 169.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.5 mt -56.7 -56.95 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-O 118.825 -0.607 . . . . 1.12 109.967 168.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 99.5 t -54.34 -40.28 47.66 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 124.642 1.177 . . . . 0.72 112.933 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -72.62 -39.02 67.6 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.268 -0.895 . . . . 1.09 112.432 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.1 t -64.55 -40.41 88.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.067 0.947 . . . . 0.81 111.53 172.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -55.15 -54.21 46.16 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.38 1.072 . . . . 2.69 110.094 174.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -56.48 -30.16 62.6 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 115.479 1.659 . . . . 3.25 115.479 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -73.59 -57.85 3.71 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.532 0.606 . . . . 2.35 112.171 173.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -68.38 -17.33 64.21 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.311 1.226 . . . . 1.82 114.311 -171.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -44.27 -32.64 1.34 Allowed 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 120.546 1.521 . . . . 2.92 113.215 171.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -93.4 8.02 42.17 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.07 1.748 . . . . 2.34 114.033 -174.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.476 0.863 0 C-N-CA 125.398 1.479 . . . . 2.3 110.27 172.363 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 12.0 pt . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 120.269 0.08 . . . . 2.94 111.085 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.4 t -76.41 138.63 40.5 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 120.504 -1.372 . . . . 3.44 111.954 177.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.9 mtpt -72.51 -6.74 45.96 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.098 -0.955 . . . . 3.28 113.309 169.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.1 p -80.3 -48.31 13.2 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.294 0.952 . . . . 3.09 111.056 156.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.6 m -59.06 -35.6 73.61 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 117.234 -1.365 . . . . 1.28 113.751 -167.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -60.16 -60.38 3.91 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 121.058 1.754 . . . . 2.38 112.07 172.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -63.78 -23.87 67.54 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.872 0.693 . . . . 2.79 112.872 -178.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -71.45 -49.0 45.77 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.121 1.368 . . . . 3.23 112.774 169.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 8.4 tmm? -59.37 -35.88 74.73 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 126.125 1.77 . . . . 1.37 111.804 -174.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.2 mt -59.07 -20.24 51.58 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.679 1.592 . . . . 1.24 114.695 168.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -1.15 18.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.789 1.177 . . . . 2.79 113.228 175.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.62 -37.14 7.23 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.144 1.378 . . . . 1.86 112.839 172.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -96.79 -72.2 0.65 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.93 1.692 . . . . 4.5 109.637 169.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.95 20.7 0.06 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 125.944 1.698 . . . . 1.5 114.769 -171.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -66.63 -23.01 66.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 128.964 2.906 . . . . 1.45 116.2 -164.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.494 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 0.3 OUTLIER -76.42 -54.84 6.16 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.417 1.008 . . . . 1.49 109.608 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.4 tpp -47.7 -42.91 26.07 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.485 2.314 . . . . 1.79 113.797 162.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -109.22 34.72 3.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.729 1.212 . . . . 4.02 113.076 -175.262 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.4 p -62.88 -39.49 94.63 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 114.942 -1.026 . . . . 5.64 110.942 167.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -68.98 137.43 53.72 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.286 1.434 . . . . 4.68 112.991 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.8 m -69.35 -32.79 72.08 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.954 1.701 . . . . 2.33 112.327 175.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.85 -50.53 57.82 Favored Glycine 0 N--CA 1.47 0.922 0 CA-C-N 119.568 1.076 . . . . 1.56 111.963 178.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -59.4 -29.29 67.63 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.971 -0.723 . . . . 3.36 112.35 172.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -80.02 -31.85 39.59 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.679 0.992 . . . . 5.85 113.679 174.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 mmmt -60.67 -35.88 77.34 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 119.249 -2.157 . . . . 3.7 111.872 169.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.88 -29.89 56.73 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 117.25 -1.357 . . . . 1.04 114.076 167.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.65 -41.32 79.53 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 120.514 1.506 . . . . 0.79 113.157 167.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -63.38 -35.31 79.99 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 125.845 1.658 . . . . 3.46 112.606 -177.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -47.82 -43.04 27.64 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.628 1.171 . . . . 3.27 112.835 168.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.487 ' HB3' HD22 ' A' ' 82' ' ' LEU . 16.4 mt -70.12 -38.48 75.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.601 -1.182 . . . . 1.01 110.35 -174.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.3 mm -63.89 -42.12 94.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 122.988 0.515 . . . . 0.87 111.518 -176.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -72.13 -37.4 69.46 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 123.319 0.648 . . . . 1.97 111.583 176.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -67.16 -30.68 70.72 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.183 -0.948 . . . . 3.6 112.383 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.444 HD22 HD11 ' A' ' 82' ' ' LEU . 28.2 tp -69.14 -24.3 64.07 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 120.895 -1.128 . . . . 3.5 112.394 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.51 -25.96 28.7 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.143 1.777 . . . . 4.89 113.731 171.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -85.47 -4.43 59.16 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.817 1.414 . . . . 3.77 114.817 174.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -127.59 -30.22 2.58 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 114.372 1.249 . . . . 3.94 114.372 -171.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -90.97 57.97 3.65 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.943 1.297 . . . . 5.72 112.528 -163.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -87.47 84.23 7.18 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.361 1.065 . . . . 5.68 111.543 177.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 74.0 -28.6 0.95 Allowed Glycine 0 N--CA 1.476 1.309 0 C-N-CA 125.831 1.681 . . . . 4.14 115.863 167.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 -89.14 152.15 21.79 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 126.229 1.812 . . . . 7.45 110.329 169.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.4 mp -127.39 138.48 54.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 106.0 -1.852 . . . . 4.27 106.0 170.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.0 152.28 20.38 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.579 0.228 . . . . 2.25 111.219 173.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -61.62 -48.67 79.84 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 123.408 1.575 . . . . 2.13 109.558 167.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.2 -16.5 64.34 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.95 2.9 . . . . 2.9 114.308 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.2 tt0 -59.85 -55.04 39.07 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.444 1.498 . . . . 2.92 110.256 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -59.49 -38.3 80.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.367 -0.833 . . . . 2.45 111.813 177.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 22.2 t-105 -61.96 -49.98 73.94 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 118.818 -0.611 . . . . 0.57 111.084 177.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.3 t -71.63 -15.6 62.25 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 113.924 1.083 . . . . 1.87 113.924 176.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.487 HD22 ' HB3' ' A' ' 62' ' ' LEU . 89.3 mt -74.34 -47.53 33.81 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 120.009 1.277 . . . . 0.76 111.861 164.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.8 mm -51.31 -40.66 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-N 120.895 1.679 . . . . 0.78 113.77 -174.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.11 -22.62 60.81 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 118.767 0.712 . . . . 0.72 113.641 177.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.41 -16.76 80.43 Favored Glycine 0 CA--C 1.534 1.234 0 O-C-N 121.181 -1.187 . . . . 0.59 113.882 175.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.8 mp -95.62 -46.36 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 CA-C-N 118.382 1.091 . . . . 0.79 110.871 161.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 28.8 m -84.78 83.55 8.0 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 126.128 1.771 . . . . 1.27 108.54 -171.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -167.45 -64.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.961 0 C-N-CA 125.428 1.49 . . . . 1.17 111.932 -171.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -58.19 -53.17 4.5 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.2 2.6 . . . . 1.47 111.293 165.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.9 pt -61.22 -24.61 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 113.115 0.783 . . . . 1.85 113.115 174.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.39 -53.42 52.64 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.412 1.006 . . . . 1.0 112.389 -175.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -61.08 -34.17 74.51 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.621 -1.299 . . . . 2.99 112.662 175.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.6 tt -66.24 -44.47 83.67 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.211 1.004 . . . . 1.29 111.23 -178.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 56.0 mt -49.32 -59.91 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.63 0.772 . . . . 1.06 109.734 166.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -61.95 -28.52 69.6 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.014 -1.054 . . . . 1.94 113.409 -173.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.348 3.2 pt-20 -87.21 -11.43 49.84 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 121.277 -0.89 . . . . 3.14 113.095 175.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.448 ' C ' ' H ' ' A' ' 99' ' ' GLN . 0.6 OUTLIER -81.86 -40.73 22.02 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.433 1.893 . . . . 2.19 113.935 169.553 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -66.43 7.66 0.31 Allowed 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 123.501 1.62 . . . . 2.45 112.889 174.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . 0.448 ' H ' ' C ' ' A' ' 97' ' ' GLN . 16.0 mm-40 . . . . . 0 C--N 1.326 -0.426 0 C-N-CA 126.891 2.076 . . . . 1.89 109.704 -175.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 5.9 m-30 . . . . . 0 N--CA 1.479 0.992 0 N-CA-C 112.237 0.458 . . . . 2.45 112.237 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 5.4 p -65.52 166.78 9.85 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 118.436 0.562 . . . . 1.16 111.878 -176.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -62.19 -37.9 87.07 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.379 -0.826 . . . . 2.93 111.957 173.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.38 -51.49 65.66 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.278 0.631 . . . . 1.06 109.724 173.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.79 -54.8 10.29 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.26 -0.274 . . . . 2.47 110.26 -169.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . 0.257 0.7 OUTLIER -60.49 -23.41 64.48 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 122.057 -0.402 . . . . 4.62 111.621 177.06 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.24 -25.03 61.47 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 119.34 -2.1 . . . . 1.05 114.324 169.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 34.3 t -61.58 -35.38 66.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 121.297 1.862 . . . . 1.05 110.879 170.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 71.2 mt -54.52 -55.8 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 121.383 -0.823 . . . . 1.08 110.713 165.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 78.9 t -56.26 -41.45 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.951 1.3 . . . . 0.84 112.474 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.71 -38.77 87.41 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.369 0.668 . . . . 1.19 112.287 176.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 71.7 t -71.39 -39.32 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.709 0.804 . . . . 0.91 111.494 177.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -51.04 -55.89 15.24 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.726 1.21 . . . . 2.71 109.605 171.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -50.52 -40.77 52.43 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.9 1.444 . . . . 3.35 114.9 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -66.44 -57.53 7.18 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.705 0.684 . . . . 2.39 111.79 178.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -66.05 -20.52 66.2 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.617 0.969 . . . . 1.84 113.617 -171.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -45.88 -32.68 2.77 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 120.216 1.371 . . . . 3.08 113.526 170.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -93.89 8.37 41.51 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.242 1.417 . . . . 2.14 113.916 -174.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.0 m . . . . . 0 N--CA 1.479 1.02 0 C-N-CA 125.742 1.617 . . . . 2.29 110.033 169.797 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 22.0 pt . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 108.441 -0.948 . . . . 2.76 108.441 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 30.3 t -73.18 138.14 45.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 117.637 -1.625 . . . . 2.91 111.209 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mtpt -63.94 -13.93 49.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.641 0.776 . . . . 3.33 112.934 167.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 97.2 p -77.38 -27.73 52.6 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.02 -1.05 . . . . 2.46 113.233 163.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.3 m -78.55 -39.56 37.44 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.937 1.244 . . . . 1.17 113.118 -173.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.444 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 64.5 t80 -55.51 -55.9 26.47 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 120.366 1.439 . . . . 2.26 111.727 -177.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -55.49 -19.45 9.71 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.402 1.481 . . . . 2.51 113.805 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . 0.404 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 23.4 mt-10 -100.36 -46.23 5.32 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 125.332 1.453 . . . . 3.25 112.496 -174.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -51.15 -41.95 60.47 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.944 1.297 . . . . 1.19 110.646 165.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.8 mt -59.82 -17.25 34.62 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 116.098 1.888 . . . . 1.08 116.098 168.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -114.77 -5.0 12.65 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 120.679 1.581 . . . . 2.67 113.955 174.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . 0.404 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 1.3 mppt? -107.18 -36.02 6.67 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.605 1.562 . . . . 3.02 113.23 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -87.92 -72.65 0.52 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.307 1.443 . . . . 4.35 108.617 163.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.58 22.65 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.794 2.038 . . . . 1.57 114.918 -171.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -66.11 -25.67 67.1 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.376 2.67 . . . . 1.54 116.622 -166.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . 0.549 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 0.6 OUTLIER -73.17 -55.87 5.87 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.936 1.244 . . . . 1.51 109.805 -177.639 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 27.2 tpp -47.77 -49.79 27.5 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.704 2.002 . . . . 1.99 112.891 163.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 1.4 mt -99.7 35.37 2.02 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.667 1.187 . . . . 4.02 113.147 -174.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 13.5 p -65.51 -36.77 84.82 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.785 -1.098 . . . . 5.36 111.183 167.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -71.89 135.7 46.64 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.102 1.361 . . . . 4.96 113.062 174.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 96.9 m -67.07 -33.15 74.88 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.877 1.671 . . . . 2.49 112.533 174.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -64.29 -52.56 42.84 Favored Glycine 0 N--CA 1.471 0.992 0 CA-C-N 119.98 1.264 . . . . 1.66 112.152 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -58.4 -29.87 66.39 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.013 0.925 . . . . 3.54 112.446 173.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 57.7 mtm-85 -78.64 -31.52 46.9 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.779 1.4 . . . . 6.06 114.779 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -60.93 -37.09 81.11 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 119.879 -1.763 . . . . 3.85 111.68 168.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -53.22 -32.14 46.75 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-O 117.581 -1.2 . . . . 1.06 113.795 168.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.6 -44.42 74.36 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.869 1.268 . . . . 0.98 113.152 169.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -62.96 -36.32 83.08 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.754 2.022 . . . . 3.59 112.842 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -52.53 -36.21 55.05 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.916 -1.115 . . . . 2.96 112.336 171.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 9.8 mt -73.36 -36.14 66.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.949 -0.569 . . . . 1.04 111.247 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.0 mm -58.86 -44.8 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 123.797 0.839 . . . . 0.92 111.54 177.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -76.04 -33.11 59.62 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 123.168 0.587 . . . . 1.74 112.014 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -67.29 -32.4 73.36 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.341 -0.85 . . . . 3.52 112.364 170.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 22.2 tp -67.73 -23.85 65.31 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.014 -1.054 . . . . 3.38 112.123 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.2 -32.78 49.77 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.537 1.535 . . . . 5.03 113.843 170.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.09 -7.4 58.86 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.645 1.35 . . . . 3.76 114.645 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -127.31 -26.44 3.07 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 115.091 1.515 . . . . 3.7 115.091 -168.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 32.7 t60 -100.21 66.75 1.33 Allowed 'General case' 0 CA--C 1.548 0.889 0 O-C-N 120.885 -1.135 . . . . 5.29 112.817 -163.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -81.41 69.58 8.08 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.847 1.308 . . . . 5.85 111.898 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.96 -24.54 1.04 Allowed Glycine 0 CA--C 1.536 1.399 0 C-N-CA 125.858 1.694 . . . . 3.69 115.694 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 16.9 mmt85 -79.97 142.71 34.8 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.752 1.221 . . . . 7.29 110.494 169.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 3.4 mp -111.27 145.53 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 N-CA-C 106.547 -1.649 . . . . 4.57 106.547 165.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.79 150.74 25.28 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 122.907 0.483 . . . . 2.22 109.816 168.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -59.61 -49.6 77.13 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 123.569 1.652 . . . . 2.14 109.559 169.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.44 -16.91 26.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 129.821 3.248 . . . . 3.16 114.687 176.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -59.36 -57.51 12.67 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.243 1.417 . . . . 3.03 110.649 175.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -57.62 -40.2 78.61 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.444 -0.785 . . . . 2.37 112.331 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.9 t-105 -60.85 -51.47 69.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.229 -0.891 . . . . 0.67 111.351 174.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 7.1 t -69.43 -18.58 63.75 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.982 1.264 . . . . 1.65 113.701 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.444 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 97.3 mt -68.87 -51.27 42.12 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 120.092 1.314 . . . . 0.78 110.978 164.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 30.1 mm -52.0 -37.29 21.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 CA-C-N 121.035 1.743 . . . . 0.7 114.336 -173.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.33 -22.07 65.02 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 119.309 0.959 . . . . 0.67 114.238 175.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.79 -18.22 78.72 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 118.63 1.215 . . . . 0.7 113.527 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.2 mp -101.48 -41.54 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 118.385 1.093 . . . . 0.83 110.681 166.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 24.7 m -82.11 84.93 6.87 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.272 1.429 . . . . 1.37 108.84 -177.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -171.88 -66.17 0.04 OUTLIER Glycine 0 CA--C 1.528 0.896 0 CA-C-O 118.258 -1.301 . . . . 1.07 112.194 -170.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -58.36 -54.19 3.3 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.066 2.511 . . . . 1.39 110.95 167.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 35.5 pt -64.95 -21.04 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 113.387 0.884 . . . . 1.8 113.387 175.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.01 -55.91 24.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.493 1.042 . . . . 0.98 112.643 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -59.56 -34.21 72.4 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.518 -1.364 . . . . 3.12 112.558 175.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.3 tt -66.14 -43.58 86.66 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 124.126 0.97 . . . . 1.45 110.725 -177.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 48.4 mt -51.69 -58.26 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.97 0.908 . . . . 1.23 109.631 167.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 80.7 t60 -70.79 -5.57 31.22 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 114.668 1.358 . . . . 1.83 114.668 -173.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.339 3.5 pt-20 -104.01 -15.06 15.71 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.954 1.302 . . . . 3.06 112.842 167.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . 0.462 ' C ' ' H ' ' B' ' 202' ' ' GLN . 0.2 OUTLIER -80.08 -39.55 29.43 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 126.434 1.894 . . . . 2.17 114.674 169.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.06 10.34 0.11 Allowed 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 121.411 1.914 . . . . 2.51 112.977 171.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' B' ' 200' ' ' GLN . 2.3 mm-40 -126.29 -76.51 0.58 Allowed 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 127.241 2.216 . . . . 1.89 109.149 -178.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.988 0 C-N-CA 130.333 3.453 . . . . 4.17 116.72 169.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 113.94 1.089 . . . . 2.04 113.94 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 81.8 p -68.2 153.88 42.84 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.871 0.469 . . . . 1.03 110.661 -175.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.446 ' HG2' HG21 ' B' ' 117' ' ' VAL . 6.2 tp10 -52.58 -38.46 60.05 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.776 0.83 . . . . 2.57 111.355 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -42.77 99.77 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.362 1.865 . . . . 0.83 111.672 177.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -50.69 13.61 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 118.69 0.677 . . . . 2.8 111.607 -177.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -49.68 -34.82 19.59 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.237 1.015 . . . . 6.06 111.17 165.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.745 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.38 -40.63 77.31 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 116.821 -1.561 . . . . 0.58 114.229 171.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.4 t -53.76 -47.32 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 CA-C-N 121.438 1.926 . . . . 0.99 110.077 169.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.2 mt -52.46 -51.53 32.84 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 CA-C-N 118.556 0.617 . . . . 0.75 111.505 172.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 16.9 t -60.21 -47.67 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.421 1.088 . . . . 0.53 112.195 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 mp -57.92 -45.85 85.9 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.417 1.087 . . . . 0.9 111.022 175.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.9 t -59.22 -54.13 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 126.072 1.749 . . . . 0.7 111.792 -178.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 tp10 -71.22 -32.95 69.43 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.11 1.323 . . . . 5.04 112.234 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -67.72 -17.64 64.63 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 120.214 1.37 . . . . 2.59 113.432 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -80.26 -56.68 4.04 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.321 -0.862 . . . . 2.02 111.65 161.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.435 ' HB3' ' CE1' ' B' ' 198' ' ' HIS . 21.2 m-85 -59.67 -34.28 72.65 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.246 -0.883 . . . . 2.02 113.059 -169.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -47.6 -39.34 16.57 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.672 1.578 . . . . 2.9 113.949 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.476 ' CE2' ' HG3' ' A' ' 41' ' ' MET . 90.9 m-85 -82.61 -19.69 37.86 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 120.747 -1.221 . . . . 2.37 113.562 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 1.5 t . . . . . 0 CA--C 1.544 0.737 0 C-N-CA 126.283 1.833 . . . . 3.4 110.97 168.559 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.0 tt . . . . . 0 N--CA 1.477 0.883 0 CA-C-O 121.615 0.722 . . . . 3.75 110.539 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.9 m -113.61 138.27 50.41 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.12 -1.437 . . . . 3.28 107.12 168.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.503 ' HE2' ' OE2' ' A' ' 78' ' ' GLU . 15.2 mttp -76.64 -15.96 59.68 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.133 0.973 . . . . 3.38 110.633 -154.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.3 p -41.49 -27.86 0.11 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.238 1.815 . . . . 2.15 114.722 154.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.9 m -74.33 -44.27 53.14 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.19 0.996 . . . . 1.48 112.64 171.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -52.95 -50.47 63.97 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.152 1.381 . . . . 1.82 112.104 -172.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -54.35 -31.53 54.76 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.878 1.271 . . . . 3.31 113.397 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -95.56 -36.67 11.18 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 112.78 0.659 . . . . 4.11 112.78 -174.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . 0.476 ' HG3' ' CE2' ' A' ' 22' ' ' TYR . 11.8 tmm? -48.57 -47.77 39.36 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.487 0.715 . . . . 1.56 110.179 159.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.1 mt -54.48 -51.49 64.89 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.523 0.729 . . . . 1.05 112.685 173.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.41 -6.49 59.39 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.535 1.68 . . . . 3.0 115.535 -174.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.93 -37.33 9.44 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.63 1.172 . . . . 2.17 113.715 167.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -107.1 -21.85 12.84 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.006 1.322 . . . . 2.93 114.537 -167.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 64.3 mt -111.01 44.49 1.28 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.846 1.258 . . . . 2.38 109.843 162.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.6 p30 -66.76 -2.78 5.43 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 115.865 1.802 . . . . 1.53 115.865 -169.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.433 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -100.34 -48.77 4.47 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.648 1.979 . . . . 2.51 111.977 178.678 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 45.4 tpp -72.17 33.03 0.06 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.801 2.04 . . . . 2.3 112.816 175.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 tp -89.1 -36.05 15.95 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 127.014 2.126 . . . . 4.03 113.129 -157.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.96 28.13 17.09 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.733 0.813 . . . . 4.98 112.094 -175.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.5 t70 58.61 -77.53 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 129.043 2.937 . . . . 5.23 112.617 -170.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 50.9 m -132.26 -17.28 2.68 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 126.827 2.051 . . . . 2.29 111.334 -173.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -69.84 -65.37 2.58 Favored Glycine 0 N--CA 1.473 1.129 0 CA-C-N 120.566 1.53 . . . . 1.56 112.983 -170.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -59.7 -24.09 63.67 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.652 0.781 . . . . 3.78 112.83 172.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -79.89 -46.04 17.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.675 1.19 . . . . 5.02 113.736 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -58.28 -37.1 74.34 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.039 -1.663 . . . . 3.6 111.26 167.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.26 -46.17 79.78 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 117.45 -1.262 . . . . 1.81 112.0 168.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.34 -48.76 65.3 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.244 1.018 . . . . 0.79 112.386 170.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.37 -28.53 69.76 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 124.458 1.103 . . . . 2.59 113.319 -178.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -59.24 -38.22 79.47 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 120.446 -1.409 . . . . 3.54 112.196 173.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 mt -66.05 -35.35 80.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.308 -0.86 . . . . 0.88 110.953 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 20.0 mm -67.1 -50.11 66.94 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.253 0 C-N-CA 123.938 0.895 . . . . 1.02 110.973 -177.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -67.41 -24.91 65.71 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.234 1.014 . . . . 3.37 112.363 -178.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -67.71 -49.61 61.8 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 124.328 1.051 . . . . 3.06 113.795 164.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.408 HD12 ' HE2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -97.73 -34.0 11.08 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 120.461 -1.4 . . . . 2.51 114.674 -163.792 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -65.39 -14.43 60.86 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 119.888 -1.758 . . . . 4.58 112.861 169.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.25 -16.65 52.03 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.533 1.308 . . . . 3.62 114.533 167.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -128.44 -4.04 5.44 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.726 1.75 . . . . 3.73 115.726 -167.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -137.54 118.94 14.72 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 120.376 -1.453 . . . . 4.19 109.854 172.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -94.24 -108.03 0.13 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.485 1.514 . . . . 4.04 113.33 -163.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -89.03 15.44 57.98 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 128.09 2.757 . . . . 3.86 113.342 176.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.4 mmt-85 -126.38 147.57 49.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.816 1.646 . . . . 4.97 109.311 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.0 mm -142.8 141.35 27.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 125.337 1.455 . . . . 2.53 108.453 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.4 t -94.4 156.38 16.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.393 0.542 . . . . 2.34 112.059 169.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -58.98 -40.39 84.7 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.796 0.808 . . . . 1.93 111.188 161.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -73.38 -16.6 61.34 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.385 1.074 . . . . 4.09 112.686 -172.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.503 ' OE2' ' HE2' ' A' ' 35' ' ' LYS . 25.6 mt-10 -60.75 -52.44 65.08 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.893 0.77 . . . . 3.09 111.374 175.059 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -54.13 -42.84 69.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 121.228 -0.92 . . . . 1.85 111.092 174.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -65.33 -52.34 54.58 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 118.292 -0.861 . . . . 0.67 112.475 -177.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.7 t -68.65 -26.82 65.52 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.572 1.078 . . . . 1.84 112.742 177.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.0 mt -68.57 -38.71 80.93 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 119.986 1.266 . . . . 0.79 111.357 173.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.4 mm -58.42 -38.88 72.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 120.469 1.486 . . . . 0.97 112.718 -178.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.42 -24.64 52.85 Favored Glycine 0 CA--C 1.54 1.594 0 CA-C-N 119.288 0.949 . . . . 0.9 113.405 174.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.68 -8.81 57.62 Favored Glycine 0 CA--C 1.534 1.266 0 O-C-N 121.131 -1.217 . . . . 0.78 114.12 173.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.2 mp -124.44 -41.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.878 1.339 . . . . 1.04 112.154 172.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 79.5 m -81.74 94.05 6.93 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.052 1.741 . . . . 1.35 108.361 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -177.37 -68.95 0.06 OUTLIER Glycine 0 CA--C 1.527 0.829 0 CA-C-O 118.606 -1.108 . . . . 1.08 112.253 -172.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.76 -43.73 30.07 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.71 2.273 . . . . 1.1 111.378 169.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 12.2 pt -75.64 -19.56 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 N-CA-C 113.569 0.952 . . . . 1.21 113.569 172.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.08 -54.67 43.2 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.717 1.144 . . . . 1.18 111.973 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.49 -42.68 78.7 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 118.23 -0.89 . . . . 2.82 112.673 169.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.9 tt -59.78 -42.15 92.69 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 118.891 0.769 . . . . 1.25 112.126 -176.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.2 mt -55.79 -56.9 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 124.109 0.964 . . . . 1.21 109.504 173.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.4 ' CE1' ' HB3' ' B' ' 123' ' ' TYR . 60.0 t60 -59.64 -36.29 76.08 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.82 1.248 . . . . 2.24 112.789 -177.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -88.47 -9.19 53.32 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.07 0.948 . . . . 3.15 113.282 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.9 -48.47 7.77 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 124.453 1.101 . . . . 2.93 113.802 169.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -57.52 -37.59 73.27 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.128 0.966 . . . . 2.53 111.99 -171.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 . . . . . 0 N--CA 1.469 0.511 0 C-N-CA 124.471 1.108 . . . . 2.38 111.553 174.759 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 113.111 0.782 . . . . 2.12 113.111 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 82.2 p -74.08 157.47 36.01 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 122.831 0.453 . . . . 1.14 109.797 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -63.6 -23.34 67.34 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.656 -0.653 . . . . 2.65 111.962 176.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.4 -41.11 98.41 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.369 0.668 . . . . 0.75 110.053 170.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.76 -51.02 12.16 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.759 0.651 . . . . 3.03 112.759 -177.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -34.31 -50.26 0.41 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.774 1.23 . . . . 4.24 111.899 159.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.745 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.04 -41.85 85.84 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 116.488 -1.72 . . . . 0.74 113.959 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 15.6 t -53.83 -47.37 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-N 122.138 2.245 . . . . 1.01 110.788 168.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 16.6 mt -55.01 -49.19 73.62 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 119.454 1.025 . . . . 0.85 111.224 173.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.446 HG21 ' HG2' ' A' ' 7' ' ' GLU . 23.2 t -65.62 -42.14 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.958 1.303 . . . . 0.58 112.389 -176.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.6 mp -60.55 -42.44 96.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.615 1.166 . . . . 0.98 111.153 172.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 18.0 t -65.06 -54.13 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.113 1.365 . . . . 0.68 112.807 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 34.7 tp10 -69.69 -34.35 73.8 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 121.016 1.735 . . . . 4.75 111.874 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -68.73 -19.34 64.34 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.885 1.22 . . . . 2.58 113.481 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -72.65 -65.97 0.72 Allowed 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.452 -0.78 . . . . 2.05 110.985 158.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . 0.4 ' HB3' ' CE1' ' A' ' 95' ' ' HIS . 32.6 m-85 -56.35 -34.07 66.27 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 117.802 -1.094 . . . . 2.1 113.777 -167.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 13.5 ptmt -46.78 -38.06 9.54 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 121.392 1.905 . . . . 2.74 114.034 175.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . 0.535 ' CE2' ' HG3' ' B' ' 144' ' ' MET . 91.3 m-85 -82.89 -10.01 59.03 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 120.359 -1.463 . . . . 2.25 114.145 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 2.3 t . . . . . 0 CA--C 1.541 0.602 0 C-N-CA 127.057 2.143 . . . . 3.28 111.459 179.848 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 8.2 tt . . . . . 0 N--CA 1.477 0.911 0 CA-C-O 121.169 0.509 . . . . 3.57 109.952 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 58.6 m -117.84 144.31 45.51 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 121.011 -1.055 . . . . 3.2 108.26 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . 0.453 ' HE2' ' OE1' ' B' ' 181' ' ' GLU . 17.2 mttp -73.1 -16.71 61.46 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.331 -0.856 . . . . 2.94 112.183 -154.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.1 p -48.85 -29.5 4.71 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.652 1.981 . . . . 2.0 114.048 161.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 46.7 m -68.59 -46.9 68.11 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.745 1.157 . . . . 1.31 112.577 171.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -55.93 -53.85 51.86 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 120.196 1.362 . . . . 1.92 112.245 -170.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -50.17 -29.56 9.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.285 1.034 . . . . 3.24 113.19 175.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -94.89 -36.2 11.72 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 114.505 1.298 . . . . 3.6 114.505 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . 0.535 ' HG3' ' CE2' ' B' ' 125' ' ' TYR . 4.6 tmm? -53.37 -44.77 68.84 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 118.942 -0.551 . . . . 1.2 110.43 163.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 43.1 mt -53.21 -49.11 67.44 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.92 0.782 . . . . 1.18 112.155 170.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.0 -8.13 59.65 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.012 1.486 . . . . 2.67 115.012 -172.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.37 -40.64 7.0 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.852 1.261 . . . . 1.85 113.859 167.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -101.35 -28.74 12.43 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.382 1.473 . . . . 2.76 113.209 -165.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 46.3 mt -108.41 40.5 1.76 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.323 1.449 . . . . 2.64 111.022 166.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -62.0 -20.17 63.61 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.597 1.703 . . . . 1.35 115.597 -169.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . 0.584 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 0.0 OUTLIER -80.83 -59.94 2.49 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.165 1.386 . . . . 1.92 111.916 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 42.7 tpp -58.64 -15.63 12.5 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 126.055 1.742 . . . . 2.0 115.524 173.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 50.9 tp -51.08 -29.87 14.3 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.634 2.774 . . . . 4.24 115.779 -171.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 21.7 m 60.08 29.67 19.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.622 1.169 . . . . 4.69 112.823 -174.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 12.0 t70 42.64 -97.53 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.352 1.861 . . . . 6.18 111.71 -163.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 30.4 m -93.89 -25.3 17.37 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.106 1.362 . . . . 2.56 112.164 -168.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -67.13 -68.44 1.66 Allowed Glycine 0 N--CA 1.477 1.383 0 CA-C-N 120.712 1.596 . . . . 1.59 113.305 -167.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -60.53 -21.87 62.97 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.094 0.958 . . . . 3.57 112.759 173.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' B' ' 162' ' ' ALA . 1.1 ttt-85 -82.41 -37.83 24.94 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.326 1.45 . . . . 4.94 114.509 -178.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 18.2 mmmt -63.56 -37.54 87.71 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 119.981 -1.699 . . . . 4.65 111.387 165.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -55.03 -43.54 73.81 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-O 117.192 -1.385 . . . . 1.8 111.646 168.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' B' ' 159' ' ' ARG . . . -52.53 -52.57 54.05 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.46 1.104 . . . . 0.95 111.926 170.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -56.78 -37.18 70.74 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.865 1.266 . . . . 2.58 113.212 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 34.7 mtmt -57.79 -38.36 75.37 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 121.167 -0.958 . . . . 3.59 112.753 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 10.2 mt -66.27 -42.42 88.47 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.037 -0.983 . . . . 0.95 110.619 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 17.3 mm -56.13 -56.09 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.464 1.106 . . . . 0.74 109.925 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -68.01 -27.56 66.67 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.201 0.815 . . . . 2.53 113.201 -175.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.08 -42.98 99.75 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.253 1.021 . . . . 2.73 113.472 167.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.46 -26.88 16.29 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.045 -1.034 . . . . 3.01 112.605 -169.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.17 -12.26 54.8 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.137 -1.602 . . . . 3.48 113.714 172.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.08 -11.79 60.0 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.942 1.09 . . . . 2.17 113.942 164.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -128.02 -15.55 4.76 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.502 1.667 . . . . 2.59 115.502 -166.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -143.18 125.81 15.91 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 120.448 1.476 . . . . 4.16 110.418 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' B' ' 175' ' ' GLY . 12.2 p-10 -114.6 -108.06 0.37 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 125.358 1.463 . . . . 3.77 112.835 -167.104 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . 0.423 ' H ' ' CG ' ' B' ' 174' ' ' ASP . . . -77.57 15.18 7.87 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 127.126 2.298 . . . . 3.58 114.196 173.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -131.57 150.24 52.22 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.412 1.885 . . . . 4.99 110.039 170.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 35.2 mm -143.8 139.61 25.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 126.802 2.041 . . . . 2.62 107.622 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 25.2 t -92.33 151.4 20.31 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.133 0.424 . . . . 2.31 110.447 167.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -50.14 -41.37 48.78 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.403 0.621 . . . . 1.93 111.169 164.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -71.65 -12.89 61.56 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.5 0.926 . . . . 4.22 113.5 -173.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . 0.453 ' OE1' ' HE2' ' B' ' 138' ' ' LYS . 14.6 mt-10 -60.13 -51.63 68.77 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.655 1.116 . . . . 2.79 111.385 177.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -56.64 -43.58 80.42 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.134 -0.979 . . . . 2.04 111.89 174.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 24.2 t-105 -62.87 -57.38 11.02 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 118.837 -0.602 . . . . 0.63 111.875 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.7 t -65.09 -28.71 69.64 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.923 -1.037 . . . . 1.63 112.73 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 77.2 mt -71.54 -35.57 70.7 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.854 1.206 . . . . 0.77 112.975 173.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 7.0 mm -54.98 -39.2 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 CA-C-N 121.242 1.837 . . . . 0.8 112.292 177.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.07 -28.83 71.19 Favored Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.067 0.841 . . . . 0.73 113.317 176.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -67.98 -14.23 65.42 Favored Glycine 0 CA--C 1.533 1.164 0 O-C-N 121.03 -1.277 . . . . 0.82 113.461 175.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.7 mp -109.3 -32.52 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 118.465 1.133 . . . . 1.07 112.313 166.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 18.6 m -91.88 97.24 10.85 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.379 1.871 . . . . 1.5 110.05 -175.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -177.06 -64.77 0.06 OUTLIER Glycine 0 CA--C 1.529 0.938 0 C-N-CA 124.868 1.223 . . . . 1.05 111.968 -172.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -62.33 -47.86 8.98 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.627 2.218 . . . . 1.17 110.762 167.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 13.5 pt -67.93 -25.15 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 112.966 0.728 . . . . 1.4 112.966 172.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.24 -58.95 6.18 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.836 1.198 . . . . 1.05 111.939 -178.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -38.99 74.21 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 118.378 -0.82 . . . . 2.91 112.549 173.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.1 tt -61.89 -41.97 98.52 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 118.511 -0.757 . . . . 1.5 112.019 -177.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 32.8 mt -55.59 -56.17 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 119.478 1.035 . . . . 1.27 109.639 173.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . 0.435 ' CE1' ' HB3' ' A' ' 20' ' ' TYR . 62.1 t60 -59.46 -36.13 75.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.275 1.03 . . . . 2.38 112.555 -176.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -90.51 -8.94 49.04 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.249 0.833 . . . . 3.36 113.249 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -88.16 -49.02 7.28 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.434 1.094 . . . . 3.0 113.792 169.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -58.82 -33.85 70.85 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.05 0.929 . . . . 2.66 112.144 -170.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -72.77 -52.82 13.48 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.675 1.19 . . . . 2.39 111.388 175.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 . . . . . 0 CA--C 1.548 0.903 0 C-N-CA 127.212 2.205 . . . . 6.83 113.837 177.299 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.418 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 3.6 m-30 . . . . . 0 CA--C 1.546 0.81 0 CA-C-O 119.099 -0.477 . . . . 2.37 110.279 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.3 p -71.82 155.52 40.33 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 119.186 0.903 . . . . 1.21 110.703 -176.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -61.29 -24.33 66.33 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 114.276 1.213 . . . . 2.76 114.276 -171.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -48.86 79.41 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 119.7 1.137 . . . . 1.03 110.643 170.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.24 -46.84 69.39 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.381 1.472 . . . . 2.89 112.025 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.4 mmtt -52.17 -42.09 63.14 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.973 -1.08 . . . . 6.18 111.495 169.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.42 -39.46 77.87 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.098 -1.43 . . . . 0.67 112.064 177.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.2 t -54.6 -40.09 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 121.503 1.956 . . . . 1.1 110.458 167.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.1 mt -59.67 -55.67 22.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 CA-C-N 120.07 1.304 . . . . 0.89 111.809 170.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.9 t -58.11 -39.28 72.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 125.467 1.507 . . . . 0.61 112.976 -177.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -70.48 -41.7 72.37 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.518 1.127 . . . . 0.95 112.098 176.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 70.6 t -71.03 -35.88 61.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 123.826 0.85 . . . . 0.6 111.396 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -62.32 -46.29 89.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.115 0.966 . . . . 2.7 110.848 168.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -55.11 -31.78 61.5 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.827 1.418 . . . . 2.08 114.827 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -78.24 -62.23 1.75 Allowed 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.645 -0.659 . . . . 2.12 111.607 171.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -64.6 -26.57 68.46 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 118.288 -0.863 . . . . 1.92 113.094 -169.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.0 -20.05 8.28 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 120.502 1.501 . . . . 2.5 114.146 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -90.41 0.22 57.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.142 1.377 . . . . 2.53 114.584 176.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.482 1.15 0 C-N-CA 125.592 1.557 . . . . 2.37 111.007 178.066 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.5 pt . . . . . 0 N--CA 1.474 0.768 0 N-CA-C 111.85 0.315 . . . . 2.89 111.85 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.2 t -77.61 149.39 34.78 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.693 0.759 . . . . 3.06 111.533 168.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -56.1 -23.0 31.38 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 120.607 -1.308 . . . . 2.24 111.624 164.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.8 p -80.8 -9.42 59.81 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.009 -1.682 . . . . 1.69 115.388 170.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.8 m -83.36 -33.98 25.71 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.042 1.292 . . . . 1.25 112.24 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.451 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 23.8 t80 -45.49 -60.25 2.27 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.865 1.266 . . . . 2.05 110.934 176.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.7 ptt180 -58.1 -24.25 57.92 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.692 1.597 . . . . 2.33 113.229 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -94.5 -40.39 9.91 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 126.154 1.782 . . . . 3.29 111.842 -172.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 5.7 tmm? -55.06 -40.44 70.32 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 120.298 -1.501 . . . . 1.24 111.811 163.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.428 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 81.8 mt -68.87 6.06 0.98 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.94 2.496 . . . . 1.73 114.972 169.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -115.58 -13.5 11.52 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.207 1.803 . . . . 2.69 113.607 165.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.55 -37.57 9.11 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.847 1.425 . . . . 1.75 114.847 178.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -82.9 -56.29 3.91 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 118.591 0.632 . . . . 4.58 109.77 164.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.95 75.06 4.49 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.482 -0.762 . . . . 2.12 109.704 171.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -121.82 -2.92 9.23 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.216 1.807 . . . . 2.19 113.965 -174.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -118.11 -28.01 5.96 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.114 -0.991 . . . . 1.78 112.027 176.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 36.9 tpp -65.49 -12.91 57.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.608 1.963 . . . . 1.93 112.443 163.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.3 pp -151.5 175.39 12.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.555 1.542 . . . . 3.59 112.841 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.0 m 156.06 -37.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 130.903 3.681 . . . . 7.46 107.922 -164.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -55.27 132.33 47.59 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.197 0.999 . . . . 4.25 110.505 156.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 50.3 m -80.73 -25.81 37.81 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.221 1.408 . . . . 2.47 111.274 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.16 -48.12 87.49 Favored Glycine 0 N--CA 1.472 1.098 0 C-N-CA 124.738 1.161 . . . . 1.67 111.82 177.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -46.52 -55.73 7.08 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.918 1.687 . . . . 3.35 112.173 166.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -60.59 -29.08 68.98 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.536 -0.727 . . . . 6.81 112.669 -177.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 mmmt -59.98 -37.73 80.47 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.613 -1.304 . . . . 4.34 113.213 174.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.82 -19.48 62.6 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.4 1.259 . . . . 1.02 114.4 172.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.2 -43.25 19.56 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.669 1.122 . . . . 0.66 111.42 164.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -60.96 -43.08 99.23 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 113.375 0.88 . . . . 2.23 113.375 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -56.4 -27.61 56.88 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.076 0.951 . . . . 2.69 112.715 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 24.3 mt -77.01 -35.22 57.26 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 121.809 -0.557 . . . . 0.78 111.763 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.6 mm -55.28 -40.81 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.244 1.018 . . . . 0.94 110.89 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -73.42 -35.14 65.78 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.462 0.912 . . . . 2.98 113.462 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -60.78 -28.05 68.45 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.782 0.833 . . . . 3.2 111.914 170.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.4 HD23 HD21 ' A' ' 82' ' ' LEU . 0.3 OUTLIER -85.74 -32.32 21.94 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.904 2.082 . . . . 2.01 111.832 174.14 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -67.46 -22.24 65.5 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.114 1.366 . . . . 3.81 113.972 172.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.4 -15.5 49.33 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.408 1.262 . . . . 2.48 114.408 169.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -151.37 -31.4 0.16 Allowed 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 118.048 2.61 . . . . 3.96 118.048 -170.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -90.37 100.95 13.69 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 121.427 1.921 . . . . 3.44 111.385 -177.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -65.76 -5.23 8.14 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 116.635 2.087 . . . . 3.93 116.635 -173.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.34 7.71 8.16 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.629 1.109 . . . . 2.51 115.179 -169.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 41.4 mmt-85 -75.28 -179.89 4.73 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.714 1.757 . . . . 4.63 109.71 149.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.5 mm -136.34 137.28 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 N-CA-C 106.672 -1.603 . . . . 2.07 106.672 166.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.3 m -96.41 146.7 24.54 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.144 0.884 . . . . 2.11 110.175 167.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -64.39 -51.34 63.71 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.729 0.641 . . . . 2.54 112.729 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -70.55 -20.67 62.78 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.702 1.201 . . . . 4.68 112.953 -177.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -63.78 -35.86 82.0 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 121.34 -0.85 . . . . 5.23 110.834 173.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -53.85 -52.13 61.39 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.213 -1.555 . . . . 1.72 110.749 170.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 -65.29 -45.82 82.88 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.865 0.866 . . . . 0.71 111.465 -175.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 99.5 m -57.83 -46.25 85.01 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 127.102 2.161 . . . . 2.4 111.287 177.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.451 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 85.1 mt -60.94 -26.52 67.56 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 118.196 -0.907 . . . . 0.75 113.06 174.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 35.9 mm -61.37 -32.69 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 CA-C-N 121.603 2.001 . . . . 0.99 112.445 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.59 -28.07 67.16 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.572 1.082 . . . . 0.72 112.939 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -72.79 -19.98 79.57 Favored Glycine 0 CA--C 1.533 1.192 0 O-C-N 121.373 -1.075 . . . . 0.62 114.301 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.9 mp -97.47 -35.25 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 CA-C-N 118.451 1.125 . . . . 0.78 110.281 166.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.4 m -82.83 56.64 3.49 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.688 1.995 . . . . 1.37 110.666 -175.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -131.98 -71.6 0.1 OUTLIER Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.341 1.924 . . . . 1.33 111.497 175.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -63.94 -56.04 0.55 Allowed 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.302 2.668 . . . . 1.62 111.872 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.3 pt -65.31 -27.16 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 112.966 0.728 . . . . 1.8 112.966 173.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.32 -35.81 78.35 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.429 1.013 . . . . 1.29 113.458 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.4 ptpt -69.25 -32.41 71.6 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.379 -1.451 . . . . 3.22 113.478 166.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.96 -37.43 85.97 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 120.457 1.48 . . . . 1.49 112.031 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -47.04 -59.95 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-N 119.785 1.175 . . . . 1.12 109.411 162.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.406 ' CE1' ' HB3' ' B' ' 123' ' ' TYR . 30.0 t60 -64.72 -19.05 65.55 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.692 1.367 . . . . 2.31 114.692 -175.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -74.6 -47.36 32.82 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.307 -0.871 . . . . 3.17 112.372 162.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -69.21 -40.01 78.27 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 117.424 -1.274 . . . . 2.31 114.065 -172.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -60.37 -17.21 42.04 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 120.023 1.283 . . . . 2.74 112.227 173.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.477 0.912 0 O-C-N 120.448 -1.407 . . . . 3.11 110.919 172.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 . . . . . 0 CA--C 1.546 0.801 0 CA-C-O 118.592 -0.718 . . . . 2.87 111.816 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.36 166.44 14.46 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 119.126 0.876 . . . . 1.0 111.124 -177.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.87 -24.04 66.67 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 118.977 0.808 . . . . 2.9 113.155 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.37 -43.67 98.27 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.921 1.237 . . . . 0.86 110.036 172.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -71.34 -43.83 66.26 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.742 0.817 . . . . 3.19 112.004 175.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 44.7 mmtt -53.52 -42.27 67.22 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.798 1.181 . . . . 6.25 111.101 170.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.42 -45.41 69.25 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 124.331 1.052 . . . . 0.64 111.977 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.33 -38.83 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 120.428 1.467 . . . . 0.79 110.031 170.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 76.9 mt -59.29 -56.1 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-O 117.694 -1.146 . . . . 0.93 111.378 168.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 t -58.21 -35.36 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 126.048 1.739 . . . . 0.7 113.46 -177.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.42 -46.96 62.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.503 1.121 . . . . 0.97 111.227 174.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 68.0 t -69.13 -34.68 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.976 0.91 . . . . 0.61 111.316 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -67.98 -44.55 76.42 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.39 1.476 . . . . 2.67 110.445 170.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -55.63 -34.12 64.62 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.977 1.717 . . . . 2.1 113.952 175.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -73.31 -64.93 0.88 Allowed 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.885 -0.51 . . . . 1.99 111.405 170.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . 0.406 ' HB3' ' CE1' ' A' ' 95' ' ' HIS . 47.4 m-85 -64.93 -28.89 69.83 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.66 0.985 . . . . 1.86 113.66 -169.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -19.97 16.56 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 120.856 1.662 . . . . 2.65 113.834 177.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -89.94 -0.23 57.45 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.207 1.403 . . . . 2.13 114.17 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 33.6 m . . . . . 0 N--CA 1.481 1.104 0 C-N-CA 125.295 1.438 . . . . 2.41 110.763 177.244 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 23.9 pt . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 112.583 0.586 . . . . 2.95 112.583 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 42.1 t -83.04 148.92 27.25 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.369 -0.832 . . . . 2.91 111.233 171.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 18.0 ttpt -56.18 -20.3 17.31 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.734 -1.229 . . . . 2.43 112.14 163.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 76.0 p -83.04 -8.32 59.56 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 115.674 1.731 . . . . 1.67 115.674 169.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 67.4 m -76.71 -42.09 42.75 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.444 1.474 . . . . 1.16 112.692 -176.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -50.86 -54.79 20.89 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.443 1.019 . . . . 1.93 112.88 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -54.38 -26.26 29.21 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.292 1.037 . . . . 2.58 113.517 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -95.75 -42.37 8.4 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.231 1.813 . . . . 3.15 112.238 -174.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.9 tmm? -53.72 -40.06 65.78 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.852 -1.155 . . . . 1.13 111.917 163.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.71 -21.36 54.72 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.688 1.366 . . . . 1.02 114.688 168.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -97.24 -5.37 37.0 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.418 1.487 . . . . 2.61 112.386 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.85 -33.12 8.99 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.78 1.4 . . . . 1.55 114.78 168.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -89.09 -63.87 1.23 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.904 0.881 . . . . 4.03 111.521 175.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.35 35.98 0.15 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.045 1.338 . . . . 1.98 112.514 174.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -80.26 3.75 19.88 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.655 2.382 . . . . 1.9 114.43 -171.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . 0.418 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 17.3 m-70 -117.05 -26.12 6.95 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 118.826 0.739 . . . . 1.66 111.611 173.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 42.5 tpp -68.43 -26.99 65.8 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.21 2.204 . . . . 2.13 112.406 165.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 1.8 pp -123.98 167.25 14.4 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.849 1.66 . . . . 3.34 111.131 167.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 21.8 m -167.8 -54.58 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.299 1.84 . . . . 6.41 107.479 175.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -63.82 143.93 57.46 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.636 0.732 . . . . 4.26 109.678 160.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 5.9 m -65.58 -23.72 66.91 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.602 1.161 . . . . 4.2 111.08 172.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.36 -28.39 50.26 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.292 1.425 . . . . 2.31 114.793 -178.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -71.25 -61.86 1.61 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 118.133 0.967 . . . . 3.09 109.142 168.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.6 ttp-105 -48.56 -21.4 0.57 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.501 1.92 . . . . 4.67 116.137 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -45.68 -38.35 6.73 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.635 1.107 . . . . 3.63 113.224 164.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -70.94 -18.38 62.64 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 115.286 1.587 . . . . 1.04 115.286 174.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.46 -46.93 12.83 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 120.041 1.291 . . . . 0.74 109.926 165.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -57.32 -41.96 80.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.544 1.538 . . . . 1.98 112.539 -177.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -58.43 -28.33 65.15 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.445 1.276 . . . . 2.83 114.445 174.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 52.5 mt -76.98 -35.87 56.86 Favored 'General case' 0 C--O 1.222 -0.388 0 O-C-N 121.908 -0.495 . . . . 0.85 110.773 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 14.7 mm -55.38 -40.36 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.607 0.763 . . . . 0.9 110.64 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -71.35 -34.76 70.78 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.583 0.957 . . . . 3.14 113.583 176.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -64.15 -31.18 72.28 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.973 0.909 . . . . 3.23 111.712 171.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.56 -36.28 57.72 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.123 2.169 . . . . 2.1 111.56 172.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -70.3 -22.19 62.86 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.631 1.172 . . . . 3.82 113.556 177.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -63.61 -13.36 41.41 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.573 1.323 . . . . 2.29 114.573 169.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -149.36 -34.07 0.19 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 118.169 2.655 . . . . 3.92 118.169 -171.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -88.44 98.21 11.5 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 121.229 1.831 . . . . 3.33 111.326 -175.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -64.83 -4.21 4.17 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 116.994 2.22 . . . . 3.88 116.994 -172.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 120.41 5.67 10.18 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.679 -1.067 . . . . 2.44 115.044 -167.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 37.7 mmt-85 -75.94 176.14 8.16 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.829 1.815 . . . . 4.68 109.848 150.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 32.7 mm -135.3 136.63 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 106.832 -1.544 . . . . 2.22 106.832 167.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 23.8 m -95.21 147.55 23.35 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.837 0.744 . . . . 2.15 110.28 168.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -61.87 -51.63 67.41 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.513 0.673 . . . . 2.5 112.384 177.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -70.36 -16.02 62.93 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.562 1.545 . . . . 4.57 112.777 -176.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -68.32 -38.02 81.16 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.085 -1.01 . . . . 4.82 111.319 174.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -56.16 -45.43 79.68 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 119.963 -1.711 . . . . 1.82 111.826 170.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.9 t-105 -68.09 -45.27 74.22 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.309 0.644 . . . . 0.72 112.062 -177.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 87.2 m -58.25 -48.23 81.08 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.702 2.001 . . . . 2.22 110.783 175.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 84.0 mt -61.25 -27.65 68.6 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.394 0.887 . . . . 0.56 113.394 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 23.7 mm -62.12 -39.88 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 CA-C-N 120.851 1.659 . . . . 0.65 111.604 176.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -59.34 -30.65 68.21 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.645 1.117 . . . . 0.59 113.012 175.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -69.12 -20.09 74.54 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-O 118.836 -0.98 . . . . 0.58 114.297 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.5 mp -98.27 -36.53 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 119.17 1.485 . . . . 0.79 110.912 163.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 17.4 m -81.54 64.92 6.46 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.973 2.109 . . . . 1.4 110.203 -173.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -137.66 -72.5 0.06 OUTLIER Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.403 1.478 . . . . 0.93 111.649 178.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -65.43 -47.74 3.99 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.049 2.5 . . . . 1.18 111.563 177.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 10.0 pt -66.99 -25.42 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 112.814 0.672 . . . . 1.23 112.814 174.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.76 -38.2 79.91 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.32 -0.863 . . . . 0.9 112.692 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -65.78 -34.23 77.69 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 117.54 -1.219 . . . . 3.39 112.922 165.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.2 tt -65.82 -39.43 90.84 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 121.206 1.821 . . . . 1.61 111.872 177.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 96.3 mt -48.59 -59.28 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 CA-C-N 119.773 1.17 . . . . 1.09 109.655 163.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 21.5 t60 -63.86 -22.37 66.89 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.661 1.356 . . . . 2.21 114.661 -175.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -71.06 -46.29 62.21 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.385 1.074 . . . . 3.16 112.106 164.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 25.2 mm100 -68.6 -41.99 78.8 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 117.64 -1.171 . . . . 2.47 113.731 -173.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.25 -18.73 28.69 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.616 1.098 . . . . 2.7 112.553 174.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -91.38 -47.37 7.5 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.603 -1.31 . . . . 3.1 111.064 173.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 . . . . . 0 CA--C 1.548 0.891 0 C-N-CA 126.429 1.891 . . . . 5.44 113.355 -178.764 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 . . . . . 0 CA--C 1.543 0.701 0 N-CA-C 106.949 -1.5 . . . . 3.24 106.949 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 p -57.5 169.02 0.7 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.027 1.731 . . . . 2.13 113.799 -163.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.0 -8.94 53.23 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.743 -1.223 . . . . 3.68 113.786 172.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.51 -39.94 10.14 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.458 1.026 . . . . 1.19 110.641 167.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -77.51 -58.85 3.04 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 120.702 -1.249 . . . . 3.57 110.784 -173.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.437 ' O ' HG23 ' A' ' 14' ' ' VAL . 11.9 tptp -56.67 -23.56 42.65 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.865 -0.522 . . . . 5.86 111.624 171.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.801 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -66.04 -53.8 33.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.066 -1.021 . . . . 1.37 112.785 168.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.03 -36.04 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 CA-C-N 119.865 1.211 . . . . 1.32 110.727 174.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.4 mm -54.6 -50.93 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 119.463 1.029 . . . . 2.1 110.645 167.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 10' ' ' LYS . 31.0 t -69.67 -29.49 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 124.759 1.224 . . . . 1.41 112.188 -174.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.2 mp -70.59 -39.79 73.63 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.7 1.137 . . . . 1.54 111.571 170.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.8 t -63.48 -46.46 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.046 0.938 . . . . 1.35 111.295 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -65.18 -45.72 83.73 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.362 0.983 . . . . 4.95 111.244 172.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -57.85 -27.93 63.67 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 119.534 -1.979 . . . . 3.92 113.815 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -74.63 -67.35 0.64 Allowed 'General case' 0 C--O 1.24 0.559 0 C-N-CA 123.266 0.626 . . . . 2.16 111.709 165.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -61.11 -34.67 75.33 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 117.578 -1.201 . . . . 2.62 112.334 -168.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.8 mtpt -43.54 -51.43 6.79 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 126.861 2.064 . . . . 2.27 113.044 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -81.6 -32.64 31.95 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.788 1.235 . . . . 2.61 111.248 -176.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 CA--C 1.55 0.949 0 C-N-CA 128.217 2.607 . . . . 3.78 110.115 177.628 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 36.3 pt . . . . . 0 N--CA 1.478 0.966 0 CA-C-O 120.68 0.276 . . . . 2.09 111.337 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.5 m -78.19 135.98 37.72 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 121.196 -0.94 . . . . 2.42 109.072 157.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.5 mttp -59.1 -27.91 66.02 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.069 -1.02 . . . . 2.08 112.256 -178.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.2 p -57.37 -30.8 65.17 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.253 1.575 . . . . 1.64 115.253 168.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.8 m -71.19 -39.07 72.04 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.641 1.11 . . . . 1.3 112.461 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -50.95 -53.91 28.83 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.038 0.935 . . . . 2.1 111.611 176.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 23.7 ptt85 -69.61 -14.42 62.82 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.611 1.337 . . . . 2.95 114.611 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -89.18 -46.02 9.12 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.193 0.997 . . . . 4.52 111.009 175.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 3.3 tmm? -47.45 -47.25 27.1 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.518 1.127 . . . . 1.26 111.69 164.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.5 mt -60.12 -37.29 79.6 Favored 'General case' 0 C--O 1.212 -0.879 0 C-N-CA 123.49 0.716 . . . . 2.06 111.655 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -69.96 -14.31 62.65 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 120.001 1.273 . . . . 3.03 113.736 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.82 -46.48 3.48 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.391 1.476 . . . . 2.65 114.108 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -87.28 -28.17 22.46 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 119.478 1.035 . . . . 3.59 111.921 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.48 49.04 0.81 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.87 2.068 . . . . 1.71 110.766 162.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 42.1 p30 -69.05 -178.37 1.24 Allowed 'General case' 0 CA--C 1.548 0.904 0 O-C-N 120.561 -1.337 . . . . 4.67 111.467 166.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 61.5 m170 80.29 -32.27 0.12 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 116.872 2.175 . . . . 2.72 116.872 158.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.7 ptp -76.21 -19.66 58.18 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 113.383 0.883 . . . . 2.52 113.383 163.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.8 mp -69.28 107.87 3.44 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.505 0.722 . . . . 3.02 110.857 -177.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.5 m -76.58 -19.5 57.81 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.956 0.724 . . . . 4.04 112.956 167.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -162.67 160.61 25.83 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 127.73 2.412 . . . . 3.69 107.902 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 p -51.28 -20.93 1.85 Allowed 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 126.455 1.902 . . . . 4.23 114.004 164.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -48.88 -34.86 16.46 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-N 120.983 1.719 . . . . 2.17 114.291 176.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 30.5 t30 -71.57 -38.71 70.91 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 118.158 0.979 . . . . 3.61 112.304 175.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -63.73 -37.56 87.84 Favored 'General case' 0 C--N 1.346 0.446 0 O-C-N 121.003 -1.061 . . . . 4.7 112.184 165.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -64.34 -27.48 69.05 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 119.643 -1.911 . . . . 3.23 113.327 174.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.56 -12.95 61.63 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.906 1.076 . . . . 1.09 113.906 166.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.75 -46.47 14.2 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.162 0.892 . . . . 1.09 111.608 160.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -51.86 -44.01 63.48 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.64 1.176 . . . . 1.9 113.259 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -55.92 -28.45 56.88 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.715 1.005 . . . . 3.09 113.715 175.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.7 mt -79.39 -41.43 27.76 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.346 1.059 . . . . 0.97 111.238 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 mm -53.44 -54.22 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 124.407 1.083 . . . . 0.92 110.175 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -58.1 -43.06 86.94 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.234 0.54 . . . . 1.88 112.439 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -31.31 70.73 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.374 1.47 . . . . 2.85 112.829 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.6 mt -95.05 -23.24 17.43 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 114.01 1.115 . . . . 2.87 114.01 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -67.84 -14.67 63.15 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.506 1.503 . . . . 3.0 112.394 170.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.15 -18.73 48.95 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.064 1.505 . . . . 2.56 115.064 163.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -130.53 -24.17 2.53 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 116.455 2.02 . . . . 3.24 116.455 -166.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -121.88 138.94 54.2 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.288 -1.507 . . . . 4.44 112.885 -171.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -96.37 -160.6 0.81 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 126.456 1.902 . . . . 4.58 111.072 -175.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.84 -10.74 14.52 Favored Glycine 0 CA--C 1.527 0.793 0 O-C-N 120.011 -1.681 . . . . 2.79 113.843 152.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.7 mmt-85 -69.93 79.1 0.47 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.356 1.578 . . . . 4.81 108.992 161.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.4 mt -83.32 135.54 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 N-CA-C 107.505 -1.294 . . . . 2.36 107.505 172.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.7 t -104.17 166.45 10.39 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.551 0.691 . . . . 1.66 111.79 172.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -78.11 -42.97 30.31 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.273 1.035 . . . . 2.69 112.496 -178.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.5 p-10 -71.63 -24.1 61.81 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.588 1.955 . . . . 3.65 112.644 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -52.86 -57.31 10.65 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.311 1.844 . . . . 2.88 111.103 169.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -56.47 -46.73 80.26 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.223 -0.923 . . . . 2.27 111.814 177.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -59.76 -39.94 86.52 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.822 -0.549 . . . . 1.21 111.747 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 73.2 m -63.9 -42.02 97.55 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 126.243 1.817 . . . . 2.03 110.769 175.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.01 -38.83 92.22 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 117.929 -1.034 . . . . 0.82 113.289 174.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.1 mm -57.75 -34.4 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 120.716 1.598 . . . . 1.13 110.947 173.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.02 -6.06 36.32 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.87 1.224 . . . . 1.41 114.618 176.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -97.46 -19.85 24.18 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.034 1.417 . . . . 0.74 114.599 171.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 5.1 mp -92.89 -35.96 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 118.776 1.288 . . . . 1.64 110.451 170.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.8 m -74.42 145.7 43.49 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.575 -0.898 . . . . 2.28 108.575 171.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.45 -60.15 0.49 Allowed Glycine 0 CA--C 1.535 1.292 0 CA-C-O 117.086 -1.952 . . . . 0.91 115.428 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -65.55 -64.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.81 0 CA-C-N 121.356 2.578 . . . . 1.16 111.095 -173.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.5 -7.98 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 112.897 0.703 . . . . 1.72 112.897 175.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.512 ' HA ' HD12 ' A' ' 94' ' ' ILE . . . -58.67 -34.04 70.8 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.846 1.203 . . . . 1.17 113.225 -178.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -66.68 -27.59 67.78 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.335 -1.478 . . . . 3.8 111.873 175.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.1 tt -80.21 -33.56 38.01 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.655 1.582 . . . . 1.47 111.564 174.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.512 HD12 ' HA ' ' A' ' 91' ' ' ALA . 98.0 mt -47.42 -52.49 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 CA-C-N 119.226 0.921 . . . . 0.92 110.435 165.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -53.53 -42.06 67.02 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.157 1.169 . . . . 3.7 114.157 177.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.56 -49.5 76.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.794 0.838 . . . . 6.5 110.731 173.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -60.56 -39.91 89.72 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 120.905 -1.122 . . . . 2.66 113.35 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -66.94 -22.71 65.93 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 119.589 1.086 . . . . 3.44 112.283 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.414 0 O-C-N 121.162 -0.961 . . . . 2.11 112.017 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 . . . . . 0 CA--C 1.545 0.779 0 N-CA-C 106.426 -1.694 . . . . 3.28 106.426 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 11.2 p -58.32 168.2 1.15 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 126.214 1.805 . . . . 2.16 113.72 -162.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.51 -6.88 21.73 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.432 -1.417 . . . . 3.44 113.742 171.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.61 -38.72 9.43 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.663 1.12 . . . . 1.07 111.344 166.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.87 -58.39 3.29 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 120.537 -1.352 . . . . 3.5 110.407 -174.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . 0.461 ' O ' HG23 ' B' ' 117' ' ' VAL . 14.0 tptp -57.84 -26.06 61.51 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 122.087 -0.383 . . . . 6.7 110.66 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.801 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -62.23 -55.97 23.25 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 121.477 -0.764 . . . . 1.27 112.887 169.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.25 -35.09 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-N 119.911 1.232 . . . . 1.33 110.668 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 19.8 mt -57.68 -44.53 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 118.596 0.635 . . . . 1.32 112.167 167.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.461 HG23 ' O ' ' B' ' 113' ' ' LYS . 39.8 t -72.73 -29.46 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 124.26 1.024 . . . . 1.45 111.558 -177.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.4 mp -69.68 -43.44 72.51 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.15 0.886 . . . . 1.66 111.184 168.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 19.2 t -57.41 -46.76 85.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.566 1.146 . . . . 1.42 111.728 171.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -62.31 -51.9 65.81 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.961 0.904 . . . . 4.68 111.869 172.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -59.95 -25.59 65.32 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.489 -1.382 . . . . 3.92 113.497 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -72.64 -69.54 0.4 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.688 0.795 . . . . 2.52 111.534 164.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -62.98 -32.15 73.42 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 118.328 -0.844 . . . . 2.43 113.025 -167.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -43.86 -54.23 5.42 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.376 1.87 . . . . 2.2 113.2 174.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . 0.458 ' CZ ' ' HG3' ' B' ' 144' ' ' MET . 43.1 m-85 -75.5 -30.2 59.78 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 123.531 0.732 . . . . 2.43 110.783 -177.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 65.2 t . . . . . 0 CA--C 1.55 0.979 0 C-N-CA 127.683 2.393 . . . . 3.35 110.702 178.551 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 35.9 pt . . . . . 0 N--CA 1.473 0.679 0 CA-C-O 121.708 0.766 . . . . 2.08 112.403 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 5.5 m -99.07 127.2 44.97 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 121.825 -0.547 . . . . 2.39 109.933 176.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 32.0 mttp -60.79 -28.63 68.9 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 120.836 -1.165 . . . . 2.06 112.256 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 10.8 p -60.2 -33.69 72.58 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.75 1.62 . . . . 1.59 113.801 168.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.2 m -79.95 -37.36 34.63 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 118.197 -0.906 . . . . 1.81 111.792 174.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -49.05 -54.07 17.49 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.571 1.078 . . . . 2.02 111.878 173.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 14.0 ptt85 -66.08 -17.17 64.53 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 114.211 1.189 . . . . 3.01 114.211 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -94.02 -48.12 6.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.205 1.402 . . . . 3.86 110.086 -177.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . 0.458 ' HG3' ' CZ ' ' B' ' 125' ' ' TYR . 5.6 tmm? -45.17 -45.73 11.69 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.118 2.167 . . . . 1.25 112.51 162.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 8.9 mt -54.35 -40.87 68.48 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 123.625 0.77 . . . . 2.2 111.292 176.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -71.04 -13.66 62.06 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.634 -1.292 . . . . 2.97 113.944 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.76 -53.78 3.31 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.902 1.281 . . . . 1.93 113.086 175.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -86.98 -26.96 23.55 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.385 0.539 . . . . 3.64 111.657 -174.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -107.61 46.83 0.92 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.921 2.089 . . . . 1.8 110.951 164.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 48.9 p30 -65.84 -178.38 0.57 Allowed 'General case' 0 CA--C 1.554 1.109 0 O-C-N 120.952 -1.093 . . . . 4.79 111.864 168.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 60.6 m170 79.17 -35.43 0.16 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 117.168 2.284 . . . . 2.65 117.168 156.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 10.5 ptp -73.46 -19.37 60.96 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 118.716 0.689 . . . . 2.42 112.77 162.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.33 99.83 0.58 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.935 0.894 . . . . 2.95 111.04 -172.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 1.2 m -75.14 -14.7 60.58 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.259 1.024 . . . . 4.21 113.378 175.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -167.22 159.97 13.29 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 128.574 2.749 . . . . 3.89 108.035 166.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 72.9 p -50.01 -24.19 2.47 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.035 1.734 . . . . 5.01 113.5 165.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -51.71 -29.67 26.24 Favored Glycine 0 CA--C 1.529 0.967 0 CA-C-N 120.822 1.646 . . . . 2.37 114.073 174.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -74.31 -36.16 63.71 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 118.3 1.05 . . . . 3.47 112.377 174.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 17.4 ttt-85 -64.12 -39.56 94.3 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.994 0.815 . . . . 4.6 111.884 162.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.6 mtmt -65.8 -20.95 66.44 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 119.893 -1.754 . . . . 3.54 113.652 174.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . 0.428 ' HA ' ' HG2' ' B' ' 164' ' ' LYS . . . -73.18 -10.39 59.72 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.239 -0.913 . . . . 1.28 113.447 168.367 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.02 -44.44 15.21 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 117.334 -1.317 . . . . 1.11 111.471 158.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . 0.408 ' HA ' HG12 ' B' ' 166' ' ' ILE . 1.8 m-20 -48.52 -44.59 36.31 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 120.86 1.664 . . . . 1.94 113.632 176.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' B' ' 161' ' ' ALA . 3.0 ptmm? -55.37 -30.29 60.06 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.105 1.15 . . . . 3.74 114.105 174.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 39.5 mt -78.4 -38.25 42.04 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.481 -0.762 . . . . 1.19 111.892 173.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . 0.408 HG12 ' HA ' ' B' ' 163' ' ' ASP . 9.5 mm -58.8 -53.39 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 124.004 0.815 . . . . 1.22 109.669 -174.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -60.61 -31.34 70.52 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.256 0.835 . . . . 2.1 113.256 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -73.84 -39.9 63.69 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.927 1.691 . . . . 2.61 112.738 176.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.02 -18.02 22.29 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 114.09 1.144 . . . . 3.09 114.09 -173.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -58.88 -24.2 61.92 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.847 1.259 . . . . 3.08 113.021 166.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.58 -24.75 45.35 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.065 1.135 . . . . 2.34 114.065 169.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -109.34 -16.49 14.02 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.739 1.385 . . . . 2.59 114.739 -170.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 5.7 t-80 -142.08 97.2 3.09 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 120.57 -1.331 . . . . 3.52 112.576 -163.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -65.49 167.52 8.68 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 108.857 -0.794 . . . . 4.8 108.857 149.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -67.39 31.35 0.21 Allowed Glycine 0 CA--C 1.527 0.818 0 C-N-CA 126.113 1.816 . . . . 3.11 116.799 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 30.8 mmt-85 -76.24 50.57 0.64 Allowed 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.476 1.638 . . . . 5.25 109.864 161.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.9 mt -62.29 136.71 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.023 1.329 . . . . 2.65 111.144 -162.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 12.8 t -117.83 155.91 29.28 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.667 1.187 . . . . 2.57 109.471 167.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -56.35 -34.78 66.94 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.488 1.115 . . . . 2.54 113.122 -173.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -68.52 -21.78 64.56 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.773 2.029 . . . . 3.92 114.052 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -66.96 -58.63 4.59 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.008 1.277 . . . . 3.09 110.944 178.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -50.03 -49.56 50.48 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.787 -0.571 . . . . 2.26 111.706 172.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -61.17 -39.57 90.61 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.725 -0.609 . . . . 1.26 112.085 -176.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 27.5 m -64.85 -44.18 90.58 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.746 1.618 . . . . 2.03 110.86 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 88.4 mt -64.83 -36.47 84.45 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 117.847 -1.073 . . . . 1.02 113.097 177.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 34.5 mm -56.21 -45.32 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 CA-C-N 120.898 1.681 . . . . 1.06 111.344 172.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -64.82 -19.4 65.32 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 123.849 0.738 . . . . 1.12 113.272 177.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.37 -20.82 65.94 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-O 118.257 -1.302 . . . . 1.03 113.915 173.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.3 mp -86.95 -43.09 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 CA-C-N 119.607 1.704 . . . . 1.18 109.994 164.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 11.5 m -77.92 66.01 3.48 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.868 1.667 . . . . 1.53 111.375 -168.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -131.91 -75.39 0.12 Allowed Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.853 1.692 . . . . 1.32 112.961 -174.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.52 -59.43 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.256 2.638 . . . . 1.47 112.753 -168.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.3 pp -69.08 -11.55 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 113.282 0.845 . . . . 1.63 113.282 -173.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . 0.489 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -56.5 -35.9 68.53 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.624 1.102 . . . . 1.27 112.899 175.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -74.08 -10.24 59.43 Favored 'General case' 0 CA--C 1.55 0.979 0 O-C-N 120.287 -1.508 . . . . 4.3 112.785 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.1 tt -93.88 -30.33 14.84 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.176 2.19 . . . . 1.81 112.377 166.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . 0.489 HD12 ' HA ' ' B' ' 194' ' ' ALA . 91.6 mt -49.24 -48.14 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 120.661 -1.274 . . . . 1.06 109.558 165.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -57.21 -30.31 64.46 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 115.458 1.651 . . . . 3.57 115.458 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.67 -54.14 15.27 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.846 -0.427 . . . . 6.18 109.846 168.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -58.8 -41.69 87.36 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.791 1.404 . . . . 2.76 114.791 -172.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -69.66 -17.65 63.52 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 119.541 1.064 . . . . 3.25 112.471 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.8 -50.82 4.3 Favored 'General case' 0 CA--C 1.514 -0.409 0 O-C-N 121.232 -0.918 . . . . 1.98 111.735 177.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 CA--C 1.539 0.544 0 CA-C-N 114.954 -1.021 . . . . 4.22 112.757 -179.081 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 111.942 0.349 . . . . 2.07 111.942 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.9 t -64.69 151.9 43.8 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.48 0.712 . . . . 3.01 110.329 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.425 ' HG2' HG21 ' B' ' 117' ' ' VAL . 4.5 tp10 -51.09 -38.95 54.82 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.484 1.114 . . . . 2.53 112.033 -173.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.54 -49.16 73.39 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.281 1.432 . . . . 0.82 111.611 178.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -72.95 -46.14 54.13 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.521 -0.737 . . . . 3.17 111.341 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.85 -37.13 18.6 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.635 0.731 . . . . 6.09 110.951 169.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.822 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -75.96 -47.35 25.43 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.301 1.44 . . . . 0.53 112.326 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 74.3 t -54.66 -38.5 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 120.027 1.285 . . . . 0.62 110.398 171.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 85.5 mt -60.37 -55.01 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 118.403 -0.808 . . . . 0.93 110.364 170.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.4 t -56.09 -40.98 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.537 1.062 . . . . 0.64 112.569 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -64.35 -36.98 85.88 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.265 -0.897 . . . . 1.07 111.566 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.5 t -80.84 -35.98 15.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 124.363 1.065 . . . . 0.74 111.339 -178.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.457 ' CD ' ' HZ2' ' A' ' 21' ' ' LYS . 14.6 tm-20 -54.83 -49.96 69.78 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.032 0.933 . . . . 2.88 109.98 164.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.535 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 6.3 t30 -66.14 -9.48 31.94 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.496 1.295 . . . . 2.64 114.496 -170.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -112.46 -50.42 2.9 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.729 1.211 . . . . 2.56 113.631 -178.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -59.68 -25.87 65.1 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.368 1.44 . . . . 2.02 112.912 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.535 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 7.3 ptmt -53.64 -20.45 5.29 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.623 -1.298 . . . . 2.11 114.437 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -80.3 -2.86 47.05 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.43 1.27 . . . . 2.58 114.43 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.475 0.821 0 C-N-CA 126.298 1.839 . . . . 2.7 109.53 171.285 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.9 pt . . . . . 0 CA--C 1.537 0.465 0 N-CA-C 109.735 -0.468 . . . . 2.5 109.735 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.7 t -71.82 129.72 39.33 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 120.549 -1.344 . . . . 2.79 109.932 166.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.6 mttp -61.53 -20.52 63.34 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.023 -1.048 . . . . 2.3 111.815 173.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.8 m -68.72 -28.41 66.8 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.357 -0.839 . . . . 2.36 112.99 172.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.2 m -74.98 -21.42 59.16 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 120.029 1.286 . . . . 1.25 113.71 -173.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -63.15 -57.26 11.14 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.656 -1.278 . . . . 1.86 112.021 165.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -60.65 -30.06 69.65 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.849 -0.532 . . . . 2.92 112.227 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.98 -58.64 5.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.31 2.244 . . . . 3.51 110.266 171.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -52.53 -37.66 58.05 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 127.798 2.439 . . . . 1.4 113.868 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 58.9 mt -56.68 -16.17 5.83 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 115.088 1.514 . . . . 1.19 115.088 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . 0.253 0.1 OUTLIER -110.87 11.42 22.36 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 115.058 1.503 . . . . 2.2 115.058 171.786 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.94 -56.28 2.22 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.54 1.136 . . . . 1.76 111.532 164.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -81.28 -46.86 14.14 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.327 -0.858 . . . . 3.12 112.344 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.43 15.4 3.06 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.385 -1.447 . . . . 2.09 114.295 -172.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.15 29.69 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 130.582 3.553 . . . . 2.33 118.226 -174.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.428 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 21.4 m-70 -126.89 -67.1 0.87 Allowed 'General case' 0 CA--C 1.545 0.786 0 O-C-N 120.07 -1.644 . . . . 1.75 111.705 -178.054 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.3 ptp -65.3 -11.83 45.61 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.301 1.41 . . . . 2.15 114.181 167.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.4 tp -58.44 99.54 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.12 1.768 . . . . 2.35 110.286 -176.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.19 61.39 6.8 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.412 1.085 . . . . 4.45 110.143 -171.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.1 t70 48.1 -135.74 1.04 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 127.318 2.247 . . . . 5.0 112.904 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.4 p -76.61 -37.89 55.67 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 127.082 2.153 . . . . 2.75 111.18 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.82 -40.58 93.19 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 119.166 0.893 . . . . 1.65 111.824 175.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -68.81 -56.91 6.51 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.326 1.051 . . . . 3.14 111.259 172.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -56.4 -39.27 72.72 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 114.459 1.281 . . . . 4.85 114.459 -176.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 48.6 mmtt -54.15 -38.19 65.24 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.67 1.577 . . . . 3.02 113.45 174.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.14 -30.02 61.54 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.869 -1.062 . . . . 1.07 113.423 175.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.61 -47.96 65.33 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.173 0.897 . . . . 0.81 111.206 171.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -63.46 -32.36 73.78 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.433 1.093 . . . . 2.04 112.825 -175.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -57.27 -32.24 66.41 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 119.287 0.949 . . . . 3.34 113.35 173.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -75.58 -43.54 47.77 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.01 0.924 . . . . 0.94 111.637 175.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 27.0 mm -59.88 -45.21 95.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 117.847 0.294 . . . . 1.05 110.671 -170.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -59.28 -40.4 85.98 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.837 0.827 . . . . 2.37 113.094 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -65.2 -23.83 67.2 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.794 1.238 . . . . 2.99 112.486 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -93.21 -33.68 13.89 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 125.827 1.651 . . . . 2.37 113.171 174.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -58.71 -28.87 66.21 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.663 -1.273 . . . . 2.72 112.961 163.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.34 -14.43 62.92 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.115 1.524 . . . . 1.92 115.115 167.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -136.69 3.1 2.72 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.972 1.841 . . . . 2.55 115.972 -165.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.414 ' CD2' ' HA ' ' A' ' 74' ' ' ILE . 0.2 OUTLIER -150.54 127.89 11.37 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 119.789 -1.819 . . . . 3.38 112.231 -171.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -58.71 13.13 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 130.494 3.518 . . . . 4.77 115.134 173.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.47 -18.96 4.12 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 118.537 -2.602 . . . . 3.24 111.745 -162.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -44.19 135.83 4.22 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.181 1.49 . . . . 4.5 107.232 150.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.414 ' HA ' ' CD2' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -140.23 146.77 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.983 0.897 . . . . 3.35 109.367 171.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 16.1 m -56.69 167.82 0.69 Allowed 'General case' 0 CA--C 1.552 1.057 0 CA-C-O 121.995 0.902 . . . . 1.87 111.969 162.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -76.23 -33.16 59.21 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-O 124.258 1.98 . . . . 2.31 109.874 160.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.31 -20.38 48.09 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 130.284 3.434 . . . . 3.67 110.859 -162.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -68.11 -58.46 4.44 Favored 'General case' 0 C--O 1.22 -0.475 0 C-N-CA 127.242 2.217 . . . . 4.85 111.859 176.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -48.32 -49.14 35.26 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 121.395 1.907 . . . . 1.75 111.937 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 14.7 t-105 -59.68 -47.71 84.56 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 118.802 -0.618 . . . . 1.0 110.84 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 94.6 m -58.59 -51.29 70.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.958 1.303 . . . . 2.59 111.249 175.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.8 mt -58.6 -33.35 69.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.33 1.452 . . . . 1.16 113.227 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 19.5 mm -50.6 -42.48 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 CA-C-N 120.441 1.473 . . . . 0.69 111.047 173.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.94 -17.88 37.96 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.455 1.026 . . . . 0.71 114.776 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.75 -24.21 60.69 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-N 118.472 1.136 . . . . 0.78 113.741 174.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.6 mp -95.32 -44.32 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 119.398 1.599 . . . . 0.74 109.704 169.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.8 m -74.29 54.07 0.54 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.167 2.187 . . . . 1.25 109.983 165.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -124.1 -77.79 0.35 Allowed Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.532 1.539 . . . . 0.81 111.182 177.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.88 -46.84 0.68 Allowed 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 123.323 2.682 . . . . 0.93 112.685 -174.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -76.11 -16.38 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 113.195 0.813 . . . . 1.28 113.195 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.89 -31.38 64.64 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.34 0.867 . . . . 1.22 113.34 -169.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -45.84 90.87 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.283 -0.886 . . . . 2.86 111.777 168.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -57.81 -36.75 72.67 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 123.83 0.852 . . . . 1.68 111.493 -173.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.1 mt -48.42 -59.7 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.72 1.208 . . . . 1.13 110.699 171.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -64.39 -32.93 74.75 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.379 -0.825 . . . . 1.82 112.978 -176.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.322 3.1 pt-20 -81.91 -22.66 36.68 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 112.989 0.737 . . . . 2.91 112.989 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -68.15 -41.48 81.51 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 125.381 1.472 . . . . 3.0 113.761 167.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.08 -40.42 76.91 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.642 1.11 . . . . 2.67 110.371 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 . . . . . 0 N--CA 1.476 0.855 0 C-N-CA 123.339 0.656 . . . . 3.14 111.28 173.899 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.428 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 15.6 m-85 . . . . . 0 N--CA 1.472 0.642 0 N-CA-C 113.481 0.919 . . . . 2.37 113.481 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.4 t -67.43 152.92 44.84 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.514 0.726 . . . . 3.27 111.73 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -64.86 -31.65 72.98 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 114.149 1.166 . . . . 2.59 114.149 -159.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.77 -46.39 84.62 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.524 1.056 . . . . 0.87 110.184 177.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.25 -50.34 22.85 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.136 -0.935 . . . . 3.11 110.913 -176.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -38.43 -50.17 1.5 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.479 1.036 . . . . 4.16 113.239 164.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.822 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.19 -37.39 80.89 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 118.234 -0.889 . . . . 0.5 112.553 -177.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 70.4 t -61.43 -40.2 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.842 1.201 . . . . 0.62 110.477 169.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 48.0 mt -58.72 -51.12 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 119.452 1.024 . . . . 0.77 109.894 170.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.425 HG21 ' HG2' ' A' ' 7' ' ' GLU . 19.7 t -61.95 -41.02 89.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.799 1.24 . . . . 0.57 112.717 -176.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.7 mp -63.72 -43.39 96.68 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.287 -0.883 . . . . 0.97 111.078 175.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 54.1 t -71.66 -36.16 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.861 0.865 . . . . 0.63 112.142 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . 0.431 ' CD ' ' HZ2' ' B' ' 124' ' ' LYS . 10.0 tm-20 -55.07 -51.06 67.55 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.496 1.118 . . . . 3.21 110.358 166.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . 0.54 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 5.5 t30 -64.32 -6.52 7.14 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.947 1.462 . . . . 2.47 114.947 -174.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -110.24 -57.37 2.21 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.988 1.315 . . . . 2.25 112.856 -178.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -61.5 -20.86 63.67 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.426 1.012 . . . . 2.09 113.45 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . 0.54 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 5.9 ptmt -53.86 -19.36 4.33 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 120.278 -1.513 . . . . 2.0 114.598 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -81.14 -1.66 45.35 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 114.406 1.261 . . . . 2.52 114.406 174.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 29.4 m . . . . . 0 N--CA 1.477 0.918 0 C-N-CA 125.503 1.521 . . . . 2.59 110.778 172.569 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 29.7 pt . . . . . 0 N--CA 1.468 0.475 0 N-CA-C 108.72 -0.845 . . . . 2.54 108.72 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 41.7 t -61.21 122.2 14.47 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.918 -1.114 . . . . 2.68 109.726 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 14.2 mttp -64.45 -17.35 63.74 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 120.961 -1.087 . . . . 2.64 111.379 177.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 37.0 m -63.98 -29.54 70.69 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.331 -0.856 . . . . 2.28 112.778 167.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 58.6 m -74.83 -20.89 59.57 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.967 1.258 . . . . 1.3 113.733 -174.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.18 -58.68 5.38 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.171 1.35 . . . . 1.97 110.744 167.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.6 ptt180 -60.49 -27.04 67.27 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.658 -0.651 . . . . 3.38 112.475 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -66.82 -58.61 4.69 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.259 1.824 . . . . 3.62 110.601 169.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.9 tmm? -50.98 -39.11 54.71 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 127.744 2.418 . . . . 1.25 113.514 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 75.2 mt -63.14 -0.03 0.69 Allowed 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 116.106 1.891 . . . . 1.57 116.106 175.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . 0.263 0.1 OUTLIER -118.46 9.88 12.49 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.27 1.582 . . . . 2.19 115.27 164.044 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.91 -64.36 1.19 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.29 1.436 . . . . 1.75 111.826 168.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -76.57 -30.2 56.95 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.778 0.717 . . . . 3.13 111.511 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 mp -100.98 77.78 1.87 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.777 0.798 . . . . 1.88 110.87 165.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -109.68 0.7 19.09 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.74 1.385 . . . . 2.07 114.74 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -109.9 -39.83 4.95 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.9 1.227 . . . . 1.63 113.671 -171.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 17.3 ptp -85.41 -15.78 41.94 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.766 -1.209 . . . . 2.4 113.714 171.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.65 103.41 0.25 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 126.357 1.863 . . . . 2.34 111.575 -166.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.406 ' H ' ' ND2' ' B' ' 158' ' ' ASN . 0.9 OUTLIER -85.14 59.1 5.42 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.076 0.951 . . . . 4.53 110.841 -172.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . 0.417 ' CG ' ' H ' ' B' ' 156' ' ' THR . 35.3 t70 50.19 -139.7 0.86 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 127.042 2.137 . . . . 4.81 112.395 -176.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . 0.417 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 18.9 p -77.34 -35.58 54.58 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 126.669 1.988 . . . . 2.99 111.485 -167.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.3 -41.65 95.11 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 119.773 1.17 . . . . 1.72 111.509 176.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . 0.406 ' ND2' ' H ' ' B' ' 154' ' ' SER . 35.0 t-20 -66.62 -55.82 13.53 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.955 1.302 . . . . 3.01 111.346 173.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -53.36 -39.36 64.12 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.573 1.323 . . . . 5.0 114.573 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -60.34 -33.6 72.63 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.603 1.547 . . . . 3.08 113.511 177.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -56.21 -28.16 57.31 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 118.148 -0.929 . . . . 1.05 113.095 175.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.73 -48.68 63.19 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 118.757 0.708 . . . . 0.92 111.657 169.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -65.88 -30.87 71.54 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.174 0.99 . . . . 2.22 113.174 -173.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 23.5 mtmt -58.16 -30.38 66.34 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.19 0.905 . . . . 3.45 113.351 171.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 5.9 mt -80.77 -42.51 21.65 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.145 0.978 . . . . 1.02 111.742 174.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 16.1 mm -58.12 -44.73 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 CA-C-N 118.556 0.617 . . . . 1.08 110.701 -173.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -56.49 -42.23 77.94 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.655 0.613 . . . . 2.58 112.655 177.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -65.57 -25.8 67.58 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.504 1.121 . . . . 2.79 113.275 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.24 -37.47 9.66 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.888 1.275 . . . . 2.65 113.131 -177.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -65.69 -22.45 66.63 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 120.904 -1.122 . . . . 3.24 112.418 165.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.57 -23.54 62.62 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.729 1.381 . . . . 2.01 114.729 164.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -118.31 -9.86 10.33 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.853 1.797 . . . . 2.53 115.853 -169.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -140.83 129.44 22.76 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 120.887 1.676 . . . . 3.99 112.721 -171.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -64.09 70.41 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 126.993 2.117 . . . . 4.63 112.986 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 57.05 -1.75 0.11 Allowed Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.467 1.508 . . . . 3.96 114.209 -167.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 15.3 mmt85 -69.39 144.53 53.36 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 118.675 1.237 . . . . 4.74 109.1 -172.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.7 mt -126.86 138.15 55.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 104.767 -2.309 . . . . 3.93 104.767 156.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 39.3 m -74.98 -100.31 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.663 -0.648 . . . . 2.21 110.086 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -151.85 -66.72 0.17 Allowed 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.278 -1.513 . . . . 2.42 109.339 166.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -22.2 -46.91 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 130.486 3.515 . . . . 3.22 114.808 149.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -48.63 -61.65 1.92 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.583 1.953 . . . . 4.8 115.291 169.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -54.85 -42.54 72.11 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 119.759 -1.838 . . . . 1.83 111.56 -178.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 18.6 t-105 -62.09 -44.75 95.98 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.959 0.903 . . . . 0.95 111.509 178.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 90.6 m -61.26 -44.93 96.44 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.956 1.702 . . . . 2.45 111.302 174.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.7 mt -62.28 -32.67 73.42 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 117.32 -1.324 . . . . 1.08 112.794 177.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 26.4 mm -52.94 -42.13 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 121.556 1.98 . . . . 0.65 110.684 173.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.82 -9.86 35.55 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 125.153 1.358 . . . . 0.68 115.115 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -83.67 -21.67 57.49 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-N 119.023 1.412 . . . . 0.86 113.528 169.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.7 mp -100.12 -52.1 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 118.771 1.285 . . . . 0.8 109.187 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 18.2 m -75.46 58.89 1.05 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.395 2.278 . . . . 1.41 109.269 166.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -141.94 -70.54 0.03 OUTLIER Glycine 0 CA--C 1.526 0.725 0 C-N-CA 126.183 1.849 . . . . 0.93 110.15 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.23 -51.67 3.35 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.959 2.439 . . . . 1.13 112.051 175.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 1.8 pp -81.64 -13.74 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 113.038 0.755 . . . . 1.31 113.038 -174.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.26 -31.64 72.12 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.221 0.822 . . . . 1.07 113.221 -170.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.62 -46.82 77.33 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.538 -0.726 . . . . 2.93 112.558 167.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.9 tt -60.17 -34.62 73.83 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.588 -0.72 . . . . 1.4 111.379 -172.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 62.3 mt -51.46 -61.91 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.65 1.18 . . . . 1.07 109.853 171.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -59.47 -36.15 75.45 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.835 0.68 . . . . 1.97 112.835 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.345 3.1 pt-20 -80.19 -22.29 42.06 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 112.746 0.647 . . . . 2.99 112.746 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -70.61 -39.87 73.5 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 125.003 1.321 . . . . 2.82 113.617 167.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -53.54 -40.81 65.81 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.918 1.235 . . . . 2.52 110.506 175.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -48.13 76.62 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.267 1.027 . . . . 3.24 110.936 177.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 . . . . . 0 CA--C 1.541 0.622 0 N-CA-C 113.725 1.009 . . . . 5.72 113.725 179.798 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 . . . . . 0 C--O 1.246 0.9 0 CA-C-O 119.748 -0.168 . . . . 2.18 111.148 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.0 p -75.13 165.75 24.73 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.185 0.594 . . . . 1.05 111.962 -175.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -58.68 -44.98 90.39 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.445 0.698 . . . . 2.7 110.643 173.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.87 -38.61 86.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.194 1.398 . . . . 0.94 110.134 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -73.09 -53.79 10.16 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.085 -1.01 . . . . 2.95 110.931 -177.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.0 mmtp -54.82 -33.32 61.45 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.777 -1.202 . . . . 4.84 112.296 168.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.795 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.95 -45.09 83.03 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 117.955 -1.022 . . . . 0.75 112.425 169.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.6 t -58.53 -38.62 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-N 120.745 1.611 . . . . 0.89 110.458 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.7 mt -56.34 -52.95 45.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 118.042 -0.98 . . . . 1.05 111.323 165.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -61.52 -33.93 59.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 120.759 1.618 . . . . 0.73 114.094 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.19 -36.48 79.64 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 120.424 -1.422 . . . . 1.01 111.124 172.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 43.9 t -74.35 -34.94 38.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 123.707 0.803 . . . . 0.68 110.855 178.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.55 -53.8 54.05 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.897 1.279 . . . . 3.45 111.122 164.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.465 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 21.0 t-20 -52.93 -28.92 25.71 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.83 1.418 . . . . 3.55 114.83 -178.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -81.33 -61.75 1.85 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.121 0.785 . . . . 2.24 113.121 168.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -64.0 -29.12 70.3 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.736 0.643 . . . . 1.81 112.736 -167.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.465 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 12.5 ptmt -51.36 -27.19 9.14 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.867 1.062 . . . . 2.34 113.867 173.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -94.95 -8.97 35.44 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 115.362 1.616 . . . . 2.68 115.362 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.7 m . . . . . 0 N--CA 1.484 1.257 0 CA-C-N 120.312 1.415 . . . . 2.5 109.606 167.609 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 15.4 tt . . . . . 0 N--CA 1.468 0.457 0 N-CA-C 109.115 -0.698 . . . . 3.19 109.115 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.8 t -113.36 163.53 14.73 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.729 0.776 . . . . 2.3 110.623 167.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -53.63 -27.66 28.44 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.385 1.074 . . . . 4.62 113.696 168.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.9 p -72.36 -25.81 61.67 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.695 0.998 . . . . 2.36 113.695 172.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 m -78.08 -49.1 14.59 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.805 0.842 . . . . 1.54 111.257 -175.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -48.07 -57.61 5.58 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.798 1.239 . . . . 2.24 112.024 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 13.4 ptt85 -59.23 -15.53 15.82 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.011 1.115 . . . . 4.29 114.011 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -109.66 -26.05 10.09 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 114.513 1.301 . . . . 3.33 114.513 -176.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 10.5 tmm? -53.06 -45.48 68.13 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 109.003 -0.74 . . . . 1.7 109.003 151.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.8 mt -64.1 -11.77 33.04 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.114 1.524 . . . . 1.25 115.114 172.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -101.23 -23.3 14.45 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.1 0.96 . . . . 2.38 113.582 172.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -99.71 -41.28 7.36 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.257 1.206 . . . . 1.71 114.257 178.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -100.95 -20.45 15.43 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.89 1.276 . . . . 3.11 114.356 -168.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.5 mt -118.48 41.4 2.98 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.534 1.534 . . . . 2.48 111.406 165.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -70.72 -15.94 62.74 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.648 1.351 . . . . 1.46 114.648 -172.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -94.59 -15.44 24.06 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.547 1.067 . . . . 1.83 112.542 -170.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.2 mmm -80.64 14.62 2.02 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 126.153 1.781 . . . . 1.93 114.703 174.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.3 mp -99.01 128.37 45.13 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.758 2.023 . . . . 3.01 111.914 -176.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -109.49 -1.94 17.98 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.722 1.209 . . . . 4.58 112.78 169.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -177.5 170.06 2.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 129.758 3.223 . . . . 4.32 106.387 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -31.83 -39.08 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 125.329 1.452 . . . . 2.37 112.573 147.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.13 -41.08 52.88 Favored Glycine 0 N--CA 1.473 1.16 0 C-N-CA 128.806 3.098 . . . . 1.68 115.608 -171.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -59.22 -41.17 88.03 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 117.874 0.837 . . . . 3.47 110.563 172.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 74.8 mtm-85 -73.5 -36.58 65.78 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 118.169 -0.919 . . . . 4.85 112.79 172.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.3 mtmm -54.88 -28.94 54.11 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 121.485 1.948 . . . . 5.06 112.516 171.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.12 -19.16 60.67 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 115.592 1.701 . . . . 1.23 115.592 170.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.87 -52.67 9.84 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.565 1.146 . . . . 0.81 110.191 161.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -66.42 -31.33 72.02 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.984 0.914 . . . . 2.16 112.493 -170.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.8 ptmm? -55.76 -25.0 38.63 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.302 1.223 . . . . 3.54 114.302 166.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 12.0 mt -84.92 -43.09 14.37 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.31 1.044 . . . . 0.78 111.379 172.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.7 mm -51.83 -39.74 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.102 1.361 . . . . 0.8 112.12 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -69.91 -30.13 67.47 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.348 1.459 . . . . 1.91 113.899 177.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -85.66 -23.75 27.34 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.09 1.756 . . . . 3.34 112.742 175.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.14 -26.09 68.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.868 1.267 . . . . 4.01 112.456 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -67.11 -13.25 61.76 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.485 1.914 . . . . 2.8 114.499 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -78.69 -6.11 54.89 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.192 0.812 . . . . 4.06 113.192 166.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -132.07 -34.54 1.26 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.78 1.232 . . . . 3.92 114.192 -169.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.8 m170 -110.28 67.78 0.65 Allowed 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.345 -1.472 . . . . 4.37 114.764 -165.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -74.44 67.17 1.44 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.564 1.545 . . . . 4.32 111.996 173.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.67 -40.0 0.94 Allowed Glycine 0 CA--C 1.532 1.147 0 C-N-CA 126.285 1.898 . . . . 2.52 113.502 -177.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -68.14 76.51 0.24 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 127.924 2.489 . . . . 8.47 110.369 173.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.7 mm -65.58 139.01 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 O-C-N 121.425 -0.797 . . . . 2.73 109.814 171.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 t -91.92 167.27 12.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.414 1.086 . . . . 1.66 112.864 176.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -72.72 -57.8 3.83 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.752 0.787 . . . . 2.08 109.731 160.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.09 -35.81 62.5 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.933 2.093 . . . . 3.37 112.946 -167.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -73.23 -22.89 60.33 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 113.722 1.008 . . . . 5.94 113.722 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -57.01 -48.81 77.59 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 119.552 -1.968 . . . . 2.08 110.51 166.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.7 t-105 -67.2 -41.99 84.91 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.691 -0.671 . . . . 0.85 111.502 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.62 -41.66 92.45 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 119.342 0.973 . . . . 2.74 112.049 171.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.66 -37.48 78.84 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.524 1.056 . . . . 0.88 112.525 176.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 40.0 mm -55.06 -42.82 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 CA-C-N 120.7 1.591 . . . . 0.85 111.802 173.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.97 -27.63 73.62 Favored Glycine 0 CA--C 1.531 1.063 0 CA-C-N 118.54 0.609 . . . . 1.05 112.588 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.25 -20.38 71.22 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 118.164 0.982 . . . . 0.73 113.983 177.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 mp -91.74 -50.07 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.512 1.125 . . . . 0.85 110.107 162.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.8 m -81.96 46.36 1.0 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.441 2.297 . . . . 1.68 112.097 -171.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.59 -70.97 0.57 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 126.084 1.802 . . . . 1.08 110.514 175.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -61.61 -45.28 18.18 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.012 2.475 . . . . 1.06 112.82 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.3 pt -73.12 -14.91 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 114.435 1.272 . . . . 1.06 114.435 177.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.6 -40.57 83.61 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.094 0.861 . . . . 1.07 113.198 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -40.17 91.3 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 117.741 -1.584 . . . . 2.8 111.663 171.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -39.07 91.59 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 124.053 0.941 . . . . 1.47 111.353 -175.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -53.9 -58.52 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 123.982 0.913 . . . . 1.08 110.893 166.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -63.44 -36.68 84.53 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.946 -1.096 . . . . 1.85 113.08 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.279 2.6 pt-20 -81.29 -13.02 58.89 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.822 0.849 . . . . 3.08 112.222 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.44 ' C ' ' H ' ' A' ' 99' ' ' GLN . 0.4 OUTLIER -72.82 -35.17 67.24 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 125.082 1.353 . . . . 2.12 113.232 165.094 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -71.54 16.62 0.1 Allowed 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 123.935 1.826 . . . . 3.56 111.505 168.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . 0.44 ' H ' ' C ' ' A' ' 97' ' ' GLN . 4.2 mm-40 . . . . . 0 CA--C 1.534 0.356 0 C-N-CA 126.068 1.747 . . . . 2.56 109.184 174.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 . . . . . 0 C--O 1.243 0.735 0 N-CA-C 109.923 -0.399 . . . . 2.22 109.923 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.9 p -73.17 162.88 28.9 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.138 0.427 . . . . 0.88 110.994 -175.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -60.14 -43.93 95.32 Favored 'General case' 0 C--O 1.221 -0.431 0 O-C-N 121.359 -0.838 . . . . 2.1 111.196 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.87 -41.75 71.2 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.48 1.512 . . . . 0.89 110.694 175.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -72.91 -54.81 7.73 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.421 1.088 . . . . 3.04 112.249 -175.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -56.27 -26.9 53.44 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.89 1.276 . . . . 4.87 112.239 168.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.795 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -76.73 -40.34 48.91 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 120.451 -1.406 . . . . 0.97 112.608 169.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 37.3 t -58.81 -30.42 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 120.924 1.693 . . . . 0.91 110.624 171.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 70.7 mt -58.22 -57.4 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 119.448 1.022 . . . . 1.19 110.763 164.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 41.2 t -55.26 -38.56 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 125.656 1.582 . . . . 0.76 114.617 177.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.7 mp -66.37 -33.96 76.88 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.408 -1.432 . . . . 1.17 111.858 174.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 52.5 t -78.45 -33.59 17.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.157 0.583 . . . . 0.71 110.768 -178.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -56.41 -51.58 67.85 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.797 0.839 . . . . 3.6 111.563 164.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . 0.47 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 19.2 t-20 -52.65 -29.55 26.91 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.927 1.455 . . . . 3.6 114.927 -177.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -82.37 -60.18 2.29 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.017 0.747 . . . . 2.08 113.017 170.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -63.11 -29.3 70.69 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 119.01 -0.519 . . . . 1.81 112.217 -166.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 10.7 ptmt -51.31 -25.44 5.88 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.931 1.292 . . . . 2.14 114.137 172.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -98.24 -9.41 25.62 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 115.083 1.512 . . . . 2.8 115.083 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.482 1.141 0 CA-C-N 119.818 1.19 . . . . 2.45 109.158 166.71 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 19.9 tt . . . . . 0 N--CA 1.47 0.54 0 N-CA-C 109.754 -0.462 . . . . 3.27 109.754 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 30.2 t -94.04 149.15 21.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.6 0.714 . . . . 2.4 110.677 166.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 57.9 pttt -52.43 -20.56 2.92 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.772 1.229 . . . . 4.39 113.975 164.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 92.8 p -81.56 -21.31 38.55 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.354 1.242 . . . . 2.07 114.354 169.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 14.0 m -78.06 -45.4 23.65 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.916 -1.115 . . . . 1.22 111.408 -175.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -47.07 -58.36 4.09 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.625 1.17 . . . . 2.34 111.516 178.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 18.1 ptt85 -58.57 -14.98 9.44 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.438 1.495 . . . . 3.83 113.652 -178.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -107.86 -31.01 8.19 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 114.706 1.373 . . . . 2.84 114.706 -178.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . 0.424 ' CG ' HD21 ' B' ' 121' ' ' ASN . 7.4 tmm? -52.52 -44.42 65.72 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.651 -0.499 . . . . 1.43 109.651 156.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.5 mt -59.9 -22.34 62.25 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.931 1.692 . . . . 1.01 114.182 173.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -94.65 -15.2 24.18 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.411 1.084 . . . . 2.42 112.979 177.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.17 -41.54 5.11 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.91 1.078 . . . . 1.66 113.91 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -100.24 -15.99 17.89 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.369 1.468 . . . . 3.11 113.899 -171.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 96.9 mt -125.38 38.33 4.2 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.296 1.839 . . . . 2.44 111.966 166.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -69.57 -17.73 63.58 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.827 1.417 . . . . 1.3 114.827 -172.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -88.93 -0.79 57.7 Favored 'General case' 0 CA--C 1.555 1.153 0 O-C-N 120.565 -1.334 . . . . 1.64 112.375 -171.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 4.5 mmm -101.71 12.97 36.23 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.273 2.229 . . . . 1.95 113.447 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 9.2 mp -96.71 128.64 43.85 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.734 2.014 . . . . 3.02 111.412 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 33.0 t -112.23 -1.75 15.1 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.117 1.367 . . . . 4.75 112.808 169.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -178.04 170.8 1.81 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 129.751 3.22 . . . . 4.5 106.917 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 m -33.24 -40.0 0.06 Allowed 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 125.133 1.373 . . . . 2.68 111.915 148.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.09 -42.49 39.95 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 128.394 2.902 . . . . 1.73 115.389 -171.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -58.35 -43.56 88.38 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 117.642 0.721 . . . . 3.45 110.78 172.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 83.2 mtm-85 -69.68 -39.52 76.92 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 118.244 -0.884 . . . . 4.94 112.467 172.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 17.2 mtmm -54.16 -29.58 46.12 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 121.35 1.886 . . . . 4.95 112.299 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -75.29 -19.37 59.72 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 115.282 1.586 . . . . 1.18 115.282 171.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -76.37 -54.29 6.96 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.141 1.376 . . . . 0.76 110.395 161.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -66.43 -31.82 72.8 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.87 0.868 . . . . 2.01 112.394 -169.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 6.0 ptmm? -56.17 -25.56 47.22 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.774 1.028 . . . . 3.48 113.774 167.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.6 mt -84.54 -41.78 16.15 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.216 1.007 . . . . 0.75 111.391 174.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 20.3 mm -54.57 -43.1 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.385 1.074 . . . . 0.81 111.233 -177.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -65.09 -27.87 69.06 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.861 1.264 . . . . 1.74 113.68 176.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -85.21 -24.22 27.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.956 1.303 . . . . 3.41 112.782 174.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 14.2 tp -66.88 -23.85 66.05 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.596 1.158 . . . . 3.83 112.355 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.46 -25.08 34.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.223 2.209 . . . . 3.14 114.326 166.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.2 -9.08 59.04 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.601 0.963 . . . . 3.74 113.601 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -130.61 -33.05 1.66 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.259 1.207 . . . . 3.46 114.259 -166.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 22.4 m170 -114.21 74.76 0.89 Allowed 'General case' 0 CA--C 1.548 0.88 0 O-C-N 120.463 -1.398 . . . . 4.18 114.749 -168.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -82.67 76.76 9.51 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.002 0.921 . . . . 4.06 110.824 166.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.61 -41.5 1.2 Allowed Glycine 0 N--CA 1.478 1.46 0 C-N-CA 126.518 2.009 . . . . 2.67 114.598 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -68.52 82.83 0.27 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 128.064 2.546 . . . . 8.64 109.967 171.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 26.6 mm -72.41 136.62 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 O-C-N 120.877 -1.14 . . . . 2.71 109.519 171.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 8.4 t -94.06 137.67 33.0 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.457 1.103 . . . . 1.79 111.275 170.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -50.14 -54.49 20.36 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.487 1.115 . . . . 2.22 110.28 171.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.65 -30.67 65.59 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.813 2.045 . . . . 3.49 112.278 -170.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -74.29 -22.93 59.06 Favored 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 113.049 0.759 . . . . 5.91 113.049 -177.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -58.63 -47.32 84.8 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 119.503 -1.998 . . . . 2.1 110.471 165.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 19.0 t-105 -68.59 -37.61 79.97 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.144 -0.931 . . . . 0.85 111.724 -173.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 82.3 p -63.09 -47.09 84.35 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 119.649 1.113 . . . . 2.6 110.689 171.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.29 -37.71 81.36 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.087 -0.959 . . . . 0.88 112.85 -178.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 39.6 mm -54.62 -41.89 57.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 CA-C-N 120.589 1.54 . . . . 0.83 111.467 173.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.55 -26.31 73.69 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 123.684 0.659 . . . . 1.01 112.789 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -67.52 -19.99 71.38 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-N 118.097 0.949 . . . . 0.69 113.326 177.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.8 mp -96.71 -46.47 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 CA-C-N 118.284 1.042 . . . . 0.85 110.132 165.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 2.9 m -81.15 39.43 0.51 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.042 2.137 . . . . 1.7 112.351 -175.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -108.97 -70.62 0.68 Allowed Glycine 0 CA--C 1.529 0.96 0 C-N-CA 126.149 1.833 . . . . 0.99 110.174 173.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -61.02 -43.39 30.36 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.057 2.505 . . . . 0.94 113.029 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 11.1 pt -75.15 -17.56 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 114.454 1.279 . . . . 1.04 114.454 177.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -58.36 -42.51 87.12 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.548 1.067 . . . . 1.01 113.588 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.29 -41.62 89.41 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.979 1.263 . . . . 2.98 111.993 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -40.22 90.78 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 123.997 0.919 . . . . 1.72 111.714 -176.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 88.0 mt -52.85 -63.09 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.591 0.756 . . . . 1.02 110.041 168.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -59.09 -37.19 76.54 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.292 -0.88 . . . . 1.78 112.906 -175.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.295 2.5 pt-20 -78.02 -18.29 56.05 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 112.385 0.513 . . . . 3.21 112.385 178.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.99 -35.02 59.75 Favored 'General case' 0 C--N 1.344 0.334 0 C-N-CA 125.392 1.477 . . . . 2.1 114.611 169.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -65.19 -1.13 2.03 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 122.801 1.286 . . . . 2.98 111.736 171.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -112.89 -70.16 0.82 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.001 1.721 . . . . 2.83 109.597 177.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 . . . . . 0 N--CA 1.483 1.206 0 C-N-CA 131.695 3.998 . . . . 4.33 116.413 177.15 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.481 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 50.8 m-85 . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 115.948 1.832 . . . . 2.09 115.948 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.6 p -65.5 158.27 27.37 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.164 0.585 . . . . 0.98 109.975 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -60.5 -31.05 70.12 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 117.885 -1.055 . . . . 3.73 110.908 172.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.22 -41.3 85.94 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.057 1.299 . . . . 0.83 111.278 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -55.99 9.87 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.886 0.874 . . . . 2.92 110.722 178.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -45.05 -43.82 9.68 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.762 1.625 . . . . 4.7 113.593 166.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.875 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.08 -45.86 83.54 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.553 1.141 . . . . 0.51 113.088 173.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.99 -41.06 87.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 120.248 1.385 . . . . 0.66 110.608 173.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.6 mt -53.28 -49.7 51.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-N 119.187 0.903 . . . . 0.8 111.331 166.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.4 t -65.6 -35.86 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 119.707 1.139 . . . . 0.54 112.783 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp -65.45 -41.78 93.09 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.862 -1.149 . . . . 0.97 111.338 172.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.0 t -67.4 -43.34 87.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 125.455 1.502 . . . . 0.59 111.917 176.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -53.69 -51.96 61.58 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 119.119 0.872 . . . . 3.23 109.835 168.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.503 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 54.4 t30 -64.13 -23.11 67.2 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.035 1.124 . . . . 2.07 114.035 -169.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -76.24 -61.1 2.06 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.7 0.8 . . . . 2.33 112.335 168.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -67.49 -21.84 65.49 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.984 1.105 . . . . 1.79 113.984 -170.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.503 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 1.6 ptmt -53.69 -21.94 8.01 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.342 1.428 . . . . 2.15 112.975 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -89.98 8.14 33.93 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.453 1.901 . . . . 2.48 115.023 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 125.136 1.374 . . . . 2.4 110.885 173.036 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 16.3 pt . . . . . 0 CA--C 1.546 0.817 0 N-CA-C 113.87 1.063 . . . . 3.4 113.87 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.2 m -125.72 156.82 38.77 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.711 2.004 . . . . 2.57 109.523 171.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -58.07 -21.8 47.43 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 115.343 1.609 . . . . 2.02 115.343 -164.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.4 m -47.85 -42.25 26.05 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 121.269 -0.894 . . . . 2.04 113.304 165.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 m -74.36 -11.6 60.3 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.534 1.309 . . . . 1.89 114.534 -172.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -69.82 -56.71 6.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 121.045 1.748 . . . . 2.14 111.444 165.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -61.78 -26.04 67.84 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.466 0.543 . . . . 2.3 112.466 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -71.52 -50.59 29.86 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.671 1.189 . . . . 3.88 110.625 170.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -59.96 -43.04 95.3 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.886 1.674 . . . . 1.33 112.733 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 31.8 mt -50.69 -36.86 38.06 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.907 1.283 . . . . 1.48 112.434 168.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -83.88 -20.21 33.47 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 118.108 -0.949 . . . . 2.56 112.771 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.52 -45.57 19.04 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.68 1.582 . . . . 2.82 112.117 166.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -90.22 -41.07 11.8 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.926 1.084 . . . . 3.47 113.926 -167.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.4 mt -107.0 28.68 7.78 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.216 1.007 . . . . 2.44 112.803 -170.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -67.63 23.83 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 117.059 2.244 . . . . 1.99 117.059 -171.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.466 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 0.2 OUTLIER -127.65 -42.88 1.59 Allowed 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.267 -1.521 . . . . 2.03 111.731 -178.372 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.9 ptp -77.54 -19.97 54.91 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.667 1.187 . . . . 2.77 113.555 164.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.1 tt -99.92 104.9 16.57 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.254 1.422 . . . . 2.95 111.046 -175.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.3 t -71.63 109.28 5.45 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.581 -0.699 . . . . 5.22 111.3 168.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 49.79 -88.39 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.68 1.992 . . . . 7.26 114.062 136.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.3 p -130.89 -19.91 2.87 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.439 1.495 . . . . 3.47 112.33 167.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.64 -41.44 99.59 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 119.976 1.262 . . . . 2.7 112.081 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -82.88 -48.98 10.14 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 117.552 0.676 . . . . 3.55 112.345 165.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -55.13 -37.13 66.52 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.901 1.445 . . . . 4.97 114.901 -172.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -63.84 -31.58 72.81 Favored 'General case' 0 N--CA 1.479 1.024 0 O-C-N 120.883 -1.136 . . . . 3.36 114.015 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.77 -40.19 96.08 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 122.96 0.504 . . . . 2.1 111.653 168.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.86 98.68 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.131 0.572 . . . . 1.27 112.291 172.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -54.67 -29.66 53.27 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.256 1.022 . . . . 2.58 112.626 174.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -24.72 59.92 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.177 -1.577 . . . . 6.05 114.004 175.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 15.4 mt -65.82 -43.0 89.88 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 120.523 -0.471 . . . . 1.09 110.973 163.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.5 mm -59.61 -48.32 87.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 123.205 0.602 . . . . 0.94 110.739 -177.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -59.32 -38.13 79.53 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.092 0.473 . . . . 1.8 112.258 178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 -65.92 -30.46 71.05 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.782 0.833 . . . . 3.49 113.071 175.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.16 -30.69 22.28 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.351 1.46 . . . . 1.95 111.827 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -64.87 -32.38 74.06 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.441 1.496 . . . . 3.15 113.147 166.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.0 -23.31 66.55 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.122 1.156 . . . . 2.2 114.122 170.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -122.71 -7.84 8.5 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.839 1.792 . . . . 2.45 115.839 -167.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.35 117.97 13.05 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.302 1.865 . . . . 3.44 112.757 -177.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -78.6 63.63 3.44 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.908 2.483 . . . . 4.04 111.926 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.78 7.87 62.6 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.344 0.974 . . . . 2.99 114.228 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.8 mmt85 -70.12 175.16 4.72 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.268 1.427 . . . . 5.63 111.957 176.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 25.0 mm -140.02 150.18 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 126.191 1.797 . . . . 2.35 106.853 161.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.7 t -127.0 165.16 19.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.536 1.534 . . . . 1.52 111.902 169.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -67.62 -51.78 46.14 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 122.54 1.162 . . . . 2.02 111.93 175.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -25.02 67.39 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.422 2.289 . . . . 3.4 113.914 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.6 -59.26 5.45 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.049 1.339 . . . . 3.46 111.888 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -58.06 -42.31 85.21 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.063 -1.023 . . . . 2.33 111.466 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 20.9 t-105 -62.33 -48.27 80.55 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.922 -0.561 . . . . 0.62 111.767 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.1 t -69.82 -32.75 71.35 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 117.637 -1.173 . . . . 1.72 111.718 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.9 mt -66.93 -40.94 87.76 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 117.798 -1.096 . . . . 0.67 112.553 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 12.1 mm -50.26 -44.58 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-N 120.174 1.352 . . . . 0.75 111.688 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.05 -19.13 50.3 Favored Glycine 0 CA--C 1.539 1.545 0 CA-C-O 119.459 -0.634 . . . . 0.63 114.579 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.45 -23.29 60.84 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 118.72 1.26 . . . . 0.6 114.013 177.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -94.98 -44.97 13.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-N 119.446 1.623 . . . . 1.04 109.647 165.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.3 m -83.44 35.43 0.5 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.055 2.542 . . . . 1.48 112.035 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -93.59 -78.9 1.42 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 125.009 1.29 . . . . 1.0 110.761 172.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.2 -41.27 16.86 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.885 2.39 . . . . 1.16 112.263 -176.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -70.17 -12.95 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 113.761 1.023 . . . . 1.2 113.761 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.78 -43.66 92.54 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.343 0.974 . . . . 0.93 111.816 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -61.45 -34.23 75.07 Favored 'General case' 0 C--O 1.221 -0.397 0 O-C-N 120.442 -1.411 . . . . 2.69 112.291 171.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 tt -66.88 -41.08 87.85 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.924 0.89 . . . . 1.24 111.271 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.2 mt -51.37 -62.58 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-O 121.642 0.734 . . . . 0.93 109.541 162.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -60.41 -27.77 67.73 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.113 1.153 . . . . 1.92 114.113 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.305 3.9 pt-20 -89.45 -9.33 50.57 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.715 1.206 . . . . 3.16 112.769 178.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.439 ' C ' ' H ' ' A' ' 99' ' ' GLN . 5.5 tp-100 -89.48 -30.51 18.23 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.882 1.673 . . . . 3.51 111.826 169.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -63.99 6.27 0.18 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 126.849 2.059 . . . . 3.3 113.314 165.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . 0.439 ' H ' ' C ' ' A' ' 97' ' ' GLN . 10.2 mm-40 . . . . . 0 C--N 1.324 -0.533 0 C-N-CA 126.153 1.781 . . . . 2.23 110.273 -173.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.466 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 46.5 m-85 . . . . . 0 N--CA 1.478 0.931 0 N-CA-C 115.554 1.686 . . . . 2.29 115.554 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 36.0 p -64.27 157.79 25.03 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.069 0.947 . . . . 1.06 109.871 178.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -59.59 -33.98 72.15 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-O 117.108 -1.425 . . . . 3.72 110.952 173.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.27 -43.29 95.29 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 120.641 1.564 . . . . 0.83 111.323 176.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -57.52 5.68 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.822 0.849 . . . . 2.95 110.598 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -42.79 -44.25 4.34 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.37 1.868 . . . . 4.75 114.278 164.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.875 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -65.27 -44.75 87.03 Favored 'General case' 0 C--O 1.223 -0.337 0 O-C-N 120.821 -1.175 . . . . 0.52 112.586 174.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.3 -42.66 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.936 1.244 . . . . 0.66 110.506 172.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 71.0 mt -53.03 -48.03 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.344 1.058 . . . . 0.75 110.57 168.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.3 t -66.58 -35.09 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.396 1.078 . . . . 0.62 112.82 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -67.87 -40.0 83.66 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.567 -1.333 . . . . 1.0 111.222 173.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 29.7 t -67.91 -38.48 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 126.036 1.734 . . . . 0.61 111.993 175.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.93 -53.05 62.57 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.153 0.981 . . . . 3.57 110.294 167.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . 0.42 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 27.0 t30 -66.57 -7.34 19.52 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.214 1.561 . . . . 2.11 115.214 -177.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -87.56 -65.43 1.02 Allowed 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.367 -0.833 . . . . 2.48 111.972 160.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -69.69 -22.31 63.43 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.921 1.452 . . . . 1.79 114.921 -166.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . 0.42 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 10.4 ptmt -53.78 -22.34 9.25 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 121.265 1.848 . . . . 2.14 113.436 177.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -84.39 7.82 18.3 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.641 1.976 . . . . 2.55 114.907 176.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 30.9 m . . . . . 0 N--CA 1.476 0.873 0 C-N-CA 125.989 1.715 . . . . 2.5 110.161 170.155 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 18.9 pt . . . . . 0 CA--C 1.551 0.982 0 N-CA-C 114.821 1.415 . . . . 3.17 114.821 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 71.1 m -118.33 155.08 31.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.818 1.247 . . . . 2.64 109.867 165.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -50.92 -36.01 36.25 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.17 1.388 . . . . 1.95 114.144 -171.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 4.9 m -52.34 -17.41 1.16 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.811 2.044 . . . . 1.85 115.43 174.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 1.4 m -75.43 -37.33 60.48 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.502 1.121 . . . . 1.26 112.545 175.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -58.39 -49.74 76.16 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.277 1.031 . . . . 1.99 111.948 -175.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -55.82 -29.2 59.39 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.455 1.102 . . . . 2.23 113.77 175.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -86.69 -44.73 11.6 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.645 1.178 . . . . 3.88 111.365 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 2.7 tmm? -52.67 -45.77 66.92 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.182 0.593 . . . . 1.14 111.641 167.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 21.3 mt -55.51 -52.51 63.45 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.624 1.57 . . . . 1.5 112.869 170.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -61.09 -18.48 58.15 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.7 1.2 . . . . 2.22 113.406 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.29 -44.14 5.25 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.848 1.055 . . . . 2.23 113.848 177.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -79.42 -38.14 35.45 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.715 1.206 . . . . 3.59 113.626 -178.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.7 mt -111.81 28.08 9.08 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.421 0.897 . . . . 2.51 113.421 -169.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -71.09 9.71 0.68 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 116.689 2.107 . . . . 1.51 116.689 -165.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . 0.481 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 0.5 OUTLIER -108.01 -32.13 7.68 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 120.041 -1.662 . . . . 2.05 111.851 -173.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 21.1 ptp -83.01 -27.71 30.17 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.045 1.738 . . . . 2.79 112.473 159.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 5.5 tt -94.79 97.49 10.08 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.089 1.356 . . . . 3.2 110.749 -176.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 30.3 t -74.64 104.36 5.29 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.99 0.9 . . . . 5.2 110.416 167.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 54.75 -100.01 0.1 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.802 1.241 . . . . 7.89 112.809 138.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 41.5 p -130.75 14.29 5.36 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.86 1.664 . . . . 4.13 113.766 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -86.4 -64.7 1.44 Allowed Glycine 0 N--CA 1.466 0.663 0 N-CA-C 109.876 -1.29 . . . . 2.91 109.876 160.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -67.2 -46.34 74.19 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 118.409 -0.805 . . . . 3.77 111.753 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -59.4 -22.91 62.11 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 120.691 1.587 . . . . 4.72 114.95 -176.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp -52.28 -38.1 57.37 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.888 1.222 . . . . 4.33 113.118 168.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -63.88 -48.03 78.27 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.824 0.45 . . . . 1.87 110.91 172.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -56.62 -49.37 75.16 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.523 0.601 . . . . 1.03 111.693 176.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -66.31 -33.0 74.76 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.726 0.811 . . . . 2.39 112.351 -175.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -47.25 82.04 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.004 -1.06 . . . . 6.7 112.894 167.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.67 -47.8 76.12 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.044 0.84 . . . . 1.32 111.019 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 38.9 mm -50.48 -51.64 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 123.404 0.682 . . . . 0.97 110.493 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -73.73 -31.03 63.16 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.322 0.582 . . . . 3.02 112.265 -173.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 38.2 m-20 -62.42 -27.47 69.12 Favored 'General case' 0 CA--C 1.555 1.165 0 N-CA-C 112.548 0.573 . . . . 4.18 112.548 169.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.47 -28.76 20.63 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.999 1.72 . . . . 2.17 111.54 177.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -63.75 -28.97 70.24 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.741 -1.224 . . . . 2.98 113.309 164.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.27 -14.07 62.72 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 114.345 1.239 . . . . 2.29 114.345 166.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -125.71 -13.3 6.47 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 116.628 2.084 . . . . 2.41 116.628 -170.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -139.88 122.35 16.15 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 122.057 2.208 . . . . 3.58 113.233 -174.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -79.07 66.06 4.41 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 127.514 2.325 . . . . 4.1 112.137 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.1 5.57 66.17 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.731 1.157 . . . . 3.2 114.75 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt85 -68.43 178.21 2.08 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.154 1.782 . . . . 5.69 112.415 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 21.5 mm -137.6 151.83 26.49 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 126.84 2.056 . . . . 2.61 105.461 158.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 9.8 t -132.46 164.05 27.41 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.22 1.408 . . . . 1.56 113.277 170.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -63.91 -55.46 22.52 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 122.881 1.324 . . . . 2.29 111.359 175.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -27.27 68.13 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.606 2.363 . . . . 3.53 113.71 178.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -57.04 -60.39 3.65 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.995 1.318 . . . . 3.39 111.153 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -55.42 -46.45 76.67 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.234 -0.916 . . . . 2.21 111.477 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 23.4 t-105 -62.64 -47.29 84.37 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.967 -0.54 . . . . 0.63 111.55 -177.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.5 t -70.7 -32.18 69.32 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 117.658 -1.163 . . . . 1.64 111.664 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 46.1 mt -67.33 -40.51 85.9 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-O 117.24 -1.362 . . . . 0.62 112.105 175.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 13.1 mm -49.03 -46.13 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 CA-C-N 120.691 1.587 . . . . 0.66 111.901 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -60.98 -19.6 56.77 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 123.997 0.808 . . . . 0.69 114.381 178.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -78.12 -18.37 76.68 Favored Glycine 0 CA--C 1.531 1.077 0 CA-C-N 118.687 1.244 . . . . 0.77 113.54 174.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -101.61 -48.17 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-N 119.482 1.641 . . . . 0.98 109.976 166.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 25.7 m -80.45 68.58 6.68 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 127.038 2.135 . . . . 1.39 109.45 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -129.67 -83.49 0.33 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.731 1.634 . . . . 0.91 110.961 177.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -61.89 -39.29 52.54 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 122.479 2.119 . . . . 1.24 111.656 178.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.95 -11.31 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 113.461 0.911 . . . . 1.27 113.461 177.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.12 -42.87 83.78 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.534 1.061 . . . . 0.87 111.293 177.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -61.42 -35.42 77.5 Favored 'General case' 0 C--O 1.22 -0.475 0 O-C-N 120.508 -1.37 . . . . 2.95 112.262 169.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.85 -43.7 95.34 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.149 0.98 . . . . 1.5 111.165 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 78.7 mt -50.17 -62.11 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-O 121.43 0.633 . . . . 0.95 109.824 163.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -58.67 -31.06 67.84 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.865 1.061 . . . . 2.09 113.865 -173.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.258 3.8 pt-20 -88.7 -12.28 42.79 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.691 1.196 . . . . 3.23 112.76 -179.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -84.28 -34.19 23.83 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.308 1.443 . . . . 3.77 111.252 169.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -63.19 2.93 0.31 Allowed 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 126.421 1.889 . . . . 3.25 113.222 166.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -128.21 -72.48 0.62 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.92 1.688 . . . . 2.5 111.21 -176.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 . . . . . 0 N--CA 1.476 0.867 1 C-N-CA 132.14 4.176 . . . . 4.18 116.513 170.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 . . . . . 0 C--O 1.241 0.607 0 N-CA-C 112.861 0.689 . . . . 2.67 112.861 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.31 153.59 40.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.771 -0.826 . . . . 1.07 108.771 -176.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -59.81 -43.31 94.56 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-O 119.125 -0.464 . . . . 2.09 110.891 178.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.91 -44.44 94.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.086 1.754 . . . . 1.81 111.639 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -71.15 -53.8 13.27 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 125.837 1.655 . . . . 3.11 110.819 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -58.55 -27.5 64.63 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.107 -0.996 . . . . 5.39 111.828 167.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.813 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -71.6 -37.39 70.97 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 119.474 -2.016 . . . . 0.57 111.72 172.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 91.4 t -60.41 -37.46 74.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.84 1.655 . . . . 0.67 110.504 167.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 13.3 mt -55.23 -54.1 28.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 CA-C-N 120.335 1.425 . . . . 0.77 112.196 165.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.4 t -58.5 -44.36 88.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 119.633 1.106 . . . . 0.57 112.951 -179.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.6 mp -63.2 -42.32 99.31 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.58 1.082 . . . . 0.91 111.393 175.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.6 t -65.34 -41.3 90.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 123.819 0.848 . . . . 0.62 110.825 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.58 -43.08 99.51 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.396 0.544 . . . . 3.15 112.161 166.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.57 -23.76 64.9 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.704 -1.247 . . . . 3.91 113.556 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -75.43 -72.83 0.28 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.907 0.883 . . . . 1.81 112.455 158.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -58.95 -26.65 64.6 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.39 1.626 . . . . 2.09 115.39 -167.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -47.45 -32.66 5.3 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.986 1.266 . . . . 2.6 112.555 173.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -93.11 -19.22 21.72 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.257 1.823 . . . . 2.38 115.219 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.488 1.464 0 CA-C-N 120.455 1.479 . . . . 2.59 110.109 -168.56 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.0 pt . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 116.032 1.864 . . . . 2.15 116.032 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.4 t -77.67 137.51 38.56 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.41 -1.431 . . . . 2.72 110.068 164.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mttp -60.7 -21.86 63.34 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 121.063 -1.023 . . . . 2.3 112.161 172.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.4 p -67.66 -32.95 73.99 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 120.492 -1.38 . . . . 1.78 113.427 171.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.5 m -63.59 -39.68 94.99 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.593 1.088 . . . . 1.09 111.543 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.463 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 25.9 t80 -52.1 -60.47 3.16 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.816 0.846 . . . . 2.1 111.733 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -61.88 -28.68 69.67 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.458 0.54 . . . . 3.01 112.458 -176.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -83.79 -42.01 16.95 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.288 0.566 . . . . 2.84 112.098 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 15.7 tmm? -58.58 -37.48 75.87 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.681 -1.262 . . . . 1.54 111.099 170.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.6 mt -69.56 -8.03 43.65 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.302 1.593 . . . . 1.51 115.302 167.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -92.14 -7.72 47.69 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 120.932 -1.105 . . . . 3.1 113.405 163.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -62.84 1.51 Allowed 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.404 1.261 . . . . 1.54 114.404 174.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -82.14 -4.61 57.32 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 119.338 -2.101 . . . . 2.66 114.011 -168.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.86 24.81 5.0 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.802 2.041 . . . . 1.7 111.794 175.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -74.87 -26.76 59.91 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 115.418 1.636 . . . . 2.09 115.418 -164.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 16.8 m80 -70.02 -20.54 63.26 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.472 1.487 . . . . 3.07 111.072 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.5 tpp -70.72 3.98 2.81 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.28 1.432 . . . . 1.7 114.323 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.1 mp -85.35 119.37 25.64 Favored 'General case' 0 C--O 1.225 -0.23 0 O-C-N 120.734 -1.229 . . . . 3.15 110.27 174.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.7 t -110.08 5.45 22.11 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 114.911 -1.041 . . . . 5.05 112.552 175.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 t70 164.94 158.85 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 129.992 3.317 . . . . 4.98 109.492 -177.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -25.08 -48.5 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 129.959 3.304 . . . . 3.59 114.206 157.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.18 -33.61 75.88 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 125.545 1.545 . . . . 2.1 113.515 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 -71.35 -23.71 61.97 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.074 0.937 . . . . 3.38 112.929 177.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.46 ' HA ' ' CZ ' ' A' ' 56' ' ' ARG . 0.7 OUTLIER -81.39 -45.34 16.24 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-N 119.301 0.955 . . . . 6.8 112.487 164.213 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.8 mmtm -55.24 -34.57 64.11 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.906 0.776 . . . . 3.21 112.892 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.27 -27.58 36.11 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.442 1.275 . . . . 1.07 114.442 172.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.38 -43.41 50.37 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 119.149 0.886 . . . . 0.94 111.62 171.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -60.45 -36.63 78.69 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.279 1.432 . . . . 2.85 112.771 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -58.19 -30.21 66.26 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.514 0.931 . . . . 3.35 113.514 173.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.9 mt -78.06 -42.18 33.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 118.415 -0.802 . . . . 1.0 111.425 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.7 mm -60.73 -43.65 95.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 118.951 0.796 . . . . 1.16 110.373 -175.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -62.09 -28.72 69.81 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.536 0.939 . . . . 2.24 113.536 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.6 m-20 -81.64 -44.63 16.92 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.283 1.433 . . . . 3.01 113.01 175.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.87 -30.19 26.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.612 1.165 . . . . 2.34 111.703 -171.07 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -71.5 -22.93 61.73 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.914 1.079 . . . . 2.77 113.914 -177.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.55 -2.4 3.4 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 113.88 1.067 . . . . 2.53 113.88 164.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -138.4 -173.31 3.5 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 127.514 2.326 . . . . 3.85 110.287 -176.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 7.2 m80 55.52 45.34 25.22 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.97 1.47 . . . . 4.2 114.97 158.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.402 ' C ' ' H ' ' A' ' 73' ' ' ARG . 0.3 OUTLIER -134.09 155.46 50.01 Favored 'General case' 0 C--O 1.232 0.158 0 O-C-N 121.378 -0.826 . . . . 6.68 112.592 166.657 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.56 -18.9 0.41 Allowed Glycine 0 CA--C 1.538 1.515 0 CA-C-O 118.918 -0.934 . . . . 4.96 113.392 -161.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.402 ' H ' ' C ' ' A' ' 71' ' ' ASP . 87.5 mmt-85 -141.38 149.83 41.61 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 128.359 2.664 . . . . 4.9 110.42 172.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.4 mm -138.02 148.16 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.296 1.839 . . . . 3.06 109.83 173.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.7 m -117.39 144.44 44.96 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.148 1.779 . . . . 1.96 108.681 177.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -59.37 -36.67 76.19 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.773 1.273 . . . . 1.93 112.112 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.83 -20.54 65.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.512 2.725 . . . . 3.02 114.488 177.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -56.8 -58.91 6.05 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.888 1.222 . . . . 3.32 109.888 171.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -58.79 -44.39 90.73 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.343 -0.848 . . . . 2.38 112.035 -175.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.6 t-105 -62.07 -47.66 83.67 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 118.561 -0.733 . . . . 0.66 112.138 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.2 t -70.3 -28.14 64.95 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.446 1.021 . . . . 1.84 112.124 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.463 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 57.9 mt -68.04 -40.96 82.75 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 117.631 -1.176 . . . . 0.64 111.75 172.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 25.6 mm -54.76 -42.03 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 CA-C-N 121.545 1.975 . . . . 0.57 111.977 176.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -65.38 -19.39 66.49 Favored Glycine 0 N--CA 1.472 1.041 0 C-N-CA 124.111 0.862 . . . . 0.66 114.149 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.09 -22.29 63.62 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-N 118.307 1.054 . . . . 0.66 113.706 177.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.1 mp -90.42 -40.82 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 118.829 1.314 . . . . 0.82 109.955 163.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.3 m -80.75 80.61 7.19 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.452 1.501 . . . . 1.35 109.074 -175.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -153.98 -75.61 0.02 OUTLIER Glycine 0 CA--C 1.532 1.132 0 C-N-CA 125.752 1.644 . . . . 0.76 112.861 -174.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -62.37 -45.77 14.03 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.74 2.293 . . . . 0.98 111.641 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 pt -72.87 -16.37 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 114.839 1.422 . . . . 1.2 114.839 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -50.51 -58.53 5.56 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.792 1.633 . . . . 1.11 112.715 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -60.69 -40.23 91.4 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.112 -0.992 . . . . 2.91 112.466 176.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.3 tt -58.63 -47.15 85.35 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 124.424 1.09 . . . . 1.15 110.579 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 42.4 mt -47.7 -58.49 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.792 1.237 . . . . 1.14 111.117 174.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -70.55 -34.65 72.49 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.57 -0.706 . . . . 2.56 112.099 -175.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.284 4.3 pt-20 -77.15 -24.19 51.57 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.636 -0.665 . . . . 2.91 111.876 -175.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -59.0 -58.35 9.04 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.262 1.825 . . . . 2.12 112.438 164.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -71.62 -12.54 61.4 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.024 0.829 . . . . 3.52 112.431 -171.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 . . . . . 0 N--CA 1.47 0.526 0 O-C-N 121.209 -0.932 . . . . 1.87 111.146 163.336 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 . . . . . 0 N--CA 1.476 0.825 0 N-CA-C 112.664 0.616 . . . . 2.23 112.664 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.17 156.61 37.18 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.712 0.805 . . . . 1.32 109.774 -173.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -63.03 -39.85 95.98 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-O 117.78 -1.105 . . . . 2.49 111.341 175.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.16 -47.37 81.35 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.784 1.278 . . . . 1.01 109.895 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.08 -56.1 7.78 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 126.57 1.948 . . . . 2.84 111.593 -173.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -57.92 -29.87 65.47 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 120.75 -1.219 . . . . 4.71 112.238 169.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.813 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.43 -40.81 77.01 Favored 'General case' 0 C--O 1.224 -0.251 0 O-C-N 119.826 -1.796 . . . . 0.49 111.992 169.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 53.2 t -59.65 -31.93 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.762 1.619 . . . . 0.73 111.162 171.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 35.2 mt -60.78 -54.37 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 CA-C-N 119.859 1.209 . . . . 0.75 110.872 166.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.24 -36.92 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.479 1.112 . . . . 0.5 113.268 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.83 -44.76 76.48 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.474 1.034 . . . . 0.94 111.39 173.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.4 t -64.12 -39.44 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.947 0.899 . . . . 0.58 111.406 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -69.9 -38.15 76.21 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.112 0.782 . . . . 3.37 113.112 170.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -59.31 -23.07 62.14 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.582 -1.324 . . . . 3.6 113.017 173.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -81.44 -68.82 0.66 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.671 0.788 . . . . 1.92 112.704 163.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -60.24 -25.75 65.9 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.892 1.441 . . . . 2.03 114.892 -168.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -47.87 -33.19 7.13 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.922 1.237 . . . . 2.61 112.925 172.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -89.47 -16.82 29.94 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.862 1.43 . . . . 2.16 114.862 177.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 5.5 t . . . . . 0 N--CA 1.483 1.224 0 CA-C-O 123.235 1.493 . . . . 2.45 109.914 -167.789 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 19.7 pt . . . . . 0 N--CA 1.488 1.445 0 N-CA-C 115.292 1.59 . . . . 2.18 115.292 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 29.8 t -94.29 137.88 32.93 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.469 -1.395 . . . . 2.73 109.97 164.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . 0.405 ' HE2' HD12 ' B' ' 169' ' ' LEU . 23.0 mttp -68.78 -17.07 63.97 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.732 -1.23 . . . . 2.61 111.469 171.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 10.0 p -65.53 -27.68 68.63 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.589 -1.319 . . . . 1.68 113.116 165.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 12.6 m -77.94 -39.29 43.2 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.364 0.984 . . . . 1.18 111.545 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.476 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 47.7 t80 -47.58 -57.48 5.39 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.008 0.923 . . . . 2.1 111.171 173.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.3 ptt180 -62.12 -26.73 68.47 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.361 0.874 . . . . 2.91 113.361 -176.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -87.82 -43.68 11.66 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.425 1.09 . . . . 2.44 111.941 -176.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.46 -41.41 69.45 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.393 1.477 . . . . 1.27 111.245 170.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 71.2 mt -71.02 -4.3 24.17 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.54 1.936 . . . . 1.6 115.183 171.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -98.92 -10.09 23.27 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.325 1.45 . . . . 2.96 112.725 165.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.19 -57.31 2.09 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.867 1.267 . . . . 1.38 113.658 174.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -86.76 -6.03 58.94 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.505 -1.372 . . . . 2.78 114.044 -169.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.35 14.85 8.3 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.784 2.034 . . . . 1.75 112.618 176.029 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -66.87 -26.87 67.1 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.264 1.579 . . . . 1.92 115.264 -163.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -70.86 -14.21 62.32 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.182 1.355 . . . . 2.95 112.304 178.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.6 tpp -80.25 5.37 14.82 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.339 1.455 . . . . 1.76 113.731 174.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.9 mp -91.49 132.04 36.53 Favored 'General case' 0 C--O 1.227 -0.122 0 O-C-N 120.678 -1.264 . . . . 3.18 109.404 177.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 20.1 m -140.4 16.88 2.39 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.165 -0.959 . . . . 5.21 112.118 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 18.7 t70 172.13 158.57 0.1 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 129.4 3.08 . . . . 5.42 109.762 173.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 3.7 m -25.2 -52.87 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 129.498 3.119 . . . . 4.24 113.326 156.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.0 -33.5 69.25 Favored Glycine 0 CA--C 1.525 0.674 0 C-N-CA 124.817 1.199 . . . . 2.42 113.262 -175.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -70.92 -23.83 62.33 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 118.516 1.158 . . . . 3.33 113.516 -178.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -84.4 -50.05 8.14 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.084 0.857 . . . . 7.28 112.62 164.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -54.33 -34.46 61.1 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 119.007 0.821 . . . . 3.26 112.552 -178.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -53.62 -29.44 37.95 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.41 1.263 . . . . 1.07 114.41 173.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -74.12 -40.34 62.72 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.224 0.92 . . . . 0.88 112.274 171.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -70.13 -27.63 64.71 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.292 1.037 . . . . 1.92 112.876 -177.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 23.4 mtmt -60.05 -27.82 67.26 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 121.138 -0.976 . . . . 3.41 113.274 168.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 6.5 mt -78.14 -40.89 36.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.702 -0.681 . . . . 0.96 110.998 173.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 19.1 mm -61.06 -44.69 98.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 118.393 0.542 . . . . 1.29 110.926 -178.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -61.94 -27.66 68.99 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.491 0.923 . . . . 2.6 113.491 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 m-20 -83.2 -45.23 14.12 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.158 1.383 . . . . 3.06 113.092 174.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . 0.405 HD12 ' HE2' ' B' ' 138' ' ' LYS . 0.1 OUTLIER -96.72 -31.34 12.72 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.311 1.044 . . . . 2.96 112.673 -166.086 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -79.83 -8.4 59.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.703 1.201 . . . . 3.43 112.966 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -74.97 -7.13 52.73 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.894 1.278 . . . . 2.92 113.484 159.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -134.48 -173.41 3.28 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.439 2.296 . . . . 4.01 110.514 -178.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 57.6 73.08 0.48 Allowed 'General case' 0 CA--C 1.552 1.034 0 CA-C-O 122.809 1.29 . . . . 4.0 113.269 164.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -155.81 159.23 39.23 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.791 1.237 . . . . 6.1 110.899 172.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 69.01 -27.43 0.3 Allowed Glycine 0 CA--C 1.534 1.221 0 C-N-CA 124.381 0.991 . . . . 5.38 112.337 -160.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 81.9 mmt-85 -134.58 149.65 50.63 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.027 2.531 . . . . 5.18 110.302 167.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 26.2 mm -140.3 152.24 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.893 2.077 . . . . 3.45 107.315 172.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.4 m -117.38 144.01 45.39 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.503 1.521 . . . . 1.99 109.501 -177.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -58.91 -38.93 80.02 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 122.986 1.374 . . . . 1.84 111.937 177.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -63.5 -20.98 66.05 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.305 2.642 . . . . 2.96 114.346 175.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -57.5 -55.48 34.21 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.919 1.236 . . . . 2.97 109.713 171.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -55.39 -51.24 67.47 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.838 -0.539 . . . . 2.4 111.507 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.3 t-105 -61.05 -45.58 94.19 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 118.927 -0.559 . . . . 0.66 112.351 -178.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.7 t -72.12 -27.53 62.68 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 117.81 -1.091 . . . . 1.69 112.343 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.476 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 74.4 mt -65.21 -44.71 87.46 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.769 1.168 . . . . 0.78 111.535 168.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 36.8 mm -52.89 -38.55 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 CA-C-N 121.578 1.99 . . . . 0.95 113.417 -177.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.2 -18.96 67.77 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 123.928 0.775 . . . . 0.73 113.924 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -77.7 -25.16 63.31 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 118.522 1.161 . . . . 0.81 113.321 176.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -87.55 -43.06 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 118.44 1.12 . . . . 0.95 110.238 164.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 8.0 m -86.41 86.04 7.33 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.912 1.285 . . . . 1.51 109.177 -170.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -160.07 -74.37 0.02 OUTLIER Glycine 0 CA--C 1.533 1.206 0 C-N-CA 126.259 1.885 . . . . 0.73 113.18 -171.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.59 -45.59 17.19 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.917 2.411 . . . . 0.96 111.751 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.5 pt -71.82 -19.31 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 116.874 -1.536 . . . . 1.25 114.533 172.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -46.79 -58.91 3.43 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 121.71 2.05 . . . . 1.11 112.902 178.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.13 -40.96 87.08 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.42 -1.425 . . . . 3.28 112.583 177.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.2 tt -61.01 -46.67 89.8 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 118.465 0.575 . . . . 1.46 110.334 -178.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 49.7 mt -49.36 -48.21 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 126.141 1.776 . . . . 1.34 111.903 175.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -76.72 -42.78 40.02 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.254 -0.579 . . . . 2.52 111.601 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -76.13 -21.64 56.38 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.888 -0.508 . . . . 2.89 111.896 -169.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -50.74 -59.76 3.75 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 126.516 1.926 . . . . 2.14 112.888 162.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -75.56 0.75 16.3 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 122.196 0.998 . . . . 3.42 111.631 -170.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -98.09 -53.91 3.23 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.715 1.606 . . . . 2.39 110.257 165.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 113.563 0.949 . . . . 5.13 113.563 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.471 0.579 0 N-CA-C 108.121 -1.066 . . . . 2.62 108.121 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 70.0 p -59.6 141.18 55.5 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 118.956 0.798 . . . . 1.2 110.751 -170.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.404 ' HG2' HG21 ' B' ' 117' ' ' VAL . 6.6 tt0 -65.39 -21.76 66.71 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 117.992 -1.004 . . . . 3.38 112.33 -175.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -47.92 64.69 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.019 0.827 . . . . 0.8 110.912 169.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -69.64 -52.21 27.9 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.863 0.756 . . . . 3.13 110.783 -178.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -44.57 -45.94 9.71 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.193 1.397 . . . . 4.49 114.01 164.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.911 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -63.0 -48.07 80.4 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 118.05 -0.976 . . . . 0.5 112.321 174.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 93.8 t -58.93 -35.52 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 120.061 1.3 . . . . 0.65 111.296 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.0 mt -54.13 -46.77 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 CA-C-N 120.066 1.303 . . . . 0.79 112.312 165.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 53.9 t -71.62 -42.01 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 120.459 -1.4 . . . . 0.68 112.938 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.19 -30.49 68.25 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.886 -1.134 . . . . 1.0 111.052 174.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.3 t -73.49 -48.74 40.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-O 117.038 -1.458 . . . . 0.58 111.799 172.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -38.54 81.97 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 121.416 1.916 . . . . 3.41 112.949 176.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -64.88 -32.64 74.44 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.786 1.032 . . . . 2.13 113.786 -176.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.461 ' CZ ' HG21 ' A' ' 23' ' ' VAL . 36.0 t80 -65.63 -57.51 7.94 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.69 -0.631 . . . . 2.28 110.713 167.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.479 ' HA ' HG22 ' A' ' 23' ' ' VAL . 55.4 m-85 -68.97 -24.7 64.28 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.927 1.084 . . . . 1.78 113.927 -170.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.5 pttt -66.71 -24.8 66.29 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 121.27 1.85 . . . . 2.54 112.661 168.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -100.33 10.7 40.85 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.053 1.741 . . . . 2.86 114.433 172.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.479 HG22 ' HA ' ' A' ' 20' ' ' TYR . 34.1 m . . . . . 0 CA--C 1.541 0.615 0 C-N-CA 125.626 1.57 . . . . 2.81 108.207 164.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.5 tt . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 108.986 -0.746 . . . . 3.36 108.986 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.0 m -114.27 142.15 46.66 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 107.77 -1.196 . . . . 2.84 107.77 148.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.5 mttp -63.31 -19.58 64.73 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.614 -1.304 . . . . 2.76 113.143 -168.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 5.3 p -49.97 -20.15 0.87 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.442 2.297 . . . . 2.18 115.877 163.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 m -92.48 -18.34 23.33 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.565 1.691 . . . . 1.61 115.565 170.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.412 ' CE1' HD11 ' A' ' 42' ' ' LEU . 27.7 t80 -60.47 -47.16 87.36 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 118.592 -2.567 . . . . 2.31 111.296 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -58.04 -20.77 41.64 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.91 1.684 . . . . 2.55 114.344 170.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.65 -49.13 6.25 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 126.591 1.956 . . . . 3.8 108.853 -171.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 1.2 tmm? -48.67 -49.89 35.56 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.413 1.485 . . . . 1.49 111.295 163.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.412 HD11 ' CE1' ' A' ' 38' ' ' PHE . 38.4 mt -59.98 -9.96 3.64 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 115.627 1.714 . . . . 1.19 115.627 172.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -112.23 -16.87 12.9 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.551 1.54 . . . . 2.0 112.589 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.8 -42.61 11.8 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.999 0.818 . . . . 2.94 112.837 166.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -84.76 -53.16 5.54 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.099 1.36 . . . . 3.0 111.746 -174.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.3 mt -96.14 39.82 1.14 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.769 1.228 . . . . 2.54 112.334 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -76.41 -12.15 60.01 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.838 1.421 . . . . 1.58 114.838 -169.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -88.19 -22.45 24.01 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.814 1.188 . . . . 1.66 111.318 178.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.3 tpp -63.81 -6.87 6.44 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 128.054 2.541 . . . . 2.38 114.336 172.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.2 mp -100.55 -179.9 4.23 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 128.393 2.677 . . . . 2.83 113.754 -168.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.8 m -177.28 -101.19 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 129.086 2.954 . . . . 4.6 107.148 175.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.59 17.3 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 128.202 2.601 . . . . 4.52 115.066 -171.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.6 m 68.53 -1.85 1.8 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.425 2.29 . . . . 3.89 111.316 -152.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.36 -47.26 69.51 Favored Glycine 0 N--CA 1.471 0.972 0 C-N-CA 125.119 1.342 . . . . 2.51 113.874 -165.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -59.58 -51.83 68.14 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 117.699 0.749 . . . . 4.71 112.17 174.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -55.34 -28.9 56.83 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.584 1.327 . . . . 5.08 114.584 171.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -55.18 -39.46 69.59 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 122.567 2.439 . . . . 3.68 111.984 173.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.34 -12.06 60.97 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.078 1.51 . . . . 1.53 115.078 174.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.26 -52.25 6.38 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.598 1.159 . . . . 1.31 112.284 163.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.92 -30.87 71.88 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.685 0.794 . . . . 2.71 111.758 -175.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.0 ptmm? -60.91 -27.4 68.16 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.999 1.111 . . . . 3.39 113.999 171.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.3 mt -83.39 -32.49 26.15 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.227 0.611 . . . . 1.38 112.297 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.1 mm -53.6 -55.54 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.719 1.207 . . . . 1.48 110.334 178.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -62.69 -39.4 93.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.227 1.011 . . . . 3.58 112.531 -177.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.24 -28.97 56.99 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.775 1.23 . . . . 3.56 113.767 171.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.5 mt -104.27 -26.4 12.5 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.763 1.394 . . . . 2.66 114.763 177.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -66.39 -15.25 63.15 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.55 1.068 . . . . 3.62 111.821 165.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.32 -27.32 59.22 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 115.07 1.507 . . . . 2.63 115.07 160.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -109.62 -20.39 12.86 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.625 1.713 . . . . 2.43 115.625 -168.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -139.15 124.84 19.54 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.584 -1.322 . . . . 4.43 113.541 -166.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -77.59 17.96 0.48 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.202 1.801 . . . . 4.73 115.422 -170.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.76 5.28 66.69 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 124.08 0.848 . . . . 2.47 112.658 -159.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.23 134.73 57.34 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.408 1.104 . . . . 4.85 109.204 146.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 34.8 mm -150.39 115.69 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 127.375 2.27 . . . . 2.16 107.97 -176.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.8 t -95.8 -172.38 2.58 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.731 1.612 . . . . 2.65 111.609 167.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -78.24 -40.45 37.23 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.474 1.11 . . . . 2.09 112.034 170.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.75 -32.28 73.73 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.847 2.459 . . . . 3.19 112.981 -168.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -58.59 -50.97 71.85 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 124.786 1.235 . . . . 4.08 110.49 176.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -57.41 -49.66 75.48 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.588 -0.695 . . . . 2.61 112.489 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 14.0 t-105 -61.83 -39.73 92.82 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 118.779 0.718 . . . . 0.86 111.778 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.0 m -59.64 -47.12 86.86 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.283 1.433 . . . . 2.19 111.082 174.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.86 -48.57 79.92 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.123 -0.941 . . . . 0.87 111.976 178.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.3 mm -55.09 -34.68 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 120.506 1.503 . . . . 1.02 112.84 -170.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -69.6 -21.21 76.2 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.072 0.844 . . . . 0.71 113.753 177.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.47 -23.74 77.33 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.394 0.997 . . . . 0.74 113.081 173.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.1 mp -89.74 -48.5 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.219 1.01 . . . . 1.16 110.344 163.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.9 m -82.7 67.2 8.66 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 126.096 1.758 . . . . 1.32 108.974 -173.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -146.69 -77.33 0.02 OUTLIER Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.596 1.569 . . . . 1.01 112.103 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -60.99 -40.66 50.43 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.545 2.83 . . . . 1.24 114.181 -170.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.7 pt -86.57 -14.91 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 119.455 1.025 . . . . 1.64 113.146 173.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.48 -35.77 80.39 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.352 0.978 . . . . 1.29 113.155 -172.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -55.33 -44.69 76.09 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.094 -1.004 . . . . 2.62 112.75 167.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.6 tt -60.7 -36.57 79.13 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.247 1.019 . . . . 1.2 111.222 -178.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.2 mt -50.39 -61.09 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 123.79 0.836 . . . . 0.89 110.151 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.1 t60 -62.16 -35.36 78.55 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.245 -0.91 . . . . 1.9 112.846 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -70.11 -23.07 62.97 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 122.986 0.514 . . . . 3.23 111.018 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -81.05 -30.28 34.84 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.228 1.411 . . . . 2.71 113.944 171.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -67.8 3.89 1.32 Allowed 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 120.292 1.405 . . . . 2.83 112.182 166.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 . . . . . 0 CA--C 1.537 0.444 0 C-N-CA 125.705 1.602 . . . . 2.17 111.08 170.285 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.538 0.497 0 CA-C-O 118.067 -0.968 . . . . 2.72 110.989 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 77.4 p -54.01 139.85 33.2 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.863 1.21 . . . . 1.17 110.018 -171.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -60.41 -36.67 78.68 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-O 116.433 -1.746 . . . . 3.73 109.514 -176.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.92 -50.56 66.13 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.61 1.55 . . . . 0.73 111.364 174.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -68.02 -50.56 54.66 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.856 0.753 . . . . 3.0 111.737 -177.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -49.72 -40.93 42.31 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.705 -1.247 . . . . 4.7 113.831 168.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.911 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.91 -40.53 75.53 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 124.971 1.308 . . . . 0.56 111.766 177.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 95.6 t -60.79 -42.56 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 120.018 1.281 . . . . 0.79 110.719 168.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 21.0 mt -52.46 -45.38 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 CA-C-N 120.436 1.471 . . . . 0.77 111.934 168.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.404 HG21 ' HG2' ' A' ' 7' ' ' GLU . 22.4 t -68.62 -38.63 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 O-C-N 120.885 -1.134 . . . . 0.55 113.232 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -58.02 -35.41 71.23 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.979 -1.076 . . . . 1.09 111.536 170.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 93.9 t -74.71 -44.67 46.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 117.575 -1.203 . . . . 0.66 111.042 -178.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.51 -37.94 85.55 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 120.551 1.523 . . . . 3.71 112.719 174.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -65.28 -33.24 75.52 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.833 1.049 . . . . 2.17 113.833 -176.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -66.77 -55.57 14.37 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 121.266 -0.896 . . . . 2.13 110.843 168.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . 0.437 ' HA ' HG22 ' B' ' 126' ' ' VAL . 51.4 m-85 -68.55 -24.21 64.6 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.791 1.034 . . . . 1.79 113.791 -171.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 36.7 pttt -69.18 -20.77 64.0 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.925 1.693 . . . . 2.42 113.264 168.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -98.75 -0.02 43.57 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.828 1.651 . . . . 2.61 115.001 170.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . 0.437 HG22 ' HA ' ' B' ' 123' ' ' TYR . 27.7 m . . . . . 0 N--CA 1.477 0.922 0 C-N-CA 126.118 1.767 . . . . 2.7 109.45 171.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.3 tt . . . . . 0 N--CA 1.471 0.586 0 CA-C-O 120.808 0.337 . . . . 3.32 110.928 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 60.3 m -92.08 138.54 31.45 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.679 -0.859 . . . . 3.31 108.679 167.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -53.86 -26.02 22.6 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 120.532 -1.355 . . . . 2.75 114.259 -175.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 20.0 p -71.23 -8.65 55.0 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.811 2.044 . . . . 2.06 116.057 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 2.2 m -80.59 -42.7 21.83 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.988 1.267 . . . . 1.48 112.459 -172.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.513 ' CE1' HD11 ' B' ' 145' ' ' LEU . 3.5 t80 -57.91 -49.06 78.03 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.661 1.184 . . . . 1.94 112.011 -176.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -54.39 -20.69 7.88 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.162 1.171 . . . . 2.24 114.162 173.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -105.39 -34.56 7.8 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.981 0.912 . . . . 2.45 113.261 -173.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.6 tmm? -49.91 -49.96 47.96 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.554 1.142 . . . . 1.35 110.697 158.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . 0.513 HD11 ' CE1' ' B' ' 141' ' ' PHE . 77.1 mt -57.05 -11.24 1.44 Allowed 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.813 1.783 . . . . 1.1 115.813 168.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -106.35 -14.62 15.05 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 120.351 1.432 . . . . 2.14 112.42 177.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.96 -38.27 6.67 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.201 1.4 . . . . 1.69 113.387 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -77.68 -57.3 3.89 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.677 1.191 . . . . 3.22 109.65 173.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.6 mt -91.95 42.3 1.1 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.26 1.024 . . . . 2.45 111.643 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -71.76 -9.36 58.17 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.198 1.184 . . . . 2.07 114.198 -172.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -92.98 -31.76 14.78 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.541 1.064 . . . . 1.6 111.491 179.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 22.2 tpp -56.76 -1.73 0.07 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 128.897 2.879 . . . . 2.34 115.933 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.7 mp -100.43 -173.98 2.54 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.638 2.375 . . . . 2.84 114.427 -166.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 16.6 m -176.25 -104.98 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 129.824 3.25 . . . . 4.51 107.393 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.44 12.73 0.06 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 128.068 2.547 . . . . 4.89 115.511 -171.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 67.64 13.81 9.36 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.992 1.717 . . . . 4.51 110.444 -134.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.19 -48.01 85.88 Favored Glycine 0 N--CA 1.473 1.155 0 C-N-CA 126.089 1.804 . . . . 3.04 115.854 -161.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -66.33 -48.65 69.59 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.611 1.205 . . . . 4.59 111.42 174.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.0 ttt-85 -53.54 -28.22 30.32 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.664 1.357 . . . . 4.82 114.664 175.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 55.9 mmtt -53.78 -36.17 62.11 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 122.247 2.294 . . . . 5.23 111.535 173.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.44 -11.59 59.86 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.284 1.587 . . . . 1.35 115.284 175.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -81.14 -51.58 8.3 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.274 1.03 . . . . 1.14 111.616 164.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.18 -33.76 75.14 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.816 0.446 . . . . 2.63 111.737 -173.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 7.6 ptmm? -58.11 -28.38 64.58 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.386 1.254 . . . . 3.42 114.386 172.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 30.0 mt -79.09 -33.04 44.79 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.875 -0.516 . . . . 1.16 112.163 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.4 mm -64.0 -52.19 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 123.686 0.794 . . . . 1.4 109.372 -174.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -60.45 -38.01 82.8 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.828 1.251 . . . . 3.43 112.251 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.02 -33.69 72.34 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.434 1.094 . . . . 3.22 112.774 172.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.02 -21.57 19.66 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.193 -0.942 . . . . 3.52 112.401 -177.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -65.21 -19.62 66.06 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.16 1.384 . . . . 2.74 113.519 166.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -73.06 -24.17 60.65 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.012 1.115 . . . . 2.16 114.012 162.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 -116.71 -10.37 11.13 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.88 1.808 . . . . 2.28 115.88 -165.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.51 138.11 24.58 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 121.326 1.876 . . . . 4.25 114.76 -173.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -87.4 1.15 54.2 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.416 1.635 . . . . 4.39 115.416 -172.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 97.27 9.84 54.99 Favored Glycine 0 CA--C 1.533 1.194 0 O-C-N 121.201 -0.937 . . . . 2.52 112.907 -161.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.4 153.81 42.82 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 119.064 -1.054 . . . . 4.71 109.044 131.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 36.2 mm -152.74 140.58 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 128.814 2.846 . . . . 2.53 106.32 178.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 3.7 t -106.2 167.51 9.76 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 119.849 1.204 . . . . 2.6 112.431 163.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -57.51 -44.35 84.96 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.502 1.144 . . . . 2.11 112.144 172.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -29.72 70.68 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.448 2.699 . . . . 3.52 112.248 -171.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.98 -46.38 81.73 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.024 0.93 . . . . 3.83 111.024 178.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -57.57 -47.62 81.59 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.256 0.935 . . . . 2.42 111.859 175.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.4 t-105 -60.06 -46.12 90.6 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.541 0.609 . . . . 0.86 111.354 178.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 89.9 m -57.07 -46.09 82.76 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.968 1.307 . . . . 2.45 110.766 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 71.9 mt -65.86 -40.67 91.89 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 117.056 -1.449 . . . . 1.0 112.603 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 25.3 mm -53.23 -39.24 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 CA-C-N 121.02 1.736 . . . . 0.88 112.261 -177.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.77 -18.63 62.04 Favored Glycine 0 CA--C 1.535 1.332 0 CA-C-N 119.446 1.021 . . . . 0.61 114.034 176.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -77.78 -20.75 73.14 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-N 118.721 1.26 . . . . 0.85 113.623 175.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.1 mp -94.44 -45.29 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.394 1.078 . . . . 1.49 110.666 166.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 23.8 m -82.16 80.01 8.5 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 125.937 1.695 . . . . 1.4 107.727 -177.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -155.9 -78.98 0.02 OUTLIER Glycine 0 CA--C 1.531 1.067 0 CA-C-O 118.656 -1.08 . . . . 1.04 113.138 -174.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.09 -40.08 35.7 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.337 2.691 . . . . 1.09 113.268 -172.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 18.9 pt -88.25 -14.69 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 N-CA-C 113.62 0.97 . . . . 1.66 113.62 171.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -58.07 -39.56 78.81 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.926 1.239 . . . . 1.2 113.19 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -57.81 -45.61 85.85 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 120.617 -1.302 . . . . 2.88 112.631 168.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.8 tt -59.2 -38.25 79.44 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 124.186 0.994 . . . . 1.43 111.337 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 76.9 mt -49.59 -61.71 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 118.742 0.701 . . . . 1.02 110.281 167.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -59.02 -34.95 72.48 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 120.928 -1.108 . . . . 2.1 113.331 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -70.24 -26.34 63.79 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.529 0.732 . . . . 3.31 111.204 177.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -77.4 -32.48 54.82 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 117.569 -1.205 . . . . 2.6 113.596 172.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -70.58 5.59 1.79 Allowed 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 120.288 1.404 . . . . 2.69 112.391 169.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -114.08 -74.48 0.62 Allowed 'General case' 0 CA--C 1.534 0.335 0 O-C-N 120.223 -1.548 . . . . 2.45 110.741 166.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.262 0 C-N-CA 129.981 3.313 . . . . 4.64 115.759 168.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 . . . . . 0 N--CA 1.485 1.308 0 N-CA-C 106.967 -1.494 . . . . 2.51 106.967 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.6 p -67.4 148.3 51.77 Favored 'General case' 0 N--CA 1.481 1.125 0 O-C-N 121.539 -0.726 . . . . 1.01 109.804 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -64.82 -19.26 65.76 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-O 118.015 -0.993 . . . . 2.64 113.251 176.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.39 -53.96 35.68 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 121.439 1.927 . . . . 1.06 109.011 172.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -63.65 -52.91 58.67 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.36 1.064 . . . . 3.28 109.666 -179.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.3 tptt -60.54 -30.64 69.88 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 120.756 -1.215 . . . . 6.05 113.497 174.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.841 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.02 -37.81 78.86 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 119.758 -1.839 . . . . 0.67 113.076 170.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 71.8 t -56.03 -46.76 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.688 1.131 . . . . 0.62 110.062 164.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.8 mt -54.14 -52.25 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.977 1.262 . . . . 0.8 111.683 172.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.5 t -60.36 -39.16 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.764 1.166 . . . . 0.64 112.262 -177.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mp -68.76 -34.1 75.02 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.328 -0.857 . . . . 1.15 113.058 173.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.3 t -75.25 -42.24 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.156 0.982 . . . . 0.67 111.391 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -63.32 -37.73 88.38 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.893 0.769 . . . . 3.72 111.572 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -55.26 -26.73 41.81 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 114.223 1.194 . . . . 1.97 114.223 175.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -87.87 -60.14 2.05 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.292 1.037 . . . . 2.24 112.282 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -60.5 -28.45 68.38 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-O 118.824 -0.608 . . . . 1.72 112.442 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -54.86 -19.67 7.06 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 119.888 -1.758 . . . . 2.74 114.465 172.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -93.31 10.08 33.56 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 114.933 1.457 . . . . 2.36 114.933 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.477 0.923 0 CA-C-N 120.482 1.492 . . . . 2.89 109.526 162.158 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 7.0 pt . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 111.448 0.166 . . . . 3.29 111.448 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.0 p -111.86 148.99 32.47 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.588 -1.32 . . . . 3.96 113.337 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.419 ' HE3' ' CG ' ' A' ' 70' ' ' HIS . 21.1 mttp -64.3 -32.24 73.76 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.624 -0.672 . . . . 2.49 111.998 174.037 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 p -69.84 -38.84 76.64 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.508 1.123 . . . . 2.3 113.417 179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.4 m -76.23 -34.71 59.22 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 117.831 -1.081 . . . . 1.51 113.064 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -53.97 -52.75 59.69 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.881 1.673 . . . . 2.04 112.448 -177.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -61.42 -25.33 67.13 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.274 0.842 . . . . 2.14 113.274 177.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -89.37 -51.2 5.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.419 1.487 . . . . 3.18 110.293 -170.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 11.2 tmm? -48.39 -41.13 28.08 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.352 1.461 . . . . 1.71 111.965 163.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.9 mt -58.54 -32.05 68.52 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.788 1.403 . . . . 1.05 114.788 173.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -92.02 -3.34 55.95 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.587 1.54 . . . . 2.03 113.418 177.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.96 -65.22 0.99 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.356 1.063 . . . . 1.75 111.614 164.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -75.29 -18.53 60.03 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.849 -1.157 . . . . 2.51 112.78 -169.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.93 16.8 19.32 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.906 1.282 . . . . 2.11 113.605 177.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -49.95 -34.49 20.87 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 114.642 1.349 . . . . 1.77 114.642 -175.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.413 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 53.9 m-70 -69.16 -21.17 64.01 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.848 1.425 . . . . 1.56 114.848 -175.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 52.1 mtm -114.44 -15.44 12.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.91 0.884 . . . . 2.07 112.981 169.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 tt -74.61 68.49 1.65 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 123.294 1.521 . . . . 2.7 110.361 163.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.4 t -94.83 -70.5 0.71 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 126.052 1.741 . . . . 3.62 108.767 171.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -77.23 138.51 39.47 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.5 0.667 . . . . 7.03 112.019 -165.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.2 m -50.06 -29.61 9.19 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.968 1.307 . . . . 4.19 112.776 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.64 -48.2 85.86 Favored Glycine 0 CA--C 1.532 1.101 0 CA-C-O 118.648 -1.084 . . . . 3.05 113.087 175.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -51.31 -60.5 3.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.559 1.143 . . . . 3.79 110.062 172.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -67.1 -37.74 84.47 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 113.57 0.952 . . . . 4.56 113.57 -171.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.74 -40.01 88.15 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 117.581 -1.199 . . . . 4.55 113.541 176.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -53.48 -49.4 67.56 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 127.093 2.746 . . . . 1.33 110.76 174.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.66 -54.45 33.18 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.786 1.634 . . . . 0.95 113.15 171.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.81 -29.0 69.87 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-O 118.493 -0.765 . . . . 2.09 112.799 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt -61.0 -33.26 72.97 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-N 121.113 1.779 . . . . 3.08 112.742 171.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.4 mt -68.78 -38.03 79.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.55 -0.295 . . . . 1.14 110.682 -178.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 23.3 mm -56.44 -53.61 38.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 125.326 1.45 . . . . 1.21 111.76 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -67.34 -37.23 82.94 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.157 0.983 . . . . 1.85 111.678 178.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -63.29 -33.73 76.14 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.025 0.379 . . . . 3.3 112.025 173.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 14.0 tp -78.37 -20.57 50.97 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 120.867 -1.146 . . . . 3.82 112.1 -177.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -56.56 -25.68 52.9 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.922 0.889 . . . . 3.43 113.127 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.91 -2.96 49.72 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 115.656 1.724 . . . . 2.64 115.656 172.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -130.03 19.9 5.44 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.956 1.253 . . . . 2.94 114.154 -166.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.419 ' CG ' ' HE3' ' A' ' 35' ' ' LYS . 21.9 t60 -146.25 92.21 2.15 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.235 -1.541 . . . . 6.97 113.643 -157.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -73.54 36.0 0.09 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 127.026 2.13 . . . . 5.07 113.089 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.79 10.2 84.95 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 126.569 2.033 . . . . 2.57 113.672 -169.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -107.03 158.88 16.71 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.805 2.442 . . . . 4.73 111.12 -172.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.4 mm -130.95 138.16 54.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 108.473 -0.936 . . . . 2.22 108.473 161.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.2 t -73.46 -129.05 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 127.68 2.392 . . . . 2.87 109.999 170.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -133.19 -44.15 0.85 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 120.143 -1.598 . . . . 2.04 110.242 164.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -64.76 -20.14 66.19 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.95 1.093 . . . . 4.54 113.95 -176.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -53.2 -56.28 17.65 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.642 1.177 . . . . 3.73 112.043 173.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -58.12 -45.79 86.71 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.283 0.947 . . . . 2.25 112.151 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.5 t-105 -65.3 -40.9 94.41 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.613 0.765 . . . . 0.72 111.981 -178.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.8 m -59.71 -46.02 90.36 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.577 1.951 . . . . 1.97 111.676 171.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.5 mt -56.8 -42.82 80.17 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.751 0.705 . . . . 1.03 111.639 176.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.8 mm -52.67 -40.65 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 CA-C-N 119.749 1.159 . . . . 0.64 112.582 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.54 -24.96 72.65 Favored Glycine 0 N--CA 1.476 1.329 0 C-N-CA 124.557 1.075 . . . . 0.59 113.559 177.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -71.34 -23.22 78.31 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 121.445 -1.032 . . . . 0.58 113.447 176.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -90.13 -45.04 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 118.616 1.208 . . . . 0.85 110.568 162.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.6 m -85.72 64.67 8.75 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 127.821 2.448 . . . . 1.3 108.883 -172.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -144.02 -60.73 0.02 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.201 1.382 . . . . 1.25 111.742 -177.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -66.21 -72.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.991 3.127 . . . . 1.1 110.647 165.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.4 pp -66.91 -14.11 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.483 1.038 . . . . 1.37 113.666 -170.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.0 -33.94 74.03 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.67 0.989 . . . . 1.13 113.67 -177.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -42.15 95.09 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.871 -1.143 . . . . 2.98 112.523 170.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.2 tt -56.52 -39.21 72.95 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 124.456 1.102 . . . . 1.39 110.516 -173.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 22.2 mt -45.39 -62.8 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.675 1.59 . . . . 0.9 111.837 169.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -69.31 -29.38 67.21 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.687 0.795 . . . . 1.76 112.515 -175.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.264 2.5 pt-20 -83.35 -16.89 44.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.112 0.869 . . . . 2.96 112.421 177.155 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 -83.32 -42.11 17.49 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 115.205 1.557 . . . . 2.36 115.205 173.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -69.83 4.28 2.09 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 123.512 1.625 . . . . 2.4 112.028 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 . . . . . 0 C--N 1.329 -0.319 0 C-N-CA 127.722 2.409 . . . . 2.65 109.7 176.853 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.413 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 17.4 m-85 . . . . . 0 N--CA 1.487 1.401 0 N-CA-C 107.826 -1.176 . . . . 2.55 107.826 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.8 p -70.2 147.62 49.6 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 118.833 0.742 . . . . 1.01 109.478 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -64.8 -18.77 65.39 Favored 'General case' 0 C--O 1.213 -0.831 0 N-CA-C 113.549 0.944 . . . . 2.95 113.549 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.94 -54.36 27.34 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 121.072 1.76 . . . . 1.08 108.843 172.245 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -62.84 -52.15 64.25 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.801 1.241 . . . . 3.22 110.429 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 25.2 tptt -60.79 -29.93 69.74 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.543 0.942 . . . . 6.83 113.543 173.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.841 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.3 -37.5 77.82 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.045 -1.659 . . . . 0.72 112.858 170.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 91.3 t -57.61 -45.37 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-N 119.964 1.256 . . . . 0.67 109.58 166.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 6.9 mt -53.84 -53.86 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.252 0.933 . . . . 0.93 111.455 171.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 18.4 t -58.21 -42.85 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 119.532 1.06 . . . . 0.67 111.864 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 4.4 mp -66.25 -41.82 89.42 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.296 -0.877 . . . . 1.13 112.731 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 50.2 t -67.43 -40.88 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.85 0.86 . . . . 0.76 111.328 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 59.9 tt0 -65.44 -39.79 92.48 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 118.718 0.69 . . . . 3.7 112.42 171.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -60.25 -19.45 54.75 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.173 1.351 . . . . 2.44 114.123 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -91.2 -60.66 1.84 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.989 1.316 . . . . 2.08 112.522 170.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -59.13 -27.5 65.66 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.104 0.866 . . . . 1.8 113.135 -176.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -49.11 -19.37 0.43 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.383 1.623 . . . . 2.7 115.383 177.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -83.55 -13.29 54.79 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 116.077 1.88 . . . . 2.31 116.077 174.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 N--CA 1.482 1.16 0 CA-C-N 121.187 1.812 . . . . 4.23 109.527 174.153 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 10.0 pt . . . . . 0 N--CA 1.473 0.723 0 CA-C-O 120.815 0.34 . . . . 3.07 110.818 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 79.5 p -116.42 141.23 48.44 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.012 -1.055 . . . . 3.97 113.08 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 11.9 mttp -53.7 -28.42 33.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.133 1.373 . . . . 2.35 112.925 173.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 9.5 p -72.94 -34.3 66.47 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.937 1.295 . . . . 2.6 113.982 176.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 45.4 t -82.43 -43.23 17.55 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 117.799 -1.096 . . . . 2.99 113.335 -169.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.471 ' CE1' HD11 ' B' ' 145' ' ' LEU . 12.3 t80 -54.72 -48.42 72.55 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.939 1.699 . . . . 1.99 112.566 -176.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -60.36 -27.21 67.21 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.504 0.927 . . . . 2.33 113.504 176.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -92.94 -50.28 5.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.836 1.654 . . . . 3.13 111.266 -170.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 10.7 tmm? -51.27 -39.84 57.61 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.724 1.21 . . . . 1.79 111.575 167.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . 0.471 HD11 ' CE1' ' B' ' 141' ' ' PHE . 14.0 mt -54.47 -36.99 64.7 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.481 1.289 . . . . 1.25 114.481 174.024 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.84 -4.8 59.22 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.926 1.239 . . . . 2.01 113.467 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.28 -61.21 1.56 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.227 1.011 . . . . 1.64 111.505 163.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.27 -18.22 46.68 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.878 1.671 . . . . 2.5 112.775 -164.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.25 20.56 13.1 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 126.319 1.848 . . . . 2.1 113.147 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -51.8 -33.04 33.82 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.946 1.462 . . . . 1.66 114.946 -173.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -69.24 -26.34 64.74 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.826 1.047 . . . . 1.47 113.826 -174.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 53.3 mtm -109.71 -14.47 14.33 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.026 0.93 . . . . 2.27 112.702 171.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.09 65.0 1.09 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 122.919 1.342 . . . . 2.71 111.037 163.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 3.5 t -88.63 -67.47 0.83 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.245 -1.343 . . . . 3.5 108.853 170.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -80.79 139.23 36.15 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.61 0.719 . . . . 7.26 112.185 -161.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 51.1 m -49.13 -31.99 9.16 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.867 1.267 . . . . 4.22 112.303 173.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.58 -50.72 64.45 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.855 -0.97 . . . . 3.08 112.802 176.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -49.31 -60.92 2.4 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.539 1.136 . . . . 3.75 110.634 171.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -69.58 -35.74 75.63 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.716 1.006 . . . . 4.45 113.716 -170.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.0 -40.17 90.9 Favored 'General case' 0 CA--C 1.511 -0.542 0 O-C-N 120.454 -1.404 . . . . 4.57 112.946 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -50.47 -51.45 46.9 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 126.593 2.433 . . . . 1.56 110.551 174.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -48.9 -56.43 8.82 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.144 0.978 . . . . 0.71 112.554 173.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.48 -34.61 71.09 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.868 0.867 . . . . 1.9 112.738 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -59.82 -34.13 72.67 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 120.628 1.558 . . . . 3.17 113.231 172.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.2 mt -68.93 -34.0 74.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.35 -0.387 . . . . 0.87 111.55 -178.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 23.3 mm -64.31 -48.7 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 123.515 0.726 . . . . 0.97 110.876 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -68.77 -34.83 76.23 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.413 1.085 . . . . 1.87 112.059 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 28.8 m-20 -62.33 -43.19 99.41 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 120.569 0.223 . . . . 3.18 111.343 169.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 12.4 tp -67.34 -19.97 65.52 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 120.865 -1.147 . . . . 3.52 112.671 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.35 -26.3 64.94 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.77 0.656 . . . . 3.74 112.77 176.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.76 -5.11 56.7 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.318 1.599 . . . . 2.61 115.318 171.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -120.39 12.88 11.76 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.049 1.34 . . . . 3.07 114.103 -167.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -143.35 90.57 2.18 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 120.377 -1.452 . . . . 6.89 114.196 -153.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -72.58 39.39 0.08 Allowed 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 126.446 1.898 . . . . 5.28 113.207 173.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 69.73 6.34 55.07 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 125.99 1.757 . . . . 2.45 114.103 -171.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -96.64 163.23 13.11 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.602 1.961 . . . . 4.46 110.875 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 19.2 mm -129.32 143.82 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 107.769 -1.197 . . . . 2.44 107.769 157.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 22.1 t -75.2 -138.18 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.953 2.101 . . . . 2.54 110.728 171.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -125.14 -46.26 1.81 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 119.865 -1.772 . . . . 1.99 110.514 161.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -62.04 -19.89 63.37 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.44 1.274 . . . . 4.46 114.44 -178.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -52.15 -52.86 49.14 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.275 1.03 . . . . 3.42 111.996 172.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -62.62 -45.53 92.44 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.917 -1.114 . . . . 2.98 111.554 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.0 t-105 -62.43 -44.64 95.94 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.517 0.727 . . . . 0.76 112.306 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 58.4 m -55.68 -50.9 69.03 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.778 1.631 . . . . 1.97 110.956 170.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 81.9 mt -60.35 -33.23 72.12 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.194 -0.908 . . . . 0.7 112.967 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 29.3 mm -55.49 -42.47 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 CA-C-N 120.564 1.529 . . . . 0.74 111.807 174.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.37 -24.72 73.68 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.745 1.164 . . . . 0.64 113.651 178.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.02 -19.77 77.38 Favored Glycine 0 CA--C 1.536 1.353 0 O-C-N 121.269 -1.136 . . . . 0.69 113.566 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 5.0 mp -93.74 -47.37 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 118.421 1.111 . . . . 0.8 110.63 160.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.4 m -83.63 62.73 7.02 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 128.425 2.69 . . . . 1.37 109.174 -173.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -142.29 -60.77 0.03 OUTLIER Glycine 0 CA--C 1.528 0.9 0 C-N-CA 125.695 1.617 . . . . 1.23 111.301 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -64.3 -73.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 124.146 3.23 . . . . 1.2 111.048 165.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.4 pp -66.37 -14.58 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 119.708 1.14 . . . . 1.34 113.805 -169.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.63 -32.49 73.53 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.639 1.176 . . . . 1.2 114.08 -176.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -44.93 91.43 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.603 -1.311 . . . . 3.08 112.537 168.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.1 tt -57.48 -36.51 71.58 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.414 1.086 . . . . 1.54 111.325 -172.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 29.2 mt -45.44 -63.05 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.872 1.669 . . . . 0.87 110.997 170.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -65.63 -35.4 80.7 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.607 0.763 . . . . 1.81 111.91 -176.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.297 2.2 pt-20 -76.91 -20.25 56.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.544 1.066 . . . . 3.08 112.51 177.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 5.2 mm100 -80.76 -42.75 21.28 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 115.329 1.604 . . . . 2.47 115.329 174.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -70.44 6.18 1.49 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 123.609 1.671 . . . . 2.5 112.385 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -125.36 -68.44 0.84 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.506 2.322 . . . . 2.48 110.407 176.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.295 11.3 pt20 . . . . . 0 N--CA 1.477 0.879 1 C-N-CA 131.944 4.097 . . . . 3.87 115.681 -177.79 . . . . . . . . 2 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 113.946 1.091 . . . . 2.47 113.946 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.8 p -73.14 154.23 40.42 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.107 0.563 . . . . 1.29 111.451 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.34 2.11 8.21 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.259 1.023 . . . . 2.62 113.1 169.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.11 -56.33 4.16 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.598 -1.314 . . . . 1.15 109.306 158.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -76.94 -50.51 13.07 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 120.854 -1.154 . . . . 2.73 112.837 -168.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.0 tmtt? -58.38 -24.86 61.17 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.209 -0.932 . . . . 5.23 111.494 169.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -74.31 -43.23 57.58 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 119.662 -1.899 . . . . 0.69 112.721 168.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 77.0 t -55.29 -35.65 37.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 CA-C-N 120.612 1.551 . . . . 0.68 111.258 169.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 38.2 mt -53.88 -58.9 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.026 0.83 . . . . 1.02 111.081 165.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 49.2 t -61.37 -40.16 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.28 1.032 . . . . 0.92 113.424 -177.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.7 mp -65.26 -40.06 93.46 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.522 1.056 . . . . 1.04 111.843 177.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.0 t -63.84 -43.8 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-O 118.747 -0.644 . . . . 0.6 110.605 171.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.46 -43.53 75.57 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.695 0.68 . . . . 3.65 111.51 173.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.75 -15.87 63.85 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.979 1.474 . . . . 2.39 114.979 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -86.3 -53.41 5.04 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.109 -0.994 . . . . 2.17 111.306 167.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -60.61 -39.41 88.05 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.804 0.668 . . . . 1.93 112.804 -175.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -19.76 65.06 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 114.981 1.475 . . . . 3.59 114.981 173.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -95.44 -28.98 14.65 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.695 1.198 . . . . 2.68 112.603 172.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.6 t . . . . . 0 N--CA 1.485 1.321 0 CA-C-N 118.974 0.806 . . . . 3.27 110.771 165.28 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.4 pt . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 108.995 -0.743 . . . . 2.92 108.995 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.7 m -60.14 136.64 58.08 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.24 0.829 . . . . 2.48 113.24 -166.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.463 ' HB3' HG23 ' A' ' 63' ' ' ILE . 10.9 mtpp -55.75 -31.85 62.9 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 120.877 -1.14 . . . . 4.72 113.518 176.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.72 -30.86 14.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.774 1.63 . . . . 2.69 113.151 169.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.9 m -77.58 -36.29 52.12 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.985 -1.072 . . . . 1.79 112.622 -174.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 12.5 t80 -53.01 -56.19 17.95 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.283 0.947 . . . . 1.88 111.023 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.402 ' HG3' HH11 ' A' ' 39' ' ' ARG . 13.9 ptt85 -61.62 -8.39 4.42 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.844 1.258 . . . . 3.04 113.966 -178.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -117.0 -32.79 4.94 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.943 1.297 . . . . 4.22 113.715 -174.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 5.6 tmm? -50.97 -42.98 60.41 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.873 0.76 . . . . 1.42 109.399 150.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.1 mt -62.68 -19.02 63.44 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 115.502 1.668 . . . . 1.3 115.502 169.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -91.57 -35.5 14.23 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 119.714 1.143 . . . . 2.65 112.106 172.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -81.27 -50.98 8.88 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.042 0.837 . . . . 1.88 112.271 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -78.46 -30.58 47.49 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.907 0.776 . . . . 2.68 111.769 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.16 19.41 20.64 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.055 1.342 . . . . 1.57 113.763 -177.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -48.09 -35.38 11.25 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.143 1.777 . . . . 1.43 115.228 -173.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.474 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 7.4 m-70 -65.21 -21.11 66.71 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.437 1.495 . . . . 1.79 114.588 -178.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 39.4 ttm -95.22 10.52 35.71 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.462 1.505 . . . . 2.7 114.325 -169.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.7 mp -81.11 169.81 16.96 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.818 1.247 . . . . 3.54 112.489 178.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.3 m -157.12 36.35 0.29 Allowed 'General case' 0 N--CA 1.476 0.838 0 O-C-N 119.843 -1.786 . . . . 4.36 110.386 -164.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.6 t70 92.71 -175.06 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 129.592 3.157 . . . . 4.06 107.865 -146.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 52.8 p -66.38 -12.76 58.69 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.971 1.708 . . . . 2.88 114.764 170.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.46 -30.72 42.12 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 125.668 1.604 . . . . 1.62 114.644 -171.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -69.24 -45.55 69.52 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.483 1.513 . . . . 3.23 110.65 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.9 ttt-85 -65.74 -47.33 75.66 Favored 'General case' 0 C--N 1.346 0.448 0 O-C-N 121.461 -0.774 . . . . 5.19 110.039 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.8 mmtt -55.94 -29.04 59.51 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.09 0.774 . . . . 4.13 113.09 175.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.86 -39.27 69.79 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 117.759 -1.115 . . . . 1.58 112.305 171.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.62 -44.37 93.48 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.386 1.075 . . . . 1.0 111.969 172.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -53.01 -37.57 61.6 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.376 1.07 . . . . 2.26 112.731 175.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -61.3 -34.53 75.37 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 120.195 -1.565 . . . . 3.67 112.797 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.4 mt -74.5 -38.2 62.93 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.04 1.336 . . . . 1.14 111.852 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.463 HG23 ' HB3' ' A' ' 35' ' ' LYS . 17.8 mm -49.56 -59.18 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 117.726 -1.13 . . . . 1.25 109.595 170.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -62.51 -36.15 81.66 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 119.603 1.092 . . . . 2.89 113.091 -174.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -62.71 -34.48 77.23 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.859 1.263 . . . . 2.67 113.009 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -86.36 -44.85 11.74 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.368 1.067 . . . . 3.29 112.266 176.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -62.43 -38.76 90.97 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.281 1.433 . . . . 2.54 111.724 -168.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.78 -18.72 13.71 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.66 1.184 . . . . 2.32 114.117 171.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -113.43 -0.54 14.44 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.082 1.753 . . . . 3.11 113.099 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -135.24 128.77 32.54 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 120.964 1.711 . . . . 3.91 112.042 -163.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -79.49 46.56 0.76 Allowed 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 122.599 1.19 . . . . 4.82 112.042 -175.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 59.45 2.24 1.5 Allowed Glycine 0 CA--C 1.538 1.489 0 C-N-CA 125.24 1.4 . . . . 4.06 113.043 -157.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -79.06 100.63 7.44 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 120.609 -1.524 . . . . 7.88 110.977 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.5 pt -69.58 166.4 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.965 1.706 . . . . 3.41 112.976 162.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 64.2 m -141.87 169.36 17.74 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.451 1.5 . . . . 2.17 110.973 166.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -52.62 -55.74 20.25 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.31 1.053 . . . . 2.05 111.927 179.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.02 -37.82 64.49 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 128.733 2.813 . . . . 2.98 111.785 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -74.77 -46.98 33.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.588 1.155 . . . . 3.68 110.603 -171.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -51.12 -54.09 28.28 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.725 0.693 . . . . 1.83 111.002 167.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 22.6 t-105 -62.78 -46.87 86.01 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 118.375 0.534 . . . . 0.57 111.873 -171.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 39.1 p -61.31 -43.49 98.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 117.785 -1.102 . . . . 2.84 111.549 178.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 23.8 mt -56.44 -36.88 69.51 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.173 -0.918 . . . . 0.99 113.231 175.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.1 mm -51.07 -36.52 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-N 120.127 1.33 . . . . 0.85 111.232 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.49 -19.65 76.42 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.479 1.037 . . . . 0.68 114.646 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.11 -11.84 84.96 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 119.083 1.441 . . . . 0.64 113.44 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.8 mp -105.0 -45.71 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.041 1.336 . . . . 0.8 110.263 165.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.7 m -80.71 88.18 5.79 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 126.582 1.953 . . . . 1.26 107.782 178.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -172.22 -77.6 0.05 OUTLIER Glycine 0 CA--C 1.528 0.856 0 CA-C-O 118.384 -1.231 . . . . 0.86 112.602 -170.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -59.71 -41.53 54.61 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.417 2.745 . . . . 1.08 112.756 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.8 pt -77.39 -11.39 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 114.216 1.191 . . . . 1.15 114.216 174.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.16 -32.63 74.07 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 113.936 1.087 . . . . 1.05 113.936 -166.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -43.68 97.57 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.856 -1.153 . . . . 3.41 111.963 169.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.5 tt -61.43 -37.82 84.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.892 1.277 . . . . 1.42 110.875 -169.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 97.3 mt -50.06 -67.14 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.29 1.436 . . . . 1.09 110.97 168.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -59.7 -29.83 68.38 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.598 -1.314 . . . . 1.78 112.998 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.24 -29.68 65.41 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.944 0.898 . . . . 2.91 111.781 174.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -77.81 -37.96 47.48 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.782 2.033 . . . . 4.94 110.984 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -63.01 4.1 0.2 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 123.483 1.611 . . . . 2.59 113.331 171.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 . . . . . 0 C--N 1.326 -0.444 0 C-N-CA 125.301 1.44 . . . . 3.0 110.925 169.384 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 113.555 0.946 . . . . 2.32 113.555 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 20.7 p -67.98 154.8 40.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 122.608 0.363 . . . . 1.09 110.105 -175.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -57.92 -38.39 75.81 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-O 118.322 -0.846 . . . . 2.49 111.471 174.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.1 -53.52 49.18 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.523 1.056 . . . . 0.79 110.67 173.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 12.1 tm-20 -74.64 -47.4 32.28 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.613 -0.68 . . . . 2.84 111.769 -170.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -60.95 -28.1 68.72 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.873 0.869 . . . . 4.88 111.908 171.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -70.38 -41.43 73.07 Favored 'General case' 0 C--O 1.222 -0.39 0 O-C-N 119.559 -1.963 . . . . 0.49 112.565 166.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 64.3 t -59.71 -37.04 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 120.572 1.533 . . . . 0.67 110.698 171.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 26.2 mt -53.41 -59.17 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 118.913 0.778 . . . . 0.83 111.166 164.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 44.3 t -61.45 -40.83 87.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-N 119.342 0.973 . . . . 0.7 113.307 -175.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.7 mp -63.18 -45.47 91.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.593 1.157 . . . . 1.06 111.68 174.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 44.5 t -57.16 -46.45 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-O 118.794 -0.622 . . . . 0.67 110.302 173.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.1 -44.77 75.23 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 118.849 0.749 . . . . 3.46 111.391 173.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . 0.422 HD21 ' HG3' ' B' ' 148' ' ' GLU . 0.3 OUTLIER -67.36 -15.67 63.81 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.933 1.457 . . . . 2.25 114.933 -179.332 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -85.04 -58.19 2.79 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.442 -0.786 . . . . 2.43 111.151 166.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -57.74 -38.47 75.39 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.133 0.79 . . . . 1.88 113.133 -175.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -19.59 65.98 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.534 1.309 . . . . 3.51 114.534 175.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -92.86 -32.58 14.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.509 1.123 . . . . 2.49 112.337 169.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 97.7 t . . . . . 0 N--CA 1.487 1.414 0 CA-C-N 119.348 0.976 . . . . 3.2 111.043 167.453 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 3.8 pt . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 109.56 -0.533 . . . . 3.02 109.56 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 2.9 m -59.53 138.86 57.56 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.995 1.109 . . . . 2.23 113.995 -164.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -56.89 -37.75 71.81 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 120.426 -1.421 . . . . 4.7 110.48 169.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 66.0 m -55.94 -13.36 1.82 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.803 2.041 . . . . 3.46 116.093 167.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 74.5 m -88.76 -39.19 14.11 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.42 1.463 . . . . 1.75 111.975 169.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -52.54 -48.23 66.22 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 120.242 1.383 . . . . 2.2 111.819 -179.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 19.6 ptt85 -55.23 -18.76 6.59 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.776 1.399 . . . . 3.35 114.776 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -114.8 -32.12 5.91 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.759 1.223 . . . . 3.4 113.659 -172.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 6.3 tmm? -50.67 -46.46 58.63 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.725 -0.472 . . . . 1.48 109.725 153.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 4.4 mt -63.87 -27.63 69.29 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 114.923 1.453 . . . . 1.33 114.923 170.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -77.35 -33.46 55.34 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 120.258 1.39 . . . . 2.53 112.177 175.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -84.77 -55.33 4.15 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.392 0.677 . . . . 1.54 112.801 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.422 ' HG3' HD21 ' B' ' 121' ' ' ASN . 3.8 mm-40 -77.0 -19.52 57.17 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.639 0.654 . . . . 2.71 112.589 -174.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.52 20.02 12.51 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.464 1.506 . . . . 1.86 113.294 -177.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -52.13 -26.0 10.24 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 116.159 1.911 . . . . 1.39 116.159 -172.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . 0.403 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 6.6 m-70 -77.47 -25.19 50.29 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.87 -1.144 . . . . 1.84 113.576 -175.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 32.1 ttm -80.01 27.81 0.3 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.338 1.455 . . . . 2.88 113.973 -171.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.6 mp -102.71 173.69 6.22 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.437 1.895 . . . . 4.02 113.289 -171.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 62.5 m -162.22 43.53 0.14 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 126.032 1.733 . . . . 4.56 109.469 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 7.5 t70 82.82 -175.98 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.575 2.35 . . . . 4.49 108.498 -144.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 70.7 p -66.46 -15.82 63.64 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 128.468 2.707 . . . . 2.92 114.87 -178.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.71 -37.27 67.98 Favored Glycine 0 N--CA 1.476 1.309 0 CA-C-N 120.622 1.555 . . . . 1.7 113.328 -173.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.97 -39.62 94.55 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.387 1.475 . . . . 3.52 110.79 176.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 43.2 ttt-85 -71.59 -38.81 70.84 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.327 -0.858 . . . . 4.71 112.942 167.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -57.48 -33.44 68.0 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.237 -1.539 . . . . 3.14 111.175 178.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' B' ' 164' ' ' LYS . . . -65.28 -13.95 59.6 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 115.973 1.842 . . . . 1.27 115.973 171.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.01 -49.53 10.14 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.822 1.249 . . . . 0.92 110.817 164.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -59.48 -34.53 72.7 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 125.047 1.339 . . . . 2.85 111.686 -176.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . 0.497 ' HG2' ' HA ' ' B' ' 161' ' ' ALA . 1.9 ptmm? -55.55 -31.1 61.86 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 120.861 -1.149 . . . . 3.98 113.684 169.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 23.4 mt -82.8 -37.33 24.65 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.332 -0.855 . . . . 1.16 112.391 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 26.8 mm -47.89 -60.61 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.098 0.959 . . . . 0.98 109.299 173.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -58.25 -39.26 78.71 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.37 0.878 . . . . 1.92 113.37 -174.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -62.69 -29.6 70.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.594 1.558 . . . . 2.84 112.637 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -99.69 -47.2 5.16 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.308 1.443 . . . . 3.59 110.839 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -53.61 -48.03 69.67 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 128.863 2.865 . . . . 2.62 111.533 -178.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.52 -15.1 15.76 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 115.009 1.485 . . . . 3.2 115.009 175.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -118.28 5.74 11.89 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.982 1.713 . . . . 4.06 112.852 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.02 134.18 42.12 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 119.749 -1.844 . . . . 4.27 113.627 -164.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -79.83 58.86 2.96 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 122.422 1.106 . . . . 4.64 111.604 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 62.8 19.54 60.96 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.169 1.842 . . . . 4.19 113.451 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -88.67 153.34 21.19 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 122.835 1.302 . . . . 7.78 114.06 -163.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 5.3 pt -132.15 169.65 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 128.022 2.529 . . . . 3.87 109.784 170.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 58.6 m -142.09 176.66 8.79 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.019 1.328 . . . . 1.71 109.562 165.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -59.15 -52.58 65.11 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 122.371 1.081 . . . . 2.19 110.083 168.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -43.71 87.17 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 129.053 2.941 . . . . 3.06 111.128 -178.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -72.64 -47.43 47.65 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.454 1.102 . . . . 3.6 110.691 -174.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -51.33 -51.53 53.56 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.931 1.241 . . . . 1.92 111.598 168.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -65.25 -41.79 93.94 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.394 0.516 . . . . 0.7 112.394 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 41.7 p -65.5 -37.21 86.13 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 117.908 -1.044 . . . . 2.65 111.777 176.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 76.3 mt -57.33 -39.91 76.88 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.973 0.806 . . . . 0.58 112.549 172.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 42.2 mm -54.07 -44.79 64.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 119.773 1.17 . . . . 0.91 111.596 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -70.15 -5.63 54.3 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 125.081 1.324 . . . . 1.03 114.266 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -93.3 -11.97 57.86 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-O 118.495 -1.169 . . . . 0.67 113.775 170.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.9 mp -95.35 -56.21 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 119.036 1.418 . . . . 1.17 107.895 164.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 42.1 m -74.65 98.01 3.33 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 126.252 1.821 . . . . 1.42 108.119 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -170.45 -80.18 0.05 OUTLIER Glycine 0 CA--C 1.532 1.143 0 C-N-CA 124.985 1.279 . . . . 1.01 112.787 -172.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -62.53 -43.38 22.21 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.126 2.551 . . . . 1.43 112.125 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 10.4 pt -72.49 -10.35 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 114.313 1.227 . . . . 1.38 114.313 173.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . 0.44 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -60.92 -35.18 76.03 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.109 1.152 . . . . 1.23 114.109 -174.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -48.82 80.06 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.471 -1.393 . . . . 3.74 111.734 166.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.14 -37.83 78.21 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.183 1.393 . . . . 1.57 111.917 -174.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' B' ' 194' ' ' ALA . 96.5 mt -53.29 -60.7 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.441 1.496 . . . . 1.22 111.935 168.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -63.74 -30.67 71.74 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.381 -0.824 . . . . 1.8 112.094 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -71.72 -27.28 62.9 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.4 -0.812 . . . . 2.96 111.86 175.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -73.98 -39.67 63.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.821 1.248 . . . . 5.35 110.248 179.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.6 1.81 0.53 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 125.408 1.483 . . . . 3.1 112.905 172.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -109.73 -71.35 0.77 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 120.427 -1.42 . . . . 2.9 111.579 167.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 . . . . . 0 CA--C 1.532 0.268 0 CA-C-N 114.92 -1.037 . . . . 5.98 112.414 -164.751 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 . . . . . 0 N--CA 1.477 0.898 0 CA-C-O 120.844 0.354 . . . . 2.41 111.22 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 70.5 p -57.53 148.21 24.53 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.84 0.856 . . . . 1.07 109.634 176.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.618 ' HG2' HG21 ' B' ' 117' ' ' VAL . 4.1 tp10 -59.17 -31.42 68.97 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 118.554 0.615 . . . . 2.28 111.445 175.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.87 -41.75 98.23 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.681 -0.637 . . . . 1.11 111.0 177.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -53.09 13.17 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 118.407 -0.806 . . . . 3.37 110.495 175.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -42.32 -43.09 3.36 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.343 1.057 . . . . 4.9 112.5 170.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.17 -42.09 76.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 125.054 1.342 . . . . 0.54 112.668 -178.211 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 54.3 t -56.52 -46.41 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.99 0.814 . . . . 0.9 109.762 167.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 16.3 mt -54.77 -49.15 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-N 118.413 0.551 . . . . 0.9 111.432 174.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.615 HG21 ' HG2' ' B' ' 110' ' ' GLU . 32.7 t -65.07 -41.71 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 118.997 0.817 . . . . 0.6 112.341 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.56 -41.38 97.29 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.251 -0.905 . . . . 0.94 111.233 176.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 80.1 t -72.66 -37.33 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.275 1.43 . . . . 0.84 112.486 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -55.51 -54.75 40.01 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.312 1.045 . . . . 3.04 110.142 170.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -71.12 -9.57 58.28 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.198 1.184 . . . . 2.74 114.198 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.431 ' HB2' ' CE2' ' A' ' 79' ' ' TYR . 60.0 t80 -79.95 -65.62 0.98 Allowed 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.853 -1.154 . . . . 2.48 112.22 167.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -63.69 -28.63 70.03 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 118.934 -0.555 . . . . 2.25 112.053 -170.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.0 mtpt -46.35 -38.59 9.01 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.354 1.462 . . . . 2.65 114.44 168.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -92.41 -26.09 18.18 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.808 -0.557 . . . . 2.33 111.325 -176.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.8 t . . . . . 0 N--CA 1.473 0.678 0 C-N-CA 126.243 1.817 . . . . 3.07 112.881 176.051 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.3 tt . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 108.379 -0.971 . . . . 2.93 108.379 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.8 m -163.9 163.29 23.71 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 127.081 2.152 . . . . 3.76 109.433 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.4 pttt -47.15 -13.3 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.273 0 N-CA-C 118.011 2.597 . . . . 2.79 118.011 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.3 m -78.98 -28.02 43.5 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 119.912 -1.743 . . . . 2.38 114.501 169.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.8 m -77.66 -48.76 16.02 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.624 1.102 . . . . 1.53 111.477 -171.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.431 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 9.8 t80 -49.13 -49.6 41.38 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.166 0.986 . . . . 2.01 112.032 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -58.3 -30.24 66.5 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 118.23 -0.891 . . . . 3.79 113.16 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -96.58 -40.93 8.79 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.172 1.389 . . . . 2.88 113.533 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 43.3 ttp -49.43 -42.1 41.83 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.863 1.665 . . . . 2.59 112.044 163.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.431 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 12.0 mt -55.01 -19.99 8.18 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 114.398 1.258 . . . . 0.97 114.398 170.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -98.75 -11.23 22.09 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.447 1.499 . . . . 2.65 113.009 177.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 -59.5 1.77 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.275 1.03 . . . . 1.61 112.118 170.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -76.9 -26.42 54.13 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.708 1.203 . . . . 3.59 113.156 -172.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.15 43.91 2.34 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.006 1.722 . . . . 1.62 111.745 -179.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -84.24 -17.86 38.38 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 116.566 2.061 . . . . 1.34 116.566 -171.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.523 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 10.5 m-70 -80.92 -25.99 37.08 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 120.917 1.69 . . . . 1.7 113.244 -168.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 76.0 mtm -97.59 15.5 23.21 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.182 1.393 . . . . 2.55 113.257 164.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.26 -152.56 0.29 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.194 1.798 . . . . 2.63 110.853 174.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.1 t 69.11 -35.91 0.32 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.849 2.059 . . . . 6.61 113.78 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -35.03 18.26 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 127.3 2.24 . . . . 6.35 113.075 174.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 95.1 m 74.41 -23.45 0.23 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 127.329 2.252 . . . . 2.8 114.123 169.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.26 -48.97 76.15 Favored Glycine 0 CA--C 1.532 1.154 0 CA-C-N 120.549 1.522 . . . . 2.25 110.244 160.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -37.47 -65.2 0.33 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.073 2.549 . . . . 4.17 111.254 159.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.9 tpm_? -56.77 -46.52 81.41 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 114.613 1.338 . . . . 5.81 114.613 -175.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -66.28 -35.86 81.49 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.534 0.733 . . . . 3.02 111.586 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.19 -32.87 66.89 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 118.086 -0.959 . . . . 1.12 112.885 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.56 -44.12 95.05 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.422 1.089 . . . . 0.94 112.78 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.99 -22.73 59.5 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.172 0.804 . . . . 3.49 113.172 -175.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -54.88 -37.79 66.73 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 121.552 -0.718 . . . . 3.11 112.167 164.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 12.6 mt -74.63 -43.7 54.13 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.159 -0.928 . . . . 1.15 111.175 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.0 mm -60.22 -39.04 79.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 118.408 -0.806 . . . . 1.35 111.384 -175.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -72.32 -37.58 68.88 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.889 0.876 . . . . 2.4 113.297 176.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -62.82 -34.9 78.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.902 1.281 . . . . 3.38 112.552 171.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.1 tp -82.27 -36.64 26.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.259 1.424 . . . . 2.58 111.454 178.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -43.71 -57.13 3.37 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.8 2.04 . . . . 4.42 113.024 -169.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.42 -16.34 3.56 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.702 2.001 . . . . 2.32 114.844 -177.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -110.89 -1.62 16.4 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.918 1.287 . . . . 2.33 113.059 -173.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 30.6 m80 -138.06 101.21 4.36 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.024 -1.047 . . . . 3.45 112.755 -166.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.13 27.4 0.14 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.942 2.097 . . . . 4.66 114.349 -171.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.77 32.8 58.72 Favored Glycine 0 CA--C 1.533 1.161 0 O-C-N 120.112 -1.618 . . . . 2.43 110.643 -150.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.8 mmt-85 -95.34 159.17 15.13 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.051 1.34 . . . . 5.91 108.615 162.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.4 mm -145.26 140.66 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 126.454 1.902 . . . . 2.23 107.895 -173.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 t -116.97 173.47 6.63 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.671 0.748 . . . . 1.92 112.15 166.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -78.19 -47.47 17.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.355 1.062 . . . . 2.33 111.988 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -73.3 -23.86 60.33 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.092 2.157 . . . . 2.77 113.372 -178.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -48.07 -61.19 2.1 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.807 2.043 . . . . 3.27 111.075 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.431 ' CE2' ' HB2' ' A' ' 19' ' ' PHE . 6.8 t80 -54.98 -49.29 71.81 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.312 -0.868 . . . . 1.95 111.485 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.486 ' CZ2' HG21 ' B' ' 186' ' ' ILE . 19.6 t-105 -61.0 -48.18 83.01 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.239 0.615 . . . . 1.06 111.881 -178.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.5 t -73.28 -25.15 60.56 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.752 -1.118 . . . . 2.11 112.647 -178.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.7 mt -69.45 -36.11 76.3 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.562 1.073 . . . . 0.92 112.274 170.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.449 HG21 ' CZ2' ' B' ' 183' ' ' TRP . 21.4 mm -48.23 -44.11 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 CA-C-N 120.336 1.425 . . . . 0.79 111.408 177.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.45 -15.1 44.72 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 124.159 0.885 . . . . 0.74 114.998 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.86 -19.81 60.71 Favored Glycine 0 CA--C 1.533 1.161 0 CA-C-N 118.741 1.27 . . . . 0.72 114.077 172.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.0 mp -99.13 -52.49 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-N 119.139 1.47 . . . . 0.92 109.24 170.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.1 m -73.91 59.23 0.69 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 128.225 2.61 . . . . 1.45 108.387 167.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -146.11 -69.63 0.01 OUTLIER Glycine 0 CA--C 1.525 0.692 0 C-N-CA 126.711 2.1 . . . . 1.07 109.299 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -58.0 -50.88 9.0 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.273 2.649 . . . . 1.52 112.742 173.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.9 pp -90.8 -11.82 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 113.827 1.047 . . . . 1.46 113.827 -175.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.58 -29.99 70.66 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 120.842 -1.161 . . . . 1.74 113.448 -174.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -37.74 67.42 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.036 -1.04 . . . . 3.63 113.792 168.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.6 tt -56.58 -40.35 75.09 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.829 1.252 . . . . 2.02 110.807 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 57.0 mt -47.92 -62.8 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.059 1.344 . . . . 1.38 110.1 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -73.24 -24.82 60.52 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.966 -1.084 . . . . 1.81 112.794 -174.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -67.65 -27.89 67.24 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-O 118.489 -0.767 . . . . 3.64 110.136 168.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -90.27 -38.59 13.31 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.328 1.851 . . . . 2.32 115.745 178.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -61.37 -2.66 0.74 Allowed 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 121.47 1.941 . . . . 2.2 112.054 167.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 N--CA 1.451 -0.392 0 C-N-CA 126.129 1.771 . . . . 1.92 111.838 165.53 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.523 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 85.8 m-85 . . . . . 0 N--CA 1.475 0.802 0 N-CA-C 110.168 -0.308 . . . . 2.67 110.168 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 81.3 p -64.14 156.8 27.32 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 121.372 -0.83 . . . . 1.22 110.373 171.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . 0.615 ' HG2' HG21 ' A' ' 14' ' ' VAL . 1.5 tp10 -60.38 -19.52 56.08 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.219 0.463 . . . . 2.71 111.49 171.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -44.9 66.07 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.599 1.56 . . . . 1.01 111.369 172.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.37 -44.57 62.38 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 117.69 -1.147 . . . . 2.94 111.634 173.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . 0.407 ' O ' HG23 ' B' ' 117' ' ' VAL . 1.7 mmmp? -43.83 -48.05 8.23 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.621 1.555 . . . . 4.66 111.088 165.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -66.21 -53.36 38.18 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 118.045 -0.978 . . . . 0.81 113.606 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 42.6 t -52.84 -46.61 52.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 CA-C-N 119.707 1.14 . . . . 0.92 111.131 174.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 93.8 mt -53.16 -52.35 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.846 1.258 . . . . 1.38 110.926 170.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . 0.618 HG21 ' HG2' ' A' ' 7' ' ' GLU . 21.8 t -67.62 -37.96 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-N 119.97 1.259 . . . . 0.56 112.543 -175.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -61.78 -41.86 98.26 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.062 0.945 . . . . 0.99 111.055 175.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 72.9 t -75.07 -40.44 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.886 1.274 . . . . 0.82 112.302 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -51.93 -56.42 14.24 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.724 1.21 . . . . 3.08 110.086 170.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -69.78 -15.08 63.06 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.811 1.041 . . . . 3.01 113.811 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -83.79 -60.85 1.99 Allowed 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.406 -0.809 . . . . 2.02 113.103 172.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -58.34 -32.9 68.96 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.66 -0.65 . . . . 2.34 112.16 -174.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -41.24 -44.54 2.67 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.102 1.761 . . . . 2.67 114.293 169.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -89.16 -29.52 19.26 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.46 0.704 . . . . 2.26 112.282 -176.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 56.1 t . . . . . 0 N--CA 1.474 0.763 0 C-N-CA 126.217 1.807 . . . . 3.39 111.991 176.765 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.7 tt . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 107.544 -1.28 . . . . 3.09 107.544 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 6.2 m -161.79 162.82 29.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 124.354 1.062 . . . . 3.53 110.273 173.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 30.3 pttt -50.98 -11.06 0.08 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 128.301 2.64 . . . . 2.66 117.066 -179.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.0 m -80.99 -27.9 35.73 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 119.706 -1.872 . . . . 2.13 114.418 166.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 26.8 m -76.86 -46.4 24.81 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.572 -1.33 . . . . 1.32 112.058 -169.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -51.23 -50.16 59.68 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.513 1.125 . . . . 2.42 112.438 175.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -65.01 -12.28 48.57 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.979 1.103 . . . . 3.53 113.979 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -98.37 -43.67 6.83 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 120.171 1.351 . . . . 2.48 111.225 170.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 63.2 ttp -54.04 -41.85 68.54 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.279 1.831 . . . . 2.91 112.479 177.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 11.7 mt -59.86 -29.3 68.2 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.913 -1.117 . . . . 1.53 113.625 172.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -80.48 -9.82 59.76 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.901 1.281 . . . . 2.61 112.885 176.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.99 -64.72 1.01 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.551 1.14 . . . . 1.55 111.366 167.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -75.85 -13.71 60.28 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.557 -1.339 . . . . 3.19 114.279 -172.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.2 18.13 9.12 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.104 1.362 . . . . 1.67 112.748 177.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -53.75 -28.45 34.58 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 115.365 1.617 . . . . 1.26 115.365 -171.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -66.98 -25.89 66.54 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 114.128 1.159 . . . . 1.62 114.128 -169.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 68.1 mtm -105.14 11.59 32.99 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.407 1.083 . . . . 2.5 112.598 171.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . 0.453 HD23 ' H ' ' B' ' 154' ' ' SER . 0.2 OUTLIER -99.21 -163.76 1.07 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.448 1.899 . . . . 2.4 110.398 -178.701 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.453 ' H ' HD23 ' B' ' 153' ' ' LEU . 5.3 t 70.53 -23.16 0.17 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.235 1.814 . . . . 7.09 113.988 -177.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -65.54 16.67 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 128.309 2.644 . . . . 7.01 114.638 177.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 98.8 m 62.41 -65.83 0.09 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 128.853 2.861 . . . . 4.19 113.548 -179.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -54.01 -40.52 66.15 Favored Glycine 0 N--CA 1.468 0.825 0 C-N-CA 125.543 1.544 . . . . 2.44 112.692 -172.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -43.74 -67.5 0.27 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.77 1.628 . . . . 4.16 112.232 168.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 25.0 ttt-85 -73.79 -29.58 62.26 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.105 -0.997 . . . . 5.04 112.528 -173.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -61.19 -42.42 98.55 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.574 -1.328 . . . . 3.14 112.137 171.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.12 -37.61 74.91 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.55 0.944 . . . . 1.23 113.55 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -58.02 -47.18 83.84 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.851 1.26 . . . . 0.96 112.856 173.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.06 -23.59 60.58 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.438 -0.789 . . . . 3.4 112.906 -173.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -54.5 -36.64 64.4 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.683 -0.635 . . . . 3.02 112.058 164.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 7.4 mt -73.76 -46.04 48.11 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.523 -0.762 . . . . 1.04 110.712 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 7.1 mm -60.31 -42.73 91.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.691 0.678 . . . . 1.26 112.002 -175.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -68.65 -36.46 78.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.486 1.114 . . . . 1.98 113.223 177.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -70.24 -37.62 75.01 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.06 1.344 . . . . 2.84 111.57 174.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 10.5 tp -74.48 -32.74 62.65 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.62 1.168 . . . . 2.58 111.506 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -46.4 -54.58 8.83 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 125.822 1.649 . . . . 4.03 112.808 -172.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -61.53 -4.95 1.52 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.337 1.855 . . . . 2.27 115.771 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -121.35 -2.76 9.49 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.526 1.13 . . . . 2.27 113.423 -176.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 66.7 m80 -137.15 89.61 2.45 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.889 -1.132 . . . . 3.61 111.978 -167.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.78 29.32 0.09 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.581 2.752 . . . . 4.75 114.564 -167.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.35 32.23 58.22 Favored Glycine 0 CA--C 1.534 1.24 0 O-C-N 120.268 -1.52 . . . . 2.57 110.557 -149.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 47.1 mmt-85 -103.23 151.32 22.79 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.231 1.812 . . . . 5.91 107.388 161.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 33.2 mm -144.49 140.78 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 127.281 2.232 . . . . 2.24 106.713 -172.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.1 t -119.81 171.3 8.51 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.754 0.788 . . . . 1.97 112.559 171.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -77.99 -46.46 21.0 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.062 0.945 . . . . 2.43 112.327 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -71.2 -23.6 62.06 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.473 1.909 . . . . 2.78 113.213 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -48.51 -60.5 2.64 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 127.083 2.153 . . . . 3.18 111.061 175.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -57.17 -46.21 83.01 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.299 -0.876 . . . . 1.95 111.602 -179.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . 0.449 ' CZ2' HG21 ' A' ' 83' ' ' ILE . 19.9 t-105 -61.86 -46.19 90.52 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.366 0.666 . . . . 1.06 112.395 -178.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 6.5 t -69.05 -36.75 78.04 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.803 0.729 . . . . 1.76 111.299 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 81.6 mt -61.18 -37.22 82.15 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.458 1.026 . . . . 0.72 113.288 174.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . 0.486 HG21 ' CZ2' ' A' ' 80' ' ' TRP . 15.3 mm -49.51 -44.85 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 120.049 1.295 . . . . 0.91 110.795 176.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -64.67 -13.13 55.23 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.607 1.098 . . . . 0.63 114.601 -177.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -83.41 -20.64 59.95 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-N 118.7 1.25 . . . . 0.79 113.906 170.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 5.1 mp -96.06 -55.56 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 119.429 1.615 . . . . 1.09 108.797 171.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 27.6 m -73.11 59.17 0.52 Allowed 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 128.638 2.775 . . . . 1.48 108.555 169.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -142.84 -72.11 0.03 OUTLIER Glycine 0 CA--C 1.525 0.717 0 C-N-CA 126.882 2.182 . . . . 1.05 108.458 175.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -58.94 -51.27 7.17 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.208 2.605 . . . . 1.44 113.169 174.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.0 pp -87.18 -10.77 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.5 1.046 . . . . 1.58 113.087 -175.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.06 -31.04 70.41 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 120.975 -1.078 . . . . 1.71 113.054 -173.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . 0.411 ' HB2' ' HE3' ' B' ' 195' ' ' LYS . 0.0 OUTLIER -56.59 -36.75 69.72 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 117.815 -1.088 . . . . 3.39 113.048 172.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.7 tt -55.98 -40.15 72.86 Favored 'General case' 0 C--O 1.217 -0.605 0 C-N-CA 124.342 1.057 . . . . 2.41 110.671 -177.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 88.2 mt -48.4 -61.71 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.63 1.172 . . . . 1.25 110.869 171.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -65.54 -34.97 79.5 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 121.595 -0.691 . . . . 1.81 111.729 -176.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -68.49 -21.3 64.62 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 118.728 -0.653 . . . . 3.55 110.769 176.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -91.85 -38.77 12.13 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.063 1.745 . . . . 2.28 114.751 173.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -59.98 -6.69 1.41 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 121.229 1.831 . . . . 2.4 112.208 164.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -104.65 -93.32 0.35 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.453 1.501 . . . . 2.19 112.105 162.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.142 0 C-N-CA 128.424 2.689 . . . . 3.98 113.934 -172.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.5 m-30 . . . . . 0 N--CA 1.482 1.162 0 N-CA-C 111.747 0.277 . . . . 2.12 111.747 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.8 p -73.68 159.19 33.38 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.807 0.843 . . . . 1.25 110.351 169.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -64.95 -20.52 66.51 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.702 -0.624 . . . . 2.54 111.661 170.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.89 -45.76 77.02 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 118.749 -0.643 . . . . 0.94 109.926 173.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.16 -49.68 66.56 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 117.331 -1.318 . . . . 3.47 112.187 172.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -41.6 -48.46 4.03 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 121.045 1.748 . . . . 5.04 112.273 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.787 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -72.71 -47.31 48.15 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-O 117.306 -1.33 . . . . 0.64 112.727 -177.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.64 -40.42 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 CA-C-N 121.14 1.791 . . . . 0.63 110.619 173.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 88.4 mt -54.17 -58.46 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.207 1.003 . . . . 1.07 110.696 168.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.9 t -61.58 -35.15 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 125.542 1.537 . . . . 0.69 112.964 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -69.71 -39.17 77.03 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.85 0.86 . . . . 1.02 110.515 175.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 68.6 t -75.56 -34.41 29.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.024 0.929 . . . . 0.72 111.339 178.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -61.64 -45.5 93.76 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 124.916 1.286 . . . . 3.05 111.262 168.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -58.56 -23.54 58.71 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.612 0.967 . . . . 2.15 113.612 174.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -82.98 -60.87 2.02 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.822 -1.174 . . . . 2.15 112.489 170.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -69.07 -13.74 62.61 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.761 1.023 . . . . 2.0 113.761 -174.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.5 mttp -31.83 -48.24 0.15 Allowed 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 127.872 2.469 . . . . 2.28 112.851 162.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -98.38 6.22 47.48 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.543 1.137 . . . . 2.36 112.664 -171.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.2 t . . . . . 0 N--CA 1.477 0.918 0 C-N-CA 124.552 1.141 . . . . 2.89 110.189 -170.066 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 42.6 pt . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 110.109 -0.33 . . . . 2.46 110.109 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.5 m -66.14 140.66 58.23 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.561 -1.337 . . . . 2.44 111.549 178.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -61.95 -17.74 57.95 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.342 1.238 . . . . 2.8 114.342 -169.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.0 p -54.37 -33.34 58.96 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.802 -1.186 . . . . 2.12 112.231 168.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.1 m -60.05 -25.59 65.47 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.644 -1.285 . . . . 1.55 113.737 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 54.7 t80 -65.5 -62.51 1.48 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.308 1.413 . . . . 2.09 111.441 175.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -58.26 -21.92 50.41 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.202 1.001 . . . . 2.25 112.653 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.405 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 25.5 mt-10 -93.23 -44.74 8.18 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 124.662 1.185 . . . . 3.84 113.459 -174.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -32.1 68.04 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.593 1.088 . . . . 1.55 111.137 163.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.6 mt -66.24 -19.23 65.76 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 115.576 1.695 . . . . 1.04 115.576 169.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.41 -24.4 13.48 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.963 1.256 . . . . 3.13 113.475 171.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 1.6 mppt? -86.07 -48.2 8.85 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.78 1.232 . . . . 2.62 110.639 -178.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -86.77 -36.97 18.28 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.235 1.014 . . . . 2.93 112.238 -178.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.3 mt -103.75 50.04 0.81 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.035 0.934 . . . . 2.57 111.883 173.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -68.17 36.3 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 125.575 1.55 . . . . 2.1 113.61 175.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -136.42 -96.03 0.23 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.577 1.951 . . . . 1.94 110.745 -159.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.1 ptp -56.57 -20.23 19.77 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.638 1.563 . . . . 2.63 114.436 174.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.2 mp -80.65 64.23 5.36 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 123.801 1.762 . . . . 3.53 110.25 162.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.1 m -79.83 -10.74 59.82 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 113.036 -1.893 . . . . 3.92 114.425 -158.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -151.96 164.77 36.47 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.659 1.584 . . . . 4.6 109.639 160.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.5 m -34.47 -44.15 0.19 Allowed 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 129.443 3.097 . . . . 2.64 112.805 160.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.34 -32.09 79.62 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 117.653 -1.637 . . . . 2.24 114.39 -179.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -78.6 -47.67 16.67 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.214 1.507 . . . . 2.91 109.679 170.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -48.73 -29.62 4.68 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.421 1.889 . . . . 5.38 115.571 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.7 mtmt -48.36 -34.42 10.68 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.933 -1.104 . . . . 4.69 113.838 168.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.59 -16.49 63.41 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.54 1.311 . . . . 1.07 114.54 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.07 -49.01 8.64 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.719 0.808 . . . . 0.89 111.67 168.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.0 -31.5 72.43 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 112.916 0.709 . . . . 2.44 112.916 -179.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -57.31 -28.84 63.42 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.105 -0.997 . . . . 2.58 112.703 174.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 45.9 mt -78.32 -30.52 48.31 Favored 'General case' 0 C--O 1.224 -0.238 0 O-C-N 121.637 -0.664 . . . . 0.91 111.404 -178.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.5 mm -66.25 -49.02 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 123.94 0.896 . . . . 0.91 110.13 -178.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.57 -37.22 85.32 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.94 1.296 . . . . 2.99 113.061 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -65.88 -25.05 67.0 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.382 1.473 . . . . 2.56 113.979 171.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -87.94 -80.06 0.28 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 117.715 -1.136 . . . . 2.41 109.842 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -50.64 -34.7 27.24 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.437 1.471 . . . . 3.59 114.771 -158.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -54.37 -18.86 4.57 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 115.249 1.574 . . . . 3.75 115.249 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -132.48 5.48 4.04 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.541 1.936 . . . . 3.73 113.866 168.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -141.4 9.79 2.06 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 116.144 1.905 . . . . 4.68 116.144 -164.325 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -51.76 145.34 9.65 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.504 1.521 . . . . 7.18 112.869 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 71.47 -22.91 0.64 Allowed Glycine 0 CA--C 1.535 1.334 0 C-N-CA 126.333 1.92 . . . . 2.64 114.795 -173.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -94.39 135.11 36.17 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.294 1.437 . . . . 5.49 110.893 -178.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.2 mm -147.07 111.98 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.975 1.71 . . . . 2.46 107.446 177.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.4 m -85.3 -158.87 0.4 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.302 1.441 . . . . 2.37 111.334 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -109.03 -57.18 2.19 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 119.685 -1.884 . . . . 2.15 109.988 170.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -52.32 -25.77 10.47 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 131.407 3.883 . . . . 3.08 114.269 170.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -51.21 -59.21 4.44 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.422 1.489 . . . . 3.04 111.444 170.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -51.04 -44.71 61.11 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.6 -0.688 . . . . 2.38 111.623 176.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 28.4 t-105 -64.52 -46.8 81.36 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.485 -0.769 . . . . 0.58 111.996 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.9 t -74.47 -22.88 58.87 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 117.683 -1.151 . . . . 1.79 113.407 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.41 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 84.5 mt -65.68 -44.83 85.01 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.931 1.241 . . . . 0.62 110.331 169.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 27.4 mm -48.96 -43.87 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 CA-C-N 119.94 1.245 . . . . 0.71 112.667 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.77 -19.51 43.55 Favored Glycine 0 CA--C 1.537 1.449 0 CA-C-N 119.468 1.031 . . . . 0.68 114.07 177.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.11 -19.19 71.79 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 118.885 1.342 . . . . 0.64 114.188 172.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -118.41 -43.1 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 CA-C-N 119.117 1.459 . . . . 0.97 110.325 175.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 17.6 m -77.26 52.67 0.94 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.223 1.809 . . . . 1.44 109.749 166.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.68 -64.39 0.03 OUTLIER Glycine 0 CA--C 1.528 0.862 0 C-N-CA 126.955 2.216 . . . . 1.13 109.912 179.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -63.28 -59.15 0.24 Allowed 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.204 2.603 . . . . 1.23 112.624 173.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.1 pt -78.04 -17.55 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 114.028 1.121 . . . . 1.18 114.028 -173.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.55 -37.46 75.74 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.308 -0.87 . . . . 1.01 112.505 -173.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt -60.91 -29.42 69.58 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 120.639 -1.288 . . . . 5.1 113.238 176.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.8 tt -77.85 -23.05 49.04 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.444 1.498 . . . . 1.6 112.963 178.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.3 mt -51.75 -48.64 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 118.955 0.798 . . . . 0.96 110.466 168.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.41 -33.86 73.1 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 114.194 1.183 . . . . 3.97 114.194 -179.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.83 -55.65 24.37 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.328 1.051 . . . . 5.68 111.71 172.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -56.56 -46.05 80.95 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.865 0.866 . . . . 2.64 113.299 -175.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -80.29 2.41 24.73 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.677 0.791 . . . . 2.91 111.797 -175.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.473 0.715 0 C-N-CA 123.734 0.813 . . . . 1.95 111.041 162.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 112.695 0.628 . . . . 2.21 112.695 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 66.1 p -71.66 150.57 44.45 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.312 0.645 . . . . 1.21 110.006 164.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -53.47 -36.9 62.15 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.312 1.045 . . . . 2.34 111.097 175.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.61 -42.88 93.64 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.719 1.608 . . . . 0.85 111.726 178.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -51.47 24.93 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 121.401 -0.812 . . . . 3.35 110.323 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -55.14 -30.36 59.64 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.423 1.089 . . . . 5.11 112.125 172.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.787 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -72.65 -44.26 62.1 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.563 -1.335 . . . . 0.55 113.221 170.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 54.0 t -59.18 -39.33 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 120.877 1.671 . . . . 0.62 109.834 172.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 63.1 mt -54.77 -57.79 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.853 -1.07 . . . . 0.85 110.824 167.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 5.6 t -56.55 -39.35 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 CA-C-N 120.502 1.501 . . . . 0.65 113.035 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.67 -40.42 84.46 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.359 -0.838 . . . . 1.03 111.953 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 68.7 t -72.74 -34.51 47.35 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.635 0 C-N-CA 123.51 0.724 . . . . 0.65 110.987 177.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -65.22 -41.82 94.04 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.523 1.129 . . . . 3.06 112.281 172.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . 0.421 HD21 ' CG ' ' B' ' 144' ' ' MET . 40.0 t30 -58.67 -24.03 60.48 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.961 -1.087 . . . . 2.16 113.603 173.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -84.67 -61.12 1.87 Allowed 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.13 -0.981 . . . . 2.15 112.674 172.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -68.1 -14.67 63.15 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.44 0.904 . . . . 2.07 113.44 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mttp -32.61 -48.14 0.18 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 127.156 2.182 . . . . 2.23 113.349 164.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -97.64 6.78 47.53 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.371 1.468 . . . . 2.19 113.235 -172.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 45.9 t . . . . . 0 N--CA 1.474 0.755 0 C-N-CA 124.238 1.015 . . . . 2.8 109.982 -171.549 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 31.6 pt . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 109.375 -0.602 . . . . 2.45 109.375 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 15.2 m -64.47 140.76 58.9 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.171 -0.956 . . . . 2.4 112.212 178.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -60.71 -16.73 42.73 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.606 1.335 . . . . 2.61 114.606 -169.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 14.3 p -56.76 -33.95 67.11 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.583 -1.323 . . . . 2.03 112.48 168.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 63.9 m -57.93 -28.47 64.31 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.862 -1.149 . . . . 1.46 113.293 174.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.449 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 73.8 t80 -62.14 -63.15 1.34 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.295 1.407 . . . . 1.98 111.735 175.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -60.1 -20.8 60.02 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.585 0.754 . . . . 2.03 112.02 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . 0.424 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 26.7 mt-10 -90.24 -50.26 6.08 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 117.8 -1.095 . . . . 3.62 112.482 -175.193 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . 0.421 ' CG ' HD21 ' B' ' 121' ' ' ASN . 0.0 OUTLIER -55.06 -32.07 61.63 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.092 0.86 . . . . 1.37 111.54 164.248 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 10.0 mt -61.05 -52.26 65.69 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.247 -0.908 . . . . 1.09 112.039 168.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.03 -18.95 60.78 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.643 1.11 . . . . 3.12 113.242 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 2.0 mppt? -92.02 -48.66 6.63 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.972 1.309 . . . . 2.46 111.232 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -93.57 -28.39 16.07 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.518 1.508 . . . . 2.99 114.901 -175.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 60.0 mt -104.79 25.07 10.85 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.66 1.184 . . . . 1.94 112.201 172.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -54.51 -10.4 0.41 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.84 2.056 . . . . 1.46 116.319 -173.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.64 -64.39 1.15 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.99 -1.069 . . . . 2.06 110.509 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.7 ptp -59.26 -33.17 70.72 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.063 0.847 . . . . 3.0 113.005 170.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 2.3 mp -86.79 67.78 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 123.445 1.593 . . . . 3.89 110.212 170.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 3.3 m -74.06 -11.16 60.24 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 112.873 -1.967 . . . . 4.14 114.978 -157.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -175.72 164.99 3.05 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.298 2.239 . . . . 5.43 110.301 178.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 9.3 m -29.15 -48.99 0.07 Allowed 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 130.167 3.387 . . . . 3.28 113.861 160.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -63.75 -32.96 85.92 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-N 119.857 1.208 . . . . 2.52 113.863 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -77.44 -49.16 15.39 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.757 1.223 . . . . 2.77 109.202 170.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 17.4 ttp180 -50.08 -29.36 8.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.078 1.751 . . . . 4.96 114.78 179.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 32.9 mtmt -49.83 -30.68 10.25 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.34 1.427 . . . . 4.53 114.308 170.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.68 -20.86 52.97 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.363 1.246 . . . . 0.94 114.363 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -77.49 -52.5 8.97 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.151 0.887 . . . . 0.72 110.675 162.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -61.98 -34.26 75.81 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.387 0.675 . . . . 2.01 112.759 -175.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.35 -30.27 64.69 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.396 -0.815 . . . . 2.71 112.958 174.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 38.4 mt -74.8 -34.25 62.36 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.649 -0.657 . . . . 0.79 111.244 -178.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 28.7 mm -61.84 -48.73 87.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.247 1.019 . . . . 0.87 110.479 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -64.91 -40.93 95.83 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.773 1.229 . . . . 2.94 112.32 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -61.0 -26.11 67.37 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.053 1.341 . . . . 2.56 113.838 171.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -83.58 -80.13 0.19 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 117.368 -1.301 . . . . 2.51 109.465 169.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -50.08 -33.08 17.33 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 120.513 1.506 . . . . 3.46 114.602 -160.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -53.51 -21.01 5.57 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 115.274 1.583 . . . . 3.52 115.274 173.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -128.83 9.71 5.89 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.033 1.733 . . . . 3.45 113.494 168.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.8 6.3 0.91 Allowed 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 116.397 1.999 . . . . 4.2 116.397 -159.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -50.96 144.42 8.72 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 122.226 1.012 . . . . 7.08 112.7 172.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 71.56 -20.44 0.8 Allowed Glycine 0 CA--C 1.535 1.313 0 C-N-CA 126.211 1.862 . . . . 2.73 114.925 -173.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -99.79 135.11 41.7 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.418 1.487 . . . . 5.31 110.422 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.3 mm -145.22 113.71 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 107.023 -1.473 . . . . 2.84 107.023 177.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 2.4 t -87.19 -173.14 4.27 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.678 1.126 . . . . 1.51 113.14 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -92.89 -56.62 2.93 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.031 -1.668 . . . . 2.12 110.769 172.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -61.33 -23.55 65.81 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 129.048 2.939 . . . . 3.02 113.138 176.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -47.62 -58.92 3.68 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.492 1.517 . . . . 3.15 110.856 167.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -51.99 -45.52 64.53 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 120.931 -1.106 . . . . 2.29 112.372 177.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.3 t-105 -65.82 -47.37 75.25 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.65 -0.69 . . . . 0.59 111.875 -178.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 8.2 t -72.7 -24.1 60.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 117.684 -1.15 . . . . 1.72 112.975 177.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.449 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 82.5 mt -65.82 -45.24 83.02 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.882 1.219 . . . . 0.69 110.815 170.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 34.9 mm -48.03 -43.42 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 CA-C-N 120.734 1.606 . . . . 0.75 112.51 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -58.59 -19.57 42.55 Favored Glycine 0 CA--C 1.538 1.476 0 CA-C-N 118.57 0.623 . . . . 0.73 114.497 177.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.74 -19.36 79.24 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 118.619 1.209 . . . . 0.77 114.147 174.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -117.1 -47.79 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 118.829 1.314 . . . . 1.17 110.108 177.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 20.7 m -74.23 50.68 0.4 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.679 1.991 . . . . 1.5 109.573 166.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -138.97 -64.48 0.04 OUTLIER Glycine 0 CA--C 1.527 0.815 0 C-N-CA 127.022 2.249 . . . . 1.03 109.481 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -62.0 -54.44 1.5 Allowed 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.198 2.599 . . . . 1.23 112.8 172.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 4.2 pt -84.78 -19.38 8.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 N-CA-C 114.672 1.36 . . . . 1.24 114.672 -175.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -53.33 -43.0 67.31 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.963 0.905 . . . . 1.19 112.498 -174.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -54.45 -27.93 40.77 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.167 1.173 . . . . 4.75 114.167 175.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.22 -19.07 61.78 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.443 1.897 . . . . 1.56 111.735 178.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 98.2 mt -57.68 -43.71 84.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 O-C-N 120.062 -1.649 . . . . 1.51 110.561 166.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -74.89 -0.39 18.38 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 115.145 1.535 . . . . 3.98 115.145 177.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -88.63 -66.09 0.95 Allowed 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.568 1.147 . . . . 4.94 111.2 153.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -54.65 -44.94 73.69 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 114.301 1.223 . . . . 2.38 114.301 -167.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -80.86 10.71 4.66 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 123.026 1.393 . . . . 2.73 111.006 -175.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -114.65 -54.07 2.6 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.432 1.493 . . . . 2.51 109.885 166.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 . . . . . 0 CA--C 1.538 0.505 0 C-N-CA 127.153 2.181 . . . . 5.08 113.887 178.427 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 114.517 1.303 . . . . 2.67 114.517 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.5 p -66.4 147.84 52.72 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.187 0.595 . . . . 1.56 109.915 164.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -67.12 -17.8 65.03 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 119.276 -0.392 . . . . 2.28 111.712 170.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.6 -48.94 62.86 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.617 1.098 . . . . 0.9 110.062 173.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -51.39 66.99 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.421 -0.585 . . . . 3.37 109.421 175.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -53.89 -37.1 63.39 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.764 0.653 . . . . 4.19 112.764 176.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.778 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -62.58 -37.95 88.21 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 117.609 -1.186 . . . . 0.84 112.896 172.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 16.8 t -58.52 -44.93 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-N 120.914 1.688 . . . . 0.97 110.516 168.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.8 mt -54.69 -46.93 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 CA-C-N 118.765 0.711 . . . . 0.93 110.663 172.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.477 HG21 ' HG2' ' B' ' 110' ' ' GLU . 42.0 t -69.09 -40.49 80.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 124.057 0.943 . . . . 0.66 112.994 -176.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -62.74 -39.85 95.41 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.122 -0.986 . . . . 0.98 111.051 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 84.1 t -74.76 -38.14 43.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.72 0.808 . . . . 0.64 112.582 177.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -51.12 -52.16 46.43 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.015 0.926 . . . . 3.17 109.848 168.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -60.38 -30.66 69.72 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.486 1.291 . . . . 2.06 114.486 -175.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -80.81 -54.16 5.85 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.225 -0.922 . . . . 1.92 111.812 175.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -69.63 -23.44 63.5 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.734 1.013 . . . . 2.19 113.734 -174.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 42.2 pttt -60.74 -9.25 3.73 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 115.712 1.745 . . . . 2.31 115.712 175.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -107.03 2.28 24.94 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.877 1.271 . . . . 2.4 114.264 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.485 1.289 0 CA-C-N 120.111 1.323 . . . . 2.56 110.987 179.561 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.2 pt . . . . . 0 N--CA 1.477 0.875 0 N-CA-C 110.28 -0.267 . . . . 2.79 110.28 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.0 m -92.97 152.15 19.5 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.624 -0.672 . . . . 2.97 110.457 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.1 mtpt -52.48 -33.18 43.57 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.324 1.45 . . . . 2.56 114.768 -176.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.3 t -69.59 -23.35 63.52 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.545 1.313 . . . . 2.24 114.545 172.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.1 m -77.19 -44.48 29.99 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.85 1.205 . . . . 1.32 111.385 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -51.49 -54.2 29.63 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.416 1.007 . . . . 1.93 111.85 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -57.88 -27.03 62.9 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.91 1.078 . . . . 2.87 113.91 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -94.98 -48.8 5.83 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.63 1.572 . . . . 2.87 110.74 -171.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -49.5 -40.12 36.47 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.713 2.405 . . . . 1.37 112.24 165.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 42' ' ' LEU . 7.1 mt -60.25 -20.27 58.22 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.948 1.462 . . . . 1.11 114.948 176.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -92.82 -14.33 27.93 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.592 1.157 . . . . 2.2 112.428 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.36 -53.54 3.89 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.553 1.141 . . . . 1.51 112.599 172.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -78.34 -16.7 57.43 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.55 -0.719 . . . . 2.45 112.287 -174.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.51 24.88 9.66 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.427 1.891 . . . . 1.7 111.576 179.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -61.94 -39.09 90.87 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.405 2.002 . . . . 1.62 116.405 -162.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.516 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 0.5 OUTLIER -69.58 -19.8 63.66 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.975 1.262 . . . . 1.75 113.228 -174.036 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 52.0 tpp -77.64 -26.55 50.57 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.233 1.813 . . . . 2.09 113.016 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.0 mp -56.75 111.57 1.05 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.069 0.948 . . . . 2.91 110.399 174.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.2 m -100.73 -3.89 29.24 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.364 1.066 . . . . 3.63 111.769 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -178.75 175.46 1.06 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 131.366 3.866 . . . . 3.81 106.768 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -53.99 -26.08 24.21 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 117.021 -1.466 . . . . 3.6 111.78 160.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -51.53 -39.96 46.23 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 127.344 2.402 . . . . 1.96 115.0 -174.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -57.07 -47.63 80.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 117.951 0.875 . . . . 3.72 110.78 170.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -70.98 -32.24 69.03 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.392 0.677 . . . . 5.37 112.207 175.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -58.84 -38.01 77.73 Favored 'General case' 0 N--CA 1.481 1.078 0 O-C-N 119.516 -1.99 . . . . 3.43 111.334 173.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.77 -14.22 62.36 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.059 1.503 . . . . 1.23 115.059 172.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.64 -53.83 5.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.389 0.995 . . . . 0.94 110.82 164.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.47 -34.98 69.58 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.965 0.906 . . . . 2.06 112.866 -177.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -61.34 -24.31 66.36 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.682 0.993 . . . . 2.71 113.682 174.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.5 mt -78.63 -37.5 42.03 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.257 -0.902 . . . . 0.85 111.135 174.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.4 mm -58.19 -44.6 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.196 0.998 . . . . 0.87 111.558 -176.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -67.22 -38.8 85.87 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.234 1.813 . . . . 2.27 113.173 176.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -62.56 -27.65 69.33 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.916 -0.49 . . . . 3.42 111.972 172.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.4 mp -86.82 -19.89 28.33 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 113.565 0.95 . . . . 3.43 113.565 174.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.49 -25.21 67.89 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 120.419 1.463 . . . . 3.62 111.507 168.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.2 -10.79 59.79 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.474 1.287 . . . . 2.64 114.474 170.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -136.79 -14.08 1.65 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.805 1.78 . . . . 2.71 115.805 -171.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -155.45 119.02 4.45 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 121.195 1.816 . . . . 3.34 114.036 -159.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.9 40.28 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 130.375 3.47 . . . . 4.44 116.563 -170.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.18 13.4 76.51 Favored Glycine 0 CA--C 1.537 1.415 0 O-C-N 119.502 -1.999 . . . . 4.91 114.283 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -86.38 -171.51 3.59 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.212 1.405 . . . . 7.13 108.303 155.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 41.9 pt -147.94 161.6 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.966 1.706 . . . . 4.69 107.911 150.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.8 m -74.08 169.1 18.2 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 112.745 0.646 . . . . 2.32 112.745 164.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -63.1 -52.91 60.79 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.07 -1.019 . . . . 1.97 111.069 169.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.6 -33.76 60.92 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 128.142 2.577 . . . . 3.08 113.224 172.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.83 -38.99 76.7 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 118.44 -0.791 . . . . 4.15 112.622 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -53.09 -47.31 68.67 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.655 1.571 . . . . 1.8 110.393 172.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 28.5 t-105 -64.55 -45.86 85.29 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 118.455 -0.783 . . . . 0.6 111.987 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.13 -40.64 98.19 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.549 1.068 . . . . 1.61 112.039 -177.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 91.1 mt -63.88 -34.11 77.2 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.839 -0.6 . . . . 0.62 112.1 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.45 -36.21 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 119.896 1.225 . . . . 0.64 111.6 179.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.48 -18.02 67.25 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.929 1.252 . . . . 0.66 114.41 178.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.47 -29.58 59.66 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-N 119.007 1.404 . . . . 0.85 112.737 176.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.441 HD12 ' H ' ' A' ' 86' ' ' ILE . 2.8 mp -86.95 -45.14 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.264 1.026 . . . . 0.92 109.537 168.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.4 m -82.55 57.28 3.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 127.546 2.338 . . . . 1.26 109.989 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -132.74 -67.56 0.08 OUTLIER Glycine 0 CA--C 1.527 0.793 0 C-N-CA 125.825 1.678 . . . . 0.74 110.093 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -66.02 -51.77 1.11 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.269 2.646 . . . . 1.03 112.576 175.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.6 pt -71.84 -17.83 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 N-CA-C 113.95 1.093 . . . . 1.09 113.95 -175.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -50.36 -55.73 14.38 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.763 0.825 . . . . 0.96 111.994 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -61.84 -32.69 73.04 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 120.569 -1.332 . . . . 3.16 113.168 176.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.0 tt -60.39 -40.79 92.17 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 121.146 1.794 . . . . 1.56 111.024 178.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 74.7 mt -53.84 -54.46 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-O 122.156 0.979 . . . . 1.22 110.429 172.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -67.76 -28.38 67.57 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.228 -0.92 . . . . 1.72 113.279 -177.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -73.88 -29.2 61.96 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.597 1.159 . . . . 3.62 111.356 173.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -74.16 -42.5 59.81 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.288 1.035 . . . . 2.13 111.538 174.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -73.47 17.28 0.15 Allowed 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 123.736 1.731 . . . . 2.96 112.211 172.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 . . . . . 0 CA--C 1.536 0.423 0 C-N-CA 125.522 1.529 . . . . 2.39 110.398 161.266 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 118.983 -0.532 . . . . 2.87 112.36 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 8.3 p -62.68 152.3 35.84 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.223 -0.658 . . . . 1.22 109.223 173.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . 0.477 ' HG2' HG21 ' A' ' 14' ' ' VAL . 10.4 tp10 -63.85 -27.54 69.24 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 118.415 -0.802 . . . . 2.52 111.489 170.189 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.56 -46.46 85.8 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.759 1.618 . . . . 0.89 109.83 176.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -50.15 32.2 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.597 -0.69 . . . . 2.93 111.142 -177.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -48.74 -38.66 22.27 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.804 1.241 . . . . 4.9 113.255 167.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.778 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -64.98 -42.9 94.14 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 120.783 -1.198 . . . . 0.76 113.233 171.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 14.0 t -55.74 -42.58 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 CA-C-N 120.917 1.689 . . . . 1.11 110.666 170.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 59.9 mt -56.4 -51.22 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 118.638 -0.696 . . . . 1.08 110.189 172.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 36.1 t -65.79 -36.6 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.346 0.975 . . . . 0.55 113.342 -176.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -64.26 -37.97 89.37 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.997 -1.064 . . . . 0.95 111.44 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 89.3 t -83.21 -35.32 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 118.619 -0.705 . . . . 0.91 112.396 -178.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -51.16 -54.98 20.33 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.511 1.125 . . . . 3.33 109.634 165.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -57.78 -37.56 73.92 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 113.207 0.817 . . . . 2.01 113.207 -176.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -76.59 -55.87 5.13 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 122.02 -0.425 . . . . 2.25 110.785 -177.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -68.15 -24.05 64.94 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.675 0.991 . . . . 2.23 113.675 -175.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -56.81 -16.21 6.17 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 120.979 1.718 . . . . 2.12 115.137 176.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -90.69 -0.7 57.78 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.824 1.787 . . . . 2.13 115.824 173.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.6 m . . . . . 0 N--CA 1.479 1.003 0 C-N-CA 125.075 1.35 . . . . 2.62 109.787 176.988 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 28.5 pt . . . . . 0 N--CA 1.479 0.991 0 CA-C-O 120.572 0.225 . . . . 2.31 111.092 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 20.6 m -91.26 155.14 18.77 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 120.396 -1.44 . . . . 2.62 110.737 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -55.48 -30.75 61.16 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.016 0.926 . . . . 2.64 113.118 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 39.3 t -69.18 -20.4 64.0 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 115.31 1.596 . . . . 2.39 115.31 170.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 16.4 m -74.49 -41.46 60.67 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 120.638 1.563 . . . . 1.42 111.444 176.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.463 ' CZ ' HD11 ' B' ' 145' ' ' LEU . 35.9 t80 -56.35 -53.46 57.08 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 118.906 0.776 . . . . 2.04 111.29 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.4 ptt180 -57.12 -23.62 48.41 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.109 0.964 . . . . 2.58 113.092 178.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 tm-20 -99.48 -45.11 5.93 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.024 1.33 . . . . 2.93 112.131 -173.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 11.9 tmm? -51.62 -36.44 45.83 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.062 1.745 . . . . 1.2 112.175 167.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . 0.463 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 12.4 mt -65.94 -12.4 54.5 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 115.917 1.821 . . . . 1.06 115.917 172.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -86.26 -25.14 25.7 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 123.826 0.85 . . . . 2.28 112.592 169.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.02 -61.39 1.41 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.761 1.624 . . . . 1.62 112.45 -175.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -70.51 -16.12 62.86 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.604 0.761 . . . . 2.64 111.658 -175.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.83 17.12 11.85 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.683 1.993 . . . . 1.73 113.472 177.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -49.49 -37.73 27.49 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.468 1.655 . . . . 1.78 115.468 -171.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . 0.439 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 12.3 m-70 -63.45 -28.46 69.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.882 1.273 . . . . 1.94 113.917 -175.548 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 60.1 tpp -81.79 -22.88 36.89 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.177 1.391 . . . . 2.05 113.421 -172.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 11.2 mp -58.13 116.32 3.47 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.251 1.42 . . . . 3.01 111.024 176.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 45.9 m -97.46 -4.85 37.32 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.836 0.854 . . . . 3.8 112.616 172.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 12.4 t70 175.71 179.23 0.16 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 129.939 3.295 . . . . 3.95 106.694 -168.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 12.4 t -55.49 -26.23 41.5 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 116.931 -1.509 . . . . 3.56 112.077 160.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -51.32 -46.1 52.23 Favored Glycine 0 N--CA 1.471 1.023 0 C-N-CA 126.468 1.985 . . . . 2.0 115.46 -171.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -53.81 -45.05 70.68 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.244 1.022 . . . . 3.69 111.173 171.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.7 ttt-85 -74.13 -33.78 63.67 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.516 0.726 . . . . 5.08 111.99 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 60.0 mmtt -56.62 -38.18 71.72 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 120.82 1.645 . . . . 3.34 111.448 172.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -65.49 -14.46 61.06 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 115.089 1.515 . . . . 1.29 115.089 173.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -85.67 -50.62 7.05 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.565 1.075 . . . . 1.0 111.886 165.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.61 -37.63 76.29 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.957 0.903 . . . . 2.14 112.458 -178.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -60.42 -25.29 65.85 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.506 0.928 . . . . 2.7 113.506 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 15.6 mt -76.21 -37.7 57.41 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.13 -0.981 . . . . 0.8 111.123 176.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 28.1 mm -57.13 -43.73 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.076 0.95 . . . . 0.86 111.337 -175.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -69.32 -41.11 77.15 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.505 1.922 . . . . 2.42 113.054 175.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -59.53 -27.18 65.97 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.862 -0.524 . . . . 3.53 112.138 170.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 6.2 mp -86.57 -19.62 29.15 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 114.227 1.195 . . . . 3.29 114.227 174.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -22.71 67.04 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 120.296 1.407 . . . . 3.77 112.026 167.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -74.59 -9.56 58.69 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.309 1.225 . . . . 3.01 114.309 168.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -138.0 -14.95 1.35 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 116.455 2.02 . . . . 2.77 116.455 -170.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -154.7 122.06 5.68 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 121.079 1.763 . . . . 3.14 114.187 -159.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -71.75 41.81 0.08 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 128.936 2.894 . . . . 4.43 116.034 -171.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 76.32 0.36 66.26 Favored Glycine 0 CA--C 1.534 1.269 0 O-C-N 119.996 -1.69 . . . . 5.1 114.195 177.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -78.94 -175.47 4.53 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.309 1.444 . . . . 7.12 108.826 160.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 16.6 pt -147.51 155.74 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 128.098 2.559 . . . . 4.42 106.871 158.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 4.2 m -77.65 -177.53 4.86 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.464 0.706 . . . . 2.31 112.687 165.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -69.51 -54.27 15.0 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 122.281 1.038 . . . . 2.12 110.462 169.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.68 -37.35 18.3 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 128.99 2.916 . . . . 3.14 113.7 172.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -66.96 -42.97 84.27 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.14 0.976 . . . . 4.7 112.886 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -53.8 -47.4 70.86 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.362 -1.462 . . . . 1.88 111.176 173.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 28.7 t-105 -63.41 -45.07 92.69 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 118.621 -0.704 . . . . 0.71 111.484 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.91 -41.71 97.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.734 0.814 . . . . 1.52 111.569 -179.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.424 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 87.0 mt -64.82 -33.44 76.01 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.399 -0.81 . . . . 0.63 112.446 179.338 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 36.8 mm -56.98 -34.66 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 CA-C-N 120.698 1.59 . . . . 0.6 111.823 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.66 -20.19 69.89 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 124.292 0.949 . . . . 0.66 114.079 176.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.78 -27.6 68.74 Favored Glycine 0 CA--C 1.529 0.916 0 CA-C-N 118.282 1.041 . . . . 0.73 113.218 177.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -89.82 -42.75 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.446 1.099 . . . . 0.96 110.127 167.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 6.2 m -83.14 57.34 3.89 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.935 2.094 . . . . 1.31 110.5 -177.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -126.17 -71.64 0.19 Allowed Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.831 1.682 . . . . 0.72 110.57 177.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.5 -44.19 1.15 Allowed 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 123.017 2.478 . . . . 1.06 112.71 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 12.9 pt -72.0 -22.35 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 119.091 0.859 . . . . 1.1 113.128 -173.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -45.41 -62.65 1.19 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.374 1.47 . . . . 1.09 112.988 177.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -64.37 -26.82 68.64 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 120.539 -1.351 . . . . 3.63 113.36 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.47 -41.78 97.76 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.796 1.634 . . . . 1.66 110.621 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 53.4 mt -53.69 -56.06 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-O 121.867 0.842 . . . . 1.4 110.682 170.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 43.4 t60 -63.19 -28.95 70.4 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.09 1.144 . . . . 1.82 114.09 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -74.43 -28.24 60.97 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.796 1.238 . . . . 3.71 111.657 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -74.72 -40.56 61.24 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.501 1.12 . . . . 2.25 111.164 171.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -73.2 19.59 0.09 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 126.662 1.985 . . . . 2.88 112.293 170.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -127.97 -61.68 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 125.238 1.415 . . . . 2.61 109.652 159.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.307 12.2 pt20 . . . . . 0 N--CA 1.475 0.793 0 C-N-CA 130.127 3.371 . . . . 4.95 115.366 -171.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.546 0.792 0 CA-C-O 118.918 -0.563 . . . . 2.85 110.476 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 60.1 p -65.7 148.87 51.05 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 120.142 1.337 . . . . 1.17 110.138 168.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -63.71 -36.65 84.56 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.743 -0.598 . . . . 2.09 111.644 -175.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.72 -48.39 80.95 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.273 1.429 . . . . 1.32 110.031 174.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -72.82 -43.52 62.58 Favored 'General case' 0 C--O 1.23 0.072 0 CA-C-N 118.142 0.428 . . . . 3.67 111.442 -173.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -48.51 -42.86 34.34 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.921 1.288 . . . . 5.41 111.432 163.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.416 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -71.96 -30.22 65.07 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 116.762 -1.59 . . . . 0.76 114.511 175.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.7 t -55.59 -33.81 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 CA-C-N 122.447 2.385 . . . . 0.95 111.095 167.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 16.8 mt -56.89 -63.34 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 CA-C-N 119.588 1.085 . . . . 1.38 111.401 162.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.7 t -50.1 -43.31 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.095 1.358 . . . . 0.58 113.279 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.4 mp -66.44 -39.93 89.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.541 1.136 . . . . 1.05 112.245 176.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.3 t -68.61 -45.98 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.906 0.883 . . . . 0.66 110.258 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.3 tt0 -55.88 -44.86 78.54 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.364 0.529 . . . . 3.12 111.027 171.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -69.1 -17.42 63.85 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 115.23 1.567 . . . . 2.4 115.23 -170.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -80.74 -61.48 1.96 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.208 0.603 . . . . 1.96 111.368 161.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -68.12 -22.9 64.86 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.376 0.88 . . . . 1.92 113.376 -164.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -49.1 -24.2 1.53 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 125.018 1.327 . . . . 2.75 113.084 170.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -94.43 -2.76 51.36 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.512 1.525 . . . . 2.16 114.998 178.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.479 0.997 0 C-N-CA 125.593 1.557 . . . . 2.25 112.8 -178.368 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.9 pt . . . . . 0 CA--C 1.536 0.426 0 N-CA-C 107.42 -1.326 . . . . 3.13 107.42 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.2 m -99.8 168.9 9.6 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 121.69 -0.631 . . . . 2.82 111.302 172.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.02 -35.48 15.54 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.835 2.054 . . . . 2.47 112.525 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.6 p -55.44 -19.62 9.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.889 2.076 . . . . 1.97 114.843 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m -79.17 -46.44 17.93 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.398 0.999 . . . . 1.54 111.253 175.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -51.47 -51.87 51.36 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.556 1.142 . . . . 1.79 111.768 -177.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -52.67 -26.78 14.77 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.177 1.177 . . . . 3.74 114.177 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -108.04 -40.08 5.32 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.457 1.103 . . . . 3.76 112.792 -172.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -46.32 -46.17 17.97 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.122 0.969 . . . . 1.32 110.577 162.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.3 mt -45.85 -67.1 0.31 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.453 1.501 . . . . 1.6 111.703 165.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -67.27 -12.04 59.06 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 115.544 1.683 . . . . 2.14 115.544 -172.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.81 -43.44 10.64 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.505 0.928 . . . . 1.75 113.505 169.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -104.14 -31.06 9.83 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.761 1.225 . . . . 2.7 113.375 -166.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.3 mt -109.34 62.64 0.6 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 127.819 2.448 . . . . 2.6 109.838 164.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -94.65 -12.26 27.7 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 115.147 1.536 . . . . 1.31 115.147 -177.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 -91.14 -36.76 13.79 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 120.425 -1.422 . . . . 1.65 113.014 -173.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.2 mmm -81.31 5.14 18.2 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.302 1.441 . . . . 2.34 111.25 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.4 tp -66.88 83.49 0.11 Allowed 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 127.566 2.346 . . . . 3.2 110.952 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.6 t -69.38 59.94 0.13 Allowed 'General case' 0 CA--C 1.549 0.94 0 O-C-N 121.281 -0.887 . . . . 5.06 111.529 165.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.0 t70 51.09 -132.25 1.94 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 129.639 3.176 . . . . 3.97 112.879 171.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.1 m -71.42 -36.85 71.44 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 126.665 1.986 . . . . 4.0 109.951 -172.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.18 -51.35 59.37 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-N 119.518 1.054 . . . . 2.47 111.63 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -60.15 -52.31 65.86 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.28 1.032 . . . . 3.73 112.53 174.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.5 ttt-85 -76.65 -31.66 57.48 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.628 -0.67 . . . . 4.69 112.608 -170.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -68.2 -32.6 72.94 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 120.112 -1.617 . . . . 3.61 112.33 167.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.68 -19.83 59.46 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.392 1.256 . . . . 1.01 114.392 169.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.85 -56.51 4.53 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 119.994 1.27 . . . . 0.64 111.869 162.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.96 -31.44 72.55 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.172 1.175 . . . . 2.09 114.172 -173.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -57.36 -28.4 63.14 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.35 -0.843 . . . . 2.68 113.173 173.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.8 mt -75.37 -43.72 48.89 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.039 0.935 . . . . 1.06 110.802 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.0 mm -56.9 -53.65 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.066 1.746 . . . . 1.09 110.728 -175.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -58.92 -29.68 67.26 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.997 1.319 . . . . 1.97 113.624 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.5 -24.72 42.1 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.484 1.914 . . . . 2.46 113.524 176.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 mt -124.05 -20.56 5.3 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.672 2.101 . . . . 2.99 116.672 -168.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -61.89 -25.33 67.49 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.627 1.103 . . . . 3.3 110.734 154.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -79.47 -21.29 45.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.53 1.532 . . . . 2.87 114.836 171.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -128.58 17.04 6.43 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 119.939 1.245 . . . . 3.77 114.031 -174.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -153.78 126.99 8.46 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 120.556 -1.34 . . . . 3.85 111.736 173.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.07 59.26 3.22 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.284 2.234 . . . . 5.3 114.226 -148.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.65 4.59 26.32 Favored Glycine 0 CA--C 1.534 1.277 0 O-C-N 120.727 -1.233 . . . . 3.02 112.566 -165.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 75.2 mmt-85 -75.29 151.55 38.32 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 127.006 2.122 . . . . 4.95 111.413 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.6 mm -140.06 113.52 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 105.134 -2.173 . . . . 2.91 105.134 166.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.2 m -79.72 173.68 12.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 118.967 0.803 . . . . 1.97 112.153 168.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -55.03 -50.12 69.86 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.828 0.823 . . . . 2.03 111.403 156.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.76 -26.58 67.79 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.492 1.917 . . . . 3.32 113.994 -174.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -58.94 -55.24 37.68 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.938 1.295 . . . . 3.49 110.952 173.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -54.85 -48.36 73.0 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 120.726 -1.234 . . . . 2.33 111.668 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 24.6 t-105 -63.02 -44.03 97.08 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.163 0.801 . . . . 0.58 113.163 -177.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.9 t -67.58 -42.68 82.13 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.288 0.949 . . . . 1.82 110.997 178.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.1 -39.12 93.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 117.975 -1.012 . . . . 0.71 112.337 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 28.7 mm -52.47 -40.58 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 CA-C-N 120.62 1.555 . . . . 0.7 111.5 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -68.19 -22.07 74.22 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.843 0.735 . . . . 0.71 113.922 -178.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.38 -30.15 76.1 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-N 118.343 1.072 . . . . 0.68 112.368 174.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -89.03 -47.73 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.069 0.947 . . . . 0.87 109.514 167.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.2 m -83.62 59.35 5.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.327 2.251 . . . . 1.51 110.948 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -151.06 -57.35 0.01 OUTLIER Glycine 0 CA--C 1.529 0.95 0 C-N-CA 126.642 2.068 . . . . 0.94 110.974 -178.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.02 -60.46 0.44 Allowed 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.445 2.097 . . . . 1.13 111.569 167.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.2 pt -64.24 -18.32 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 115.425 1.639 . . . . 1.24 115.425 -175.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.32 -45.52 69.06 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.282 1.433 . . . . 1.1 113.026 -175.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -60.75 -36.76 79.72 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.618 0.767 . . . . 5.23 112.786 178.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.3 tt -75.15 -44.59 46.03 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.702 1.601 . . . . 1.09 109.875 -176.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 42.2 mt -52.51 -60.58 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.495 0.718 . . . . 1.11 109.491 168.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -55.52 -40.54 71.94 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 118.42 -0.8 . . . . 2.14 112.99 -176.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -69.66 -36.7 76.27 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 119.672 -0.811 . . . . 3.31 111.638 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -70.82 -34.29 71.57 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 117.708 -1.139 . . . . 3.88 113.879 -174.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -63.33 -12.24 28.32 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.443 1.02 . . . . 2.81 112.396 172.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.052 0 C-N-CA 125.613 1.565 . . . . 2.64 112.907 179.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 109.966 -0.383 . . . . 2.98 109.966 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 10.4 p -59.78 147.94 36.21 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 120.707 0.289 . . . . 0.9 110.642 -165.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.4 tp10 -63.96 -32.52 74.09 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 121.925 -0.484 . . . . 2.3 111.942 -174.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.9 -47.68 76.92 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.427 1.091 . . . . 0.91 110.164 171.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.04 -44.98 52.44 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 119.544 1.065 . . . . 3.46 112.748 -172.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 44.6 tttm -42.72 -47.21 5.35 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.368 1.467 . . . . 5.04 112.43 157.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.416 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -70.27 -31.96 69.56 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 117.165 -1.398 . . . . 0.59 114.284 176.186 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 32.8 t -59.72 -33.58 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 121.253 1.842 . . . . 1.02 110.747 171.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 11.8 mt -55.9 -63.59 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 CA-C-N 119.377 0.99 . . . . 1.46 110.58 164.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 83.4 t -55.35 -40.47 57.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.398 1.479 . . . . 0.57 112.936 -173.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -62.57 -35.01 78.11 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.118 0.967 . . . . 1.1 112.319 175.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 70.5 t -80.86 -41.54 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.538 1.135 . . . . 0.58 110.735 -177.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 64.7 tt0 -56.96 -45.67 82.71 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.363 0.529 . . . . 3.06 111.087 171.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -59.25 -27.94 66.26 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 114.51 1.3 . . . . 2.01 114.51 -177.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -79.46 -60.35 2.4 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.236 0.926 . . . . 1.92 111.296 173.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -65.73 -24.14 66.9 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.1 0.778 . . . . 1.96 113.1 -169.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -51.55 -23.51 4.24 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.547 1.314 . . . . 2.89 114.547 175.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -89.55 -11.09 43.79 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 115.045 1.498 . . . . 2.35 115.045 175.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 CA--C 1.546 0.819 0 C-N-CA 126.267 1.827 . . . . 2.17 111.864 -169.571 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 8.8 pt . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 108.368 -0.975 . . . . 3.22 108.368 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 75.7 m -100.06 174.27 6.25 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.259 0.624 . . . . 3.13 110.837 169.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . 0.404 ' HE2' ' HB2' ' B' ' 138' ' ' LYS . 3.0 mppt? -48.12 -30.74 4.81 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 113.767 1.025 . . . . 1.99 113.767 177.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 14.1 p -50.46 -30.36 12.52 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.628 1.344 . . . . 2.13 114.628 172.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 51.0 m -82.4 -32.42 29.14 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.41 1.004 . . . . 1.17 112.754 174.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.424 ' CE1' HD11 ' B' ' 145' ' ' LEU . 29.0 t80 -60.95 -48.57 81.21 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 120.007 1.276 . . . . 1.92 111.38 179.035 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -56.86 -28.63 61.99 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.114 0.783 . . . . 4.07 113.114 174.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.36 -52.09 5.83 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 125.253 1.421 . . . . 2.63 111.81 -173.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 7.0 tmm? -47.24 -41.02 17.77 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.792 1.237 . . . . 1.26 111.402 167.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . 0.424 HD11 ' CE1' ' B' ' 141' ' ' PHE . 30.7 mt -56.52 -70.86 0.1 Allowed 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 123.949 0.899 . . . . 1.46 111.502 167.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -72.37 -1.7 16.52 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.742 1.756 . . . . 2.93 115.742 -171.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.25 -50.84 3.51 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.704 1.602 . . . . 1.65 114.767 166.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -100.28 -26.18 14.0 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.102 1.319 . . . . 2.87 113.468 -172.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 22.2 mt -101.89 65.12 0.98 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.633 1.173 . . . . 2.92 110.3 160.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -96.96 -8.79 29.74 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.636 1.347 . . . . 1.28 114.636 -177.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 36.3 m-70 -93.89 -32.08 14.06 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.489 -1.382 . . . . 1.64 113.458 -171.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.0 mmm -91.25 -2.39 57.46 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.817 2.047 . . . . 2.37 111.365 173.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.4 tp -71.47 74.45 0.76 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.857 2.063 . . . . 2.36 111.322 -173.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 33.8 t -68.64 72.98 0.24 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.302 1.841 . . . . 4.41 112.635 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 21.8 t70 38.2 -133.43 0.13 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 130.146 3.378 . . . . 4.33 113.258 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 81.8 m -69.76 -40.99 75.76 Favored 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 125.097 1.359 . . . . 4.35 111.19 -165.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.37 -48.17 87.49 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 119.562 1.074 . . . . 2.51 111.747 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -72.47 -41.73 65.72 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.108 0.781 . . . . 3.38 113.108 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -67.12 -40.24 86.8 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 120.256 -1.527 . . . . 4.93 112.124 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 27.5 mmmt -67.23 -31.36 71.67 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 120.617 -1.302 . . . . 3.87 112.401 170.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.49 -19.81 65.81 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 114.651 1.352 . . . . 1.26 114.651 169.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.28 -57.7 3.64 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.808 1.185 . . . . 0.84 111.632 162.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -65.73 -26.37 67.71 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.736 1.013 . . . . 2.25 113.736 -172.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -56.47 -34.07 66.55 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.014 -1.054 . . . . 2.78 112.254 169.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 21.0 mt -75.7 -34.59 60.41 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.803 0.441 . . . . 0.76 111.593 -177.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 38.7 mm -62.47 -55.23 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 124.746 1.218 . . . . 1.08 109.744 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -60.73 -33.71 73.31 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.899 0.857 . . . . 1.95 112.88 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -64.48 -24.53 67.65 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.469 1.508 . . . . 2.55 113.308 174.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.32 -23.48 4.14 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 115.526 1.676 . . . . 2.65 115.526 -165.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -61.74 -13.61 24.78 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.065 -1.022 . . . . 3.3 112.139 153.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.86 -12.53 59.41 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 115.435 1.643 . . . . 2.7 115.435 163.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -134.48 -3.64 2.66 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.049 1.87 . . . . 3.18 116.049 -169.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -149.8 90.36 1.69 Allowed 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 120.853 1.66 . . . . 3.74 114.72 -170.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -81.07 116.42 21.0 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.094 1.757 . . . . 6.04 112.894 -178.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 67.02 8.59 50.27 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 115.989 1.156 . . . . 2.63 115.989 165.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 36.2 mmt-85 -112.31 163.57 14.23 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.078 1.751 . . . . 5.22 110.428 173.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.8 mm -149.82 129.78 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 126.375 1.87 . . . . 2.62 106.469 161.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 11.3 m -93.25 171.75 8.73 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.216 1.006 . . . . 1.93 111.065 171.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -71.37 -50.36 32.99 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 122.048 0.928 . . . . 2.25 111.956 173.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -70.79 -18.48 62.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.189 2.196 . . . . 3.04 113.621 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -54.38 -55.7 26.02 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.93 1.692 . . . . 3.44 111.569 167.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -55.22 -44.8 75.76 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.662 -1.274 . . . . 2.42 111.824 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 22.9 t-105 -62.93 -45.62 91.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.742 -0.647 . . . . 0.74 112.419 -177.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 6.8 t -71.59 -40.09 70.12 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 118.668 -0.682 . . . . 1.72 111.827 178.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 85.9 mt -56.42 -49.31 74.9 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 117.888 -1.053 . . . . 0.56 111.091 173.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 26.7 mm -50.13 -36.97 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-N 120.53 1.514 . . . . 0.65 112.63 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.42 -26.87 66.92 Favored Glycine 0 CA--C 1.53 1.023 0 CA-C-O 119.121 -0.821 . . . . 0.59 113.257 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -73.9 -31.5 60.0 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 118.313 1.056 . . . . 0.88 113.922 178.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . 0.463 ' H ' HD12 ' B' ' 189' ' ' ILE . 1.1 mp -85.99 -36.0 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 118.638 1.219 . . . . 0.84 110.877 173.273 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 62.6 m -71.46 -54.63 9.99 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.17 1.388 . . . . 2.92 111.475 -176.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -46.63 -41.85 13.44 Favored Glycine 0 CA--C 1.539 1.588 0 CA-C-O 117.264 -1.853 . . . . 0.95 116.705 -175.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.92 -51.91 2.02 Favored 'Trans proline' 0 C--N 1.353 0.812 0 CA-C-N 122.173 2.986 . . . . 1.28 112.046 175.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 25.2 pt -81.11 -15.49 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 N-CA-C 114.722 1.379 . . . . 0.92 114.722 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -49.8 -43.76 48.65 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.692 1.597 . . . . 0.97 112.849 -178.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 2.6 ptpp? -59.7 -36.31 76.26 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.962 0.905 . . . . 5.38 113.349 175.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 3.4 tt -77.89 -41.31 37.07 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.894 1.678 . . . . 1.46 110.091 -176.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 24.2 mt -56.22 -60.86 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.413 0.685 . . . . 1.14 109.347 168.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -54.58 -39.36 67.72 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 113.256 0.836 . . . . 2.22 113.256 -177.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -68.89 -38.02 79.39 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 119.745 -0.782 . . . . 3.29 111.627 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -70.14 -34.23 72.78 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 117.959 -1.019 . . . . 3.94 113.281 -173.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -63.01 -9.7 11.1 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.407 1.003 . . . . 2.76 112.942 171.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -114.15 -39.14 3.96 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.773 1.629 . . . . 2.69 113.33 177.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 . . . . . 0 CA--C 1.541 0.617 0 C-N-CA 127.185 2.194 . . . . 7.78 112.159 -172.885 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 . . . . . 0 CA--C 1.547 0.834 0 N-CA-C 112.322 0.489 . . . . 2.58 112.322 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.1 p -62.67 144.95 55.76 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 108.006 -1.109 . . . . 1.08 108.006 159.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.41 -43.54 98.57 Favored 'General case' 0 C--O 1.213 -0.834 0 CA-C-O 116.815 -1.564 . . . . 2.55 110.071 176.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -46.89 -48.44 21.18 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 120.3 1.409 . . . . 0.93 110.363 177.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -71.54 -51.21 24.75 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 118.045 -0.979 . . . . 2.94 112.581 -175.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 34.5 tptt -61.84 -23.89 66.55 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 121.456 1.935 . . . . 6.05 114.082 170.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.798 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -71.04 -38.79 72.55 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 125.338 1.455 . . . . 0.88 111.302 167.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.86 -41.09 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 121.04 1.745 . . . . 0.78 110.07 169.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.517 HD13 HG23 ' B' ' 197' ' ' ILE . 16.6 mm -53.07 -50.56 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 119.567 1.076 . . . . 1.36 111.063 167.239 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.7 t -62.43 -38.03 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.823 1.192 . . . . 0.76 111.99 179.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp -70.52 -26.84 63.77 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 120.705 -1.247 . . . . 1.15 112.584 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 97.3 t -81.41 -38.3 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 118.932 0.787 . . . . 0.76 111.311 175.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -52.57 -48.66 66.05 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.984 0.914 . . . . 3.36 110.512 165.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.504 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 3.3 t30 -63.98 -15.39 59.18 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.516 1.673 . . . . 2.48 115.516 -171.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -88.86 -60.56 1.92 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.846 0.858 . . . . 2.01 111.886 166.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -68.23 -22.39 64.79 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.383 1.253 . . . . 1.82 114.383 -169.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.504 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 9.1 ptmt -52.54 -19.89 2.58 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 115.707 1.743 . . . . 2.53 115.707 -177.191 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -96.53 -1.43 47.17 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 115.36 1.615 . . . . 3.43 115.36 174.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 19.9 m . . . . . 0 N--CA 1.485 1.292 0 CA-C-N 120.704 1.593 . . . . 2.97 112.377 -172.562 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 37.7 pt . . . . . 0 N--CA 1.471 0.613 0 CA-C-O 121.268 0.556 . . . . 2.86 111.331 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.0 m -71.05 145.87 49.66 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.646 -0.659 . . . . 2.64 110.578 170.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -59.39 -25.9 64.67 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 119.765 -1.834 . . . . 1.96 113.12 172.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.1 p -72.71 -20.42 61.22 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 114.04 1.126 . . . . 1.67 114.04 169.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 39.6 m -71.54 -21.03 61.95 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 120.748 -1.22 . . . . 1.07 111.527 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 51.0 t80 -58.98 -59.24 5.78 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.548 1.067 . . . . 2.19 111.206 172.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -61.84 -19.67 62.84 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.878 0.871 . . . . 2.51 113.301 -176.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.41 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 9.6 tt0 -88.82 -49.88 6.56 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 127.175 2.19 . . . . 2.94 110.685 179.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 7.1 tmm? -54.4 -40.13 67.93 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.642 1.577 . . . . 1.29 111.599 173.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.3 mt -49.77 -32.64 14.3 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.252 1.421 . . . . 1.33 113.206 168.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.84 -5.61 50.61 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.103 1.32 . . . . 3.25 113.823 -178.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.41 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -97.23 -51.58 4.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.676 0.79 . . . . 1.46 111.186 168.074 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -96.06 -21.38 18.0 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.597 0.962 . . . . 2.81 113.597 -167.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.01 34.61 4.84 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.427 1.891 . . . . 1.52 111.616 -176.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -80.42 -15.23 57.3 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 116.727 2.121 . . . . 1.53 116.727 -156.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 15.3 m-70 -79.73 -49.52 11.94 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 121.324 1.875 . . . . 1.62 112.388 -167.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 76.4 mtm -72.13 -19.83 61.71 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.925 1.69 . . . . 1.98 112.861 170.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.7 tp -86.13 50.89 2.07 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.927 1.291 . . . . 3.74 110.061 178.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 2.5 m -71.02 -9.03 57.33 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 115.801 1.778 . . . . 4.22 115.801 -153.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.403 ' CG ' ' N ' ' A' ' 53' ' ' THR . 22.6 t70 -162.28 174.98 12.1 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.423 1.889 . . . . 5.4 111.44 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.403 ' N ' ' CG ' ' A' ' 52' ' ' ASP . 9.5 m -48.66 -37.0 17.24 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 130.232 3.413 . . . . 3.53 111.943 162.383 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.0 -45.82 91.97 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 119.235 0.925 . . . . 2.4 112.217 172.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -69.47 -42.39 74.93 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.93 0.892 . . . . 4.44 109.975 175.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.75 -30.45 22.7 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.801 1.64 . . . . 5.02 114.114 172.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.5 mtmt -59.96 -22.23 62.23 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.28 1.4 . . . . 3.95 113.293 174.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.48 -15.32 57.01 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 114.866 1.432 . . . . 1.45 114.866 169.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.74 -49.31 10.58 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.402 1.081 . . . . 0.8 110.799 162.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -67.71 -29.46 68.72 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.735 1.214 . . . . 2.06 114.105 -176.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.2 ptmt -50.34 -35.68 28.87 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 119.563 1.074 . . . . 4.06 111.663 165.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.7 mt -78.23 -44.97 24.17 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 123.305 0.642 . . . . 1.04 111.15 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 23.0 mm -52.55 -49.53 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 123.734 0.646 . . . . 0.97 110.468 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -65.43 -40.12 92.92 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.503 0.927 . . . . 1.88 113.503 178.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -61.97 -29.66 70.4 Favored 'General case' 0 CA--C 1.554 1.123 0 N-CA-C 113.224 0.824 . . . . 3.31 113.224 172.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.84 -26.15 21.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.745 1.218 . . . . 2.19 112.158 179.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -64.16 -22.21 66.85 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.83 -1.168 . . . . 2.86 113.772 165.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.43 -15.98 60.89 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 114.294 1.22 . . . . 2.27 114.294 164.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -126.56 -13.38 5.98 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 116.887 2.18 . . . . 2.6 116.887 -166.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.14 125.31 27.66 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 121.963 2.165 . . . . 3.45 111.873 174.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -80.1 58.52 3.0 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.933 2.093 . . . . 4.23 111.955 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 76.12 2.5 72.6 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.594 1.093 . . . . 3.21 113.819 -174.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -77.22 163.0 26.93 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.407 1.104 . . . . 6.69 110.855 177.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 36.0 mm -138.61 140.11 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.479 1.511 . . . . 2.46 108.084 171.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.9 t -95.24 -146.49 0.27 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 127.05 2.14 . . . . 2.68 112.061 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -112.92 -59.67 1.99 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.03 1.732 . . . . 2.55 109.904 152.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.53 -22.63 61.93 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.079 2.151 . . . . 3.5 112.943 -170.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -47.57 -59.62 3.13 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 127.335 2.254 . . . . 3.13 111.09 167.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -54.17 -44.21 71.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.381 0.992 . . . . 2.42 112.202 -179.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.8 t-105 -63.1 -48.07 80.12 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 118.881 -0.581 . . . . 0.79 111.887 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.9 t -71.22 -26.45 62.93 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.931 0.787 . . . . 1.71 112.304 178.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 51.0 mt -66.15 -46.43 77.47 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.448 -1.263 . . . . 0.74 111.338 170.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.7 mm -51.99 -41.4 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 CA-C-N 121.808 2.094 . . . . 0.83 112.038 176.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.57 -21.96 71.17 Favored Glycine 0 CA--C 1.532 1.118 0 O-C-N 121.568 -0.708 . . . . 0.89 113.565 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.29 -23.36 68.48 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 118.631 -1.094 . . . . 0.9 114.279 -177.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.494 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.4 OUTLIER -92.04 -42.68 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 125.441 1.496 . . . . 0.96 110.044 166.137 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.2 m -78.77 60.11 2.71 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.528 2.331 . . . . 1.34 110.691 -177.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -130.33 -77.2 0.17 Allowed Glycine 0 CA--C 1.532 1.154 0 C-N-CA 126.206 1.86 . . . . 0.87 111.094 173.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -62.32 -38.0 57.23 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.146 2.564 . . . . 0.98 112.735 -178.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.2 pp -77.82 -14.75 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 112.864 0.69 . . . . 1.18 112.864 174.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.67 -33.02 41.56 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.798 -1.188 . . . . 1.06 113.512 -174.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.82 -33.57 71.93 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 120.095 -1.628 . . . . 2.82 111.657 163.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.04 -40.01 90.64 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 118.407 -0.806 . . . . 1.85 111.687 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 92.3 mt -45.71 -62.68 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.617 0.767 . . . . 1.03 110.212 164.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -60.43 -42.81 96.86 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.088 -0.505 . . . . 1.79 111.875 -172.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.298 4.1 pt-20 -76.38 -19.97 57.63 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 112.818 0.673 . . . . 3.28 112.818 -176.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -85.11 -37.24 20.49 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.984 1.714 . . . . 2.49 115.297 173.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -73.07 -16.48 61.48 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.178 0.899 . . . . 2.48 110.992 176.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 . . . . . 0 N--CA 1.466 0.338 0 C-N-CA 125.047 1.339 . . . . 2.3 111.085 170.12 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 C--O 1.242 0.71 0 N-CA-C 111.552 0.205 . . . . 2.2 111.552 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 11.7 p -57.93 151.35 18.42 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.053 -0.721 . . . . 0.99 109.053 166.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -68.55 -31.44 70.66 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 116.498 -1.715 . . . . 3.2 111.614 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.98 -48.62 70.17 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 121.418 1.917 . . . . 0.94 109.746 171.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -72.25 -51.35 21.35 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.442 -0.789 . . . . 2.9 112.325 -174.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -62.29 -24.07 67.08 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 121.324 1.875 . . . . 7.07 114.078 170.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.798 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.43 -43.24 73.78 Favored 'General case' 0 C--O 1.222 -0.376 0 O-C-N 120.233 -1.542 . . . . 0.64 111.461 166.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.04 -43.17 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 121.512 1.96 . . . . 0.73 110.69 169.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 22.3 mm -52.93 -55.57 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.045 0.838 . . . . 1.79 111.648 168.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 6.7 t -61.15 -38.71 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.61 1.164 . . . . 0.62 112.32 -177.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.8 mp -66.84 -32.59 73.96 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.237 -0.914 . . . . 1.26 111.848 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 79.4 t -80.01 -38.94 19.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.267 1.027 . . . . 0.68 111.025 177.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -55.05 -46.82 75.38 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.279 1.031 . . . . 3.18 110.5 168.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -59.44 -24.8 63.83 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 115.303 1.594 . . . . 2.37 115.303 -173.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -87.96 -58.4 2.58 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.158 1.383 . . . . 2.3 112.302 171.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -64.79 -26.69 68.46 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 112.582 0.586 . . . . 1.72 112.582 -172.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -53.43 -16.51 1.45 Allowed 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.017 1.488 . . . . 2.34 115.017 174.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -90.24 -5.51 56.27 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 114.744 1.387 . . . . 2.54 114.744 173.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 22.4 m . . . . . 0 N--CA 1.484 1.261 0 CA-C-N 121.271 1.85 . . . . 2.74 112.418 -171.788 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 31.3 pt . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 112.064 0.394 . . . . 2.19 112.064 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 69.0 m -85.95 151.17 23.96 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.201 -0.937 . . . . 2.25 111.172 169.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . 0.47 ' HE3' ' HA ' ' B' ' 170' ' ' ASP . 0.0 OUTLIER -58.06 -28.99 65.03 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.238 -1.539 . . . . 2.81 112.667 175.764 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 43.9 p -70.5 -24.51 62.86 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.616 -1.303 . . . . 1.64 114.218 171.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 20.0 m -72.53 -26.3 61.7 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 120.794 -1.191 . . . . 1.2 112.195 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.425 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 69.6 t80 -60.97 -51.25 70.06 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.137 -0.977 . . . . 2.01 112.103 173.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -67.08 -25.93 66.47 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.597 -0.689 . . . . 2.52 112.312 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.92 -52.52 28.49 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 124.314 1.046 . . . . 3.19 110.714 170.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 2.2 ttm -55.39 -39.83 70.63 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.976 1.31 . . . . 1.57 110.696 179.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.7 mt -56.53 -62.1 1.96 Allowed 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 125.825 1.65 . . . . 1.54 112.25 165.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -63.85 -16.76 62.13 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 120.349 1.431 . . . . 3.3 114.779 -176.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.78 -56.8 3.31 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.331 0.969 . . . . 1.38 112.019 170.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -93.88 -19.48 20.93 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 113.606 0.965 . . . . 2.83 113.606 -165.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 3.9 mt -122.33 57.21 1.09 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 129.135 2.974 . . . . 1.59 109.739 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -96.2 -16.82 21.23 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.724 1.75 . . . . 1.38 115.724 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -82.72 -27.51 31.1 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 121.087 1.767 . . . . 1.88 114.131 -172.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 65.3 mtm -89.26 6.1 41.85 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.413 1.885 . . . . 2.05 113.207 174.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 2.3 tp -83.36 -167.37 1.67 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 128.148 2.579 . . . . 3.06 111.49 173.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 15.5 m -174.6 -45.63 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 128.524 2.73 . . . . 3.97 109.266 171.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -151.69 179.07 8.72 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-O 123.437 1.589 . . . . 4.96 112.192 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 12.5 m -35.38 -40.99 0.16 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 128.802 2.841 . . . . 3.09 112.673 151.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.96 -47.76 47.43 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 124.923 1.249 . . . . 1.88 113.351 176.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -64.15 -48.17 77.04 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.904 0.881 . . . . 4.53 110.391 173.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -55.86 -33.4 64.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.992 1.717 . . . . 5.22 114.074 -178.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -55.69 -22.95 25.81 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 120.99 -1.069 . . . . 4.82 113.721 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -80.94 -14.89 57.56 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.044 1.498 . . . . 1.56 115.044 172.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -80.15 -52.19 8.06 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.58 1.082 . . . . 0.82 110.485 160.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -66.42 -29.8 70.03 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.775 1.23 . . . . 1.95 113.323 -172.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt -50.13 -35.18 24.78 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 118.911 0.778 . . . . 4.15 112.406 165.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.5 mt -81.32 -40.86 22.96 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.64 -0.663 . . . . 1.02 111.322 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.62 -48.98 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 123.23 0.612 . . . . 0.8 111.102 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -65.04 -24.42 67.48 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.002 1.112 . . . . 1.88 114.002 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -82.36 -41.05 20.49 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.293 1.22 . . . . 3.12 114.293 173.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.56 -32.04 20.9 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 121.12 -0.988 . . . . 2.6 112.45 -171.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . 0.47 ' HA ' ' HE3' ' B' ' 138' ' ' LYS . 7.9 t70 -60.26 -44.88 94.91 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.256 -0.902 . . . . 3.0 111.228 174.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.99 -12.0 7.02 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.168 1.787 . . . . 2.05 115.363 174.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -117.11 -4.06 11.48 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.758 1.223 . . . . 2.28 113.628 -177.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -154.96 95.29 1.73 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.697 1.135 . . . . 3.74 110.104 -168.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -76.23 79.94 3.02 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.631 1.572 . . . . 4.21 112.858 -164.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 68.24 -4.67 4.56 Favored Glycine 0 CA--C 1.535 1.304 0 O-C-N 121.03 -1.043 . . . . 2.89 113.114 -166.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 64.3 mmt-85 -68.52 147.95 51.25 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.799 1.24 . . . . 5.96 109.702 174.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 35.6 mm -142.55 137.92 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 126.464 1.905 . . . . 2.52 107.37 176.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 9.1 t -92.12 -142.87 0.2 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.961 1.704 . . . . 2.61 111.512 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -117.82 -56.71 2.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.404 1.881 . . . . 2.59 110.284 158.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -61.68 -27.41 68.67 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 128.508 2.723 . . . . 3.0 114.32 -177.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -43.54 -58.78 2.46 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.336 1.854 . . . . 3.01 111.054 165.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -54.5 -43.88 72.22 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.239 -0.913 . . . . 2.43 111.772 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 35.4 t-105 -62.3 -47.94 82.07 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 122.123 -0.361 . . . . 0.75 111.753 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 13.2 t -71.74 -25.81 62.21 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 118.215 -0.898 . . . . 1.66 112.274 177.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.425 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 62.1 mt -63.96 -48.97 74.37 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 117.28 -1.343 . . . . 0.71 110.737 168.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 38.7 mm -50.27 -41.88 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 CA-C-N 121.348 1.885 . . . . 0.74 112.065 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.55 -25.1 72.69 Favored Glycine 0 CA--C 1.531 1.057 0 O-C-N 121.534 -0.729 . . . . 0.91 113.744 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.94 -21.68 75.83 Favored Glycine 0 CA--C 1.533 1.182 0 CA-C-O 118.672 -1.071 . . . . 1.02 114.438 -176.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . 0.505 ' H ' HD12 ' B' ' 189' ' ' ILE . 0.5 OUTLIER -88.49 -48.4 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 125.12 1.368 . . . . 0.99 109.161 163.457 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 1.5 m -86.44 44.71 1.17 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.621 1.968 . . . . 1.69 111.9 -165.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -118.42 -71.39 0.39 Allowed Glycine 0 CA--C 1.53 1.027 0 C-N-CA 126.603 2.049 . . . . 0.93 111.036 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.14 -30.66 82.54 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.471 2.781 . . . . 1.6 114.176 -178.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 7.7 pt -83.88 -13.75 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 119.713 1.142 . . . . 1.29 113.518 172.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.95 -34.94 76.17 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.31 1.226 . . . . 0.87 114.31 -169.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -56.78 -36.29 69.69 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.434 -1.416 . . . . 3.2 111.808 168.289 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.02 -40.04 75.44 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 123.625 0.77 . . . . 2.2 111.369 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . 0.517 HG23 HD13 ' A' ' 13' ' ' ILE . 90.3 mt -47.41 -62.33 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.768 0.827 . . . . 1.13 110.85 166.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -56.35 -46.67 79.87 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.514 0.561 . . . . 1.68 112.514 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.305 2.6 pt-20 -78.6 -13.19 59.95 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.977 0.732 . . . . 2.91 112.977 -173.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -81.45 -25.81 35.81 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 115.058 1.503 . . . . 2.33 115.058 169.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -75.13 -15.63 60.58 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.12 0.968 . . . . 2.23 111.228 170.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -102.49 -61.81 1.35 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.965 1.306 . . . . 2.34 110.876 -179.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.254 7.5 pt20 . . . . . 0 N--CA 1.48 1.057 1 C-N-CA 132.026 4.13 . . . . 4.79 115.72 171.744 . . . . . . . . 2 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 . . . . . 0 CA--C 1.544 0.714 0 N-CA-C 112.34 0.496 . . . . 2.59 112.34 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 17.1 p -78.95 166.75 22.03 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 120.795 -1.191 . . . . 0.9 110.953 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -56.58 -34.13 66.85 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.28 0.632 . . . . 2.25 112.47 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -45.7 90.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.17 1.388 . . . . 0.83 110.122 175.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -76.23 -47.99 21.93 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.993 0.917 . . . . 2.93 111.423 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 40.2 tttm -44.89 -46.69 11.01 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.248 1.419 . . . . 5.87 113.104 159.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.82 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -63.52 -45.99 88.08 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.563 -1.208 . . . . 0.53 112.896 175.695 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.5 t -57.76 -38.61 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 120.87 1.668 . . . . 0.59 110.377 174.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.4 mt -63.64 -43.37 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 121.634 -0.666 . . . . 1.04 111.277 173.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.8 t -68.28 -39.82 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 124.394 1.077 . . . . 0.49 111.986 179.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.4 mp -59.83 -45.29 92.85 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.75 1.159 . . . . 0.91 110.212 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.6 t -64.66 -42.22 94.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 124.896 1.278 . . . . 0.53 112.32 177.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -56.57 -49.28 75.33 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.408 1.083 . . . . 3.38 111.13 168.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.406 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -72.16 -24.62 61.47 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.91 0.707 . . . . 2.59 112.91 -170.115 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -71.2 -63.15 1.16 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.983 0.513 . . . . 1.95 112.185 161.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -63.53 -32.59 74.09 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.792 -0.623 . . . . 1.88 112.376 -163.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 18' ' ' ASN . 35.8 pttt -55.57 -23.38 26.66 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.585 1.328 . . . . 2.31 114.585 175.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -78.95 -31.03 44.9 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.623 -1.298 . . . . 2.4 112.607 174.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.1 m . . . . . 0 N--CA 1.486 1.333 0 CA-C-N 120.824 1.647 . . . . 2.09 111.72 176.379 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.0 pt . . . . . 0 CA--C 1.533 0.289 0 N-CA-C 108.907 -0.775 . . . . 3.25 108.907 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 72.1 m -113.92 167.64 10.48 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.606 0.763 . . . . 2.99 109.512 160.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.41 -18.28 4.01 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 115.583 1.697 . . . . 2.36 115.583 176.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.3 p -57.15 -20.73 28.01 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.384 -1.447 . . . . 2.18 114.286 165.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.7 m -82.44 -33.01 28.69 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.725 -1.234 . . . . 1.26 113.52 171.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -55.3 -52.38 63.63 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.789 1.177 . . . . 2.37 111.37 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -16.32 8.81 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.688 1.195 . . . . 2.96 113.976 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -106.86 -38.58 6.03 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 124.826 1.251 . . . . 3.04 112.529 -174.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.2 ttm -47.99 -44.58 30.74 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.767 0.827 . . . . 1.6 110.286 156.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.2 mt -62.46 -12.64 23.17 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 116.006 1.854 . . . . 0.96 116.006 170.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -104.96 -15.56 15.09 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 124.761 1.224 . . . . 2.33 113.505 174.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.51 -47.56 3.9 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.326 1.051 . . . . 1.49 112.924 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -94.73 -9.53 34.42 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.223 1.374 . . . . 2.94 113.967 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -120.14 34.11 5.34 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.849 1.66 . . . . 1.48 112.601 171.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -78.65 -21.2 48.69 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 116.209 1.929 . . . . 1.65 116.209 -161.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -94.18 -14.35 25.69 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.237 1.381 . . . . 1.96 112.989 -170.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 50.2 mtm -85.53 -18.1 34.43 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.625 1.17 . . . . 2.12 112.922 162.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.55 125.99 26.93 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 120.643 -1.286 . . . . 3.15 108.618 163.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.6 p -171.81 -57.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.568 -0.707 . . . . 3.5 109.449 -158.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -79.49 147.2 32.32 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.511 0.724 . . . . 5.45 109.25 155.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.3 m -69.15 -30.17 68.35 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.785 0.834 . . . . 2.38 110.473 171.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -55.8 -33.74 60.29 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 124.461 1.029 . . . . 1.74 113.098 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -59.78 -56.0 27.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.319 1.047 . . . . 3.07 111.514 -179.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.6 ttt-85 -73.33 -33.29 65.05 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.148 0.795 . . . . 4.8 113.148 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -55.65 -38.11 69.12 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 119.562 -1.961 . . . . 3.08 112.163 171.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.96 -10.14 55.79 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.571 1.693 . . . . 1.25 115.571 172.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.32 -57.32 3.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.585 1.084 . . . . 0.88 111.019 162.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.18 -29.42 70.35 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.49 0.716 . . . . 2.96 112.085 -172.295 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -62.64 -28.07 69.65 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 120.434 -1.416 . . . . 2.57 114.311 172.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.9 mt -78.54 -36.76 44.3 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.315 0.646 . . . . 0.91 110.554 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.4 mm -51.6 -55.48 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 126.271 1.828 . . . . 1.0 109.55 178.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -60.1 -31.15 69.77 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.67 0.989 . . . . 2.25 113.67 -178.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -31.61 65.64 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.405 1.482 . . . . 2.96 112.55 175.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.4 -29.98 21.08 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.335 1.454 . . . . 2.1 111.587 177.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -55.4 -52.01 64.98 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.757 1.623 . . . . 2.99 109.503 164.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.97 -14.69 24.47 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 115.553 1.686 . . . . 2.03 115.553 175.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -118.73 -7.39 10.52 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.152 1.538 . . . . 2.35 115.152 -175.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -147.45 125.28 11.92 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 121.019 1.736 . . . . 3.76 111.051 -179.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -114.88 149.82 36.56 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.632 0.773 . . . . 5.23 110.44 163.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.54 -43.67 0.59 Allowed Glycine 0 CA--C 1.53 1.002 0 C-N-CA 126.598 2.047 . . . . 3.0 114.346 -178.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -88.93 140.66 29.21 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.296 1.439 . . . . 5.43 112.342 -173.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 46.7 mm -114.29 129.61 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 N-CA-C 106.357 -1.72 . . . . 2.48 106.357 154.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.2 t -84.9 -171.71 3.79 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.392 0.615 . . . . 1.7 112.489 -179.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -94.51 -57.76 2.39 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 119.253 -2.154 . . . . 1.89 110.404 167.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -51.46 -29.13 15.23 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 130.713 3.605 . . . . 3.33 114.94 170.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -49.72 -58.67 4.87 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.306 1.442 . . . . 3.23 111.306 171.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -52.44 -48.21 65.94 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.211 -0.931 . . . . 1.99 111.652 176.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.4 t-105 -64.54 -45.56 86.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 119.054 -0.498 . . . . 0.54 111.416 -171.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.2 t -71.17 -29.39 65.13 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 117.753 -1.117 . . . . 1.87 112.229 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.89 -35.51 76.95 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.459 1.027 . . . . 0.66 112.207 174.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.3 mm -52.26 -38.72 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 CA-C-N 120.322 1.419 . . . . 0.67 111.359 173.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.79 -14.02 64.64 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.422 1.487 . . . . 0.58 115.309 177.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.29 -24.94 64.7 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-N 119.394 1.597 . . . . 0.8 112.842 173.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -97.08 -41.99 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.305 1.442 . . . . 1.05 109.96 171.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.4 m -80.93 64.12 5.57 Favored 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 127.014 2.126 . . . . 1.33 108.342 173.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -159.87 -55.67 0.01 OUTLIER Glycine 0 CA--C 1.531 1.038 0 C-N-CA 126.04 1.781 . . . . 1.32 110.937 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.09 -73.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.344 2.696 . . . . 1.4 111.341 161.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.5 pt -73.51 -18.33 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 N-CA-C 114.7 1.37 . . . . 1.25 114.7 -170.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.484 ' HA ' HD12 ' A' ' 94' ' ' ILE . . . -55.23 -39.29 69.55 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.227 1.011 . . . . 1.13 112.606 -178.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -63.28 -41.79 99.05 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.5 -0.75 . . . . 5.78 111.863 175.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.5 tt -65.18 -40.89 94.9 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 117.908 -1.044 . . . . 1.18 110.818 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.484 HD12 ' HA ' ' A' ' 91' ' ' ALA . 96.7 mt -45.72 -51.28 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 119.375 0.988 . . . . 1.0 110.726 174.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -63.71 -39.18 93.66 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.605 0.965 . . . . 1.96 113.605 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -85.41 -24.09 27.66 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.18 0.9 . . . . 2.78 112.978 -177.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -66.89 -46.36 75.15 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.159 1.383 . . . . 2.45 109.166 164.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -84.16 41.16 0.8 Allowed 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 124.914 2.292 . . . . 3.11 111.002 176.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 111.862 -2.426 . . . . 2.44 107.361 149.915 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 . . . . . 0 CA--C 1.54 0.576 0 CA-C-O 121.091 0.472 . . . . 2.43 111.976 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.3 p -82.74 168.99 16.67 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 121.526 -0.734 . . . . 0.98 110.359 177.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -63.8 -48.78 75.51 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-O 117.022 -1.466 . . . . 2.56 110.509 171.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.25 -47.23 36.11 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 120.2 1.363 . . . . 0.75 111.0 178.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -73.49 -53.91 9.5 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 126.078 1.751 . . . . 2.96 112.503 -173.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -47.55 -36.64 10.83 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.125 1.37 . . . . 4.56 113.299 161.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.82 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -73.61 -38.82 64.96 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 120.716 -1.24 . . . . 0.47 112.003 176.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.94 -40.99 79.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 120.914 1.688 . . . . 0.66 110.385 166.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 97.1 mt -58.74 -49.04 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 118.867 0.758 . . . . 0.9 112.103 171.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.8 t -61.38 -43.3 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.98 1.312 . . . . 0.49 112.265 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -60.77 -44.01 97.32 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.825 1.193 . . . . 0.94 110.778 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 55.5 t -63.38 -42.55 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 124.325 1.05 . . . . 0.52 111.836 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -55.54 -47.75 75.81 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 119.972 1.26 . . . . 3.6 110.514 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . 0.407 ' HA ' ' HE2' ' B' ' 124' ' ' LYS . 0.2 OUTLIER -72.9 -24.9 60.89 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 112.694 0.627 . . . . 2.56 112.694 -168.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -74.02 -59.72 2.59 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.898 0.479 . . . . 1.97 112.111 163.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -64.34 -32.68 74.39 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.6 -0.714 . . . . 1.83 112.286 -165.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . 0.407 ' HE2' ' HA ' ' B' ' 121' ' ' ASN . 37.4 pttt -54.84 -24.57 23.67 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.437 1.273 . . . . 2.19 114.437 175.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -77.39 -31.29 54.09 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 117.49 -1.243 . . . . 2.13 112.963 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.486 1.37 0 CA-C-N 120.901 1.682 . . . . 2.06 112.125 -179.056 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 3.2 pt . . . . . 0 CA--C 1.533 0.316 0 N-CA-C 108.62 -0.882 . . . . 3.35 108.62 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 66.3 m -117.17 168.95 9.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.744 0.818 . . . . 2.94 109.457 161.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.6 -16.96 2.77 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 116.02 1.859 . . . . 2.21 116.02 175.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.9 p -59.59 -20.48 56.09 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 119.636 -1.915 . . . . 2.11 114.455 165.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 23.6 m -78.88 -31.68 45.57 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 120.439 -1.413 . . . . 1.21 112.983 170.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.484 ' CE2' HD11 ' B' ' 145' ' ' LEU . 50.1 t80 -61.05 -49.38 77.58 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.592 1.157 . . . . 2.24 112.039 -178.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 1.2 ptt180 -55.58 -15.55 3.02 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.899 1.074 . . . . 2.94 113.899 173.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -106.03 -38.33 6.34 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 125.451 1.5 . . . . 2.73 112.525 -175.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.5 ttm -49.79 -44.39 49.0 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.247 1.019 . . . . 1.57 110.45 159.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . 0.484 HD11 ' CE2' ' B' ' 141' ' ' PHE . 28.7 mt -65.04 -0.6 1.66 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 126.214 1.806 . . . . 1.21 115.644 171.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -120.78 -14.71 8.5 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 125.452 1.501 . . . . 2.35 114.046 174.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.86 -53.23 2.8 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.171 0.988 . . . . 1.54 113.47 175.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -85.69 -34.65 21.23 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 120.585 1.539 . . . . 2.79 112.545 177.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.22 47.38 0.9 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.753 1.221 . . . . 1.83 111.595 179.284 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -89.69 -16.32 30.65 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 115.685 1.735 . . . . 1.6 115.685 -160.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -97.82 -22.72 16.22 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 120.454 1.479 . . . . 1.64 113.278 -167.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 60.2 mtm -79.64 -19.38 49.26 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.672 -1.268 . . . . 2.1 111.947 166.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 5.9 mp -63.28 125.54 24.46 Favored 'General case' 0 C--O 1.222 -0.358 0 O-C-N 121.399 -0.813 . . . . 3.02 108.815 160.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 18.4 p -172.74 -68.72 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.996 -1.113 . . . . 3.34 107.996 -161.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -66.14 139.52 58.15 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.723 0.773 . . . . 5.7 109.392 155.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 37.8 m -68.0 -28.02 67.06 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.003 0.921 . . . . 2.53 110.441 174.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.76 -32.02 58.45 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.544 1.069 . . . . 1.77 112.953 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -64.78 -55.65 18.42 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.262 1.031 . . . . 3.16 111.522 -175.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 31.0 ttt-85 -71.74 -36.22 70.37 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.441 0.904 . . . . 4.57 113.441 173.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -53.42 -42.88 67.5 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.829 1.65 . . . . 3.47 111.859 172.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.66 -23.3 58.96 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.206 -1.378 . . . . 0.96 114.521 174.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.4 -52.01 11.75 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.818 1.19 . . . . 0.81 111.799 167.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.42 -27.38 68.51 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 124.062 0.945 . . . . 2.58 112.807 -175.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.1 mtmt -63.19 -31.21 72.3 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.345 -1.472 . . . . 3.93 113.742 169.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 7.9 mt -76.25 -36.72 58.34 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.12 0.568 . . . . 0.96 111.209 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 34.8 mm -53.84 -58.81 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.046 1.339 . . . . 1.13 110.099 175.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -59.06 -34.8 72.36 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.328 0.862 . . . . 1.82 113.328 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -63.68 -36.6 84.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.54 1.136 . . . . 3.19 112.205 173.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.67 -28.85 24.44 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.343 1.057 . . . . 2.3 111.749 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -55.67 -55.51 31.32 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.252 1.021 . . . . 3.01 110.264 163.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -56.52 -24.76 48.76 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.694 1.368 . . . . 1.98 114.694 176.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -103.6 -9.23 19.39 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 114.576 1.324 . . . . 2.38 114.576 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -150.55 122.57 8.22 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 121.394 1.906 . . . . 3.77 112.083 -177.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -100.42 153.1 19.62 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.289 0.635 . . . . 5.01 110.315 153.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.56 -45.54 1.28 Allowed Glycine 0 CA--C 1.53 0.976 0 C-N-CA 126.876 2.179 . . . . 2.79 115.489 168.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 23.6 mmt85 -84.47 154.19 22.9 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.352 1.461 . . . . 5.34 111.89 -176.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.9 mm -131.67 129.2 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 126.236 1.814 . . . . 2.47 106.324 159.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 2.8 t -87.11 -174.2 4.79 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 112.779 0.659 . . . . 1.74 112.779 -177.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -89.82 -58.12 2.62 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 119.234 -2.166 . . . . 1.89 110.029 163.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -54.53 -28.51 45.91 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.184 3.394 . . . . 3.16 114.19 176.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -46.87 -59.93 2.76 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.148 1.379 . . . . 3.31 111.287 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -52.0 -46.71 65.01 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.41 -0.806 . . . . 2.09 111.498 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 -65.92 -42.65 89.84 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 119.009 -0.519 . . . . 0.6 111.908 -174.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 11.2 t -70.5 -28.88 65.31 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 117.662 -1.161 . . . . 1.74 112.262 174.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.7 mt -69.92 -40.97 75.25 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.801 1.182 . . . . 0.68 112.106 172.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.5 mm -53.44 -37.19 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 CA-C-N 121.232 1.833 . . . . 0.63 111.989 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.22 -13.12 59.59 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 124.917 1.246 . . . . 0.56 115.126 177.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -81.31 -19.61 66.33 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-N 119.535 1.668 . . . . 1.04 113.778 173.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.1 mp -100.39 -44.57 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 124.815 1.246 . . . . 1.22 109.411 168.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.7 m -77.82 58.51 1.89 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.86 2.064 . . . . 1.47 109.24 169.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -158.68 -58.54 0.01 OUTLIER Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.359 1.933 . . . . 1.37 111.141 -172.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -61.66 -71.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.373 2.715 . . . . 1.65 111.242 163.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 16.8 pt -76.38 -18.22 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 115.1 1.519 . . . . 1.25 115.1 -170.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.0 -35.26 76.36 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.078 0.77 . . . . 1.26 113.078 -172.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -60.38 -38.49 84.08 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.918 -0.489 . . . . 6.1 111.923 175.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.4 tt -71.67 -34.67 69.89 Favored 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 124.343 1.057 . . . . 1.51 111.466 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 91.0 mt -47.16 -50.81 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 CA-C-N 119.83 1.195 . . . . 1.01 110.098 172.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 13.3 t60 -63.86 -25.16 68.04 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.495 1.295 . . . . 1.99 114.495 -176.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -98.35 -27.0 14.3 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.769 1.168 . . . . 2.83 113.17 176.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -72.0 -45.65 60.15 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 124.546 1.139 . . . . 2.26 109.824 173.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -83.26 36.3 0.52 Allowed 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 124.374 2.035 . . . . 3.12 110.969 175.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -117.06 -52.79 2.5 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 112.803 -1.999 . . . . 2.02 108.247 151.369 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 . . . . . 0 CA--C 1.543 0.71 0 C-N-CA 125.537 1.535 . . . . 5.47 114.814 -176.544 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 . . . . . 0 N--CA 1.472 0.636 0 N-CA-C 113.186 0.81 . . . . 2.3 113.186 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p -71.51 168.12 18.23 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.952 0.901 . . . . 1.25 111.251 -169.874 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -61.2 -59.92 4.57 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-O 118.502 -0.761 . . . . 2.68 109.941 169.287 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -46.64 -41.91 15.48 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.158 1.383 . . . . 0.83 111.243 -178.168 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -70.78 -58.02 4.06 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 125.357 1.463 . . . . 2.69 113.181 179.131 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -54.24 -26.54 29.26 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 120.622 1.556 . . . . 5.72 113.438 168.341 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.869 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -74.75 -42.44 58.22 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 125.456 1.502 . . . . 0.49 110.716 174.492 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.5 t -58.9 -38.24 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 120.144 1.338 . . . . 0.7 110.754 165.501 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.5 mt -58.25 -48.78 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-O 117.481 -1.247 . . . . 0.81 111.183 168.664 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.8 t -60.77 -35.53 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 CA-C-N 121.029 1.74 . . . . 0.63 113.085 178.39 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp -67.15 -48.66 67.36 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.042 -1.036 . . . . 0.95 111.775 170.384 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.1 t -57.59 -40.92 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 125.319 1.448 . . . . 0.63 111.797 173.59 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -68.33 -47.87 66.38 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 126.991 2.116 . . . . 3.15 111.154 -179.343 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -75.17 -5.27 43.5 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.8 1.037 . . . . 2.67 113.8 -179.851 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -84.08 -60.01 2.23 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.272 -0.893 . . . . 2.39 112.239 162.277 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -64.64 -30.88 71.91 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.075 -1.016 . . . . 1.76 113.575 -175.0 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -48.8 -34.11 11.73 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 114.277 1.214 . . . . 2.69 114.277 167.633 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -95.42 -36.87 11.18 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.865 0.866 . . . . 2.51 110.385 -176.012 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.8 t . . . . . 0 N--CA 1.479 0.988 0 N-CA-C 114.244 1.201 . . . . 3.03 114.244 175.866 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 29.7 pt . . . . . 0 N--CA 1.467 0.398 0 N-CA-C 109.377 -0.601 . . . . 2.31 109.377 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.4 m -98.77 139.83 33.87 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.011 0.924 . . . . 2.28 109.353 163.143 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -54.45 -31.04 54.68 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 122.861 1.315 . . . . 2.26 113.28 -177.19 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.2 p -60.77 -24.22 65.6 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.864 1.666 . . . . 1.82 114.615 173.723 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.5 m -80.78 -33.43 34.94 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.08 0.952 . . . . 1.21 112.425 174.691 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.441 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 28.8 t80 -59.98 -49.28 78.28 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.072 -1.018 . . . . 2.14 111.309 178.232 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 24.5 ptt180 -58.97 -25.21 63.36 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.94 0.718 . . . . 2.43 112.94 176.159 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -88.08 -47.54 8.42 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 125.298 1.439 . . . . 2.55 111.276 -178.741 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -45.77 -43.39 13.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.332 1.453 . . . . 1.3 111.43 167.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.441 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 44.5 mt -67.9 -4.26 12.32 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 115.474 1.657 . . . . 1.42 115.474 175.252 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -98.22 -19.25 17.97 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.166 1.787 . . . . 2.74 113.611 166.657 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.47 -57.1 2.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.371 1.468 . . . . 1.56 112.774 -178.669 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -79.2 -15.8 57.51 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.097 -1.002 . . . . 3.67 111.849 -178.085 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -126.66 45.85 2.6 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 127.508 2.323 . . . . 1.93 110.672 176.101 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -87.34 -16.41 35.11 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 116.057 1.873 . . . . 1.37 116.057 -175.314 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -98.57 -17.84 18.46 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 121.402 1.91 . . . . 1.61 112.196 -175.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.0 tpp -77.03 -13.29 59.98 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.874 1.67 . . . . 1.87 112.543 166.423 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.3 tp -72.97 89.85 1.45 Allowed 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 124.142 1.925 . . . . 3.58 112.813 -173.648 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.6 t -82.38 71.94 9.44 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 112.999 -1.909 . . . . 4.13 110.027 163.284 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.1 t70 82.26 159.78 0.14 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 127.627 2.371 . . . . 3.87 116.266 165.114 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -28.21 -41.28 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 130.959 3.704 . . . . 2.21 114.475 159.371 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.91 -50.87 62.76 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-N 119.596 1.089 . . . . 1.65 112.36 176.296 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -64.39 -32.21 73.74 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.892 -0.769 . . . . 3.28 112.263 172.795 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -66.33 -50.47 63.49 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 120.104 1.32 . . . . 6.14 112.871 173.506 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.8 mmmt -49.26 -40.84 35.72 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 119.144 0.884 . . . . 5.26 112.283 170.022 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' A' ' 61' ' ' LYS . . . -61.16 -18.72 59.59 Favored 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 115.622 1.712 . . . . 1.19 115.622 177.453 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.418 ' HB2' HG12 ' A' ' 86' ' ' ILE . . . -78.2 -52.87 8.03 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.797 0.839 . . . . 0.81 111.882 163.188 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -60.28 -29.41 68.79 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.888 2.075 . . . . 2.72 113.433 -177.163 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.497 ' HG2' ' HA ' ' A' ' 58' ' ' ALA . 2.1 ptmm? -56.51 -32.03 64.66 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 120.763 -1.21 . . . . 3.58 113.015 167.562 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.9 mt -67.38 -42.15 83.83 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.493 -0.754 . . . . 0.92 111.507 176.406 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.9 mm -57.79 -50.09 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.774 1.23 . . . . 0.94 110.385 -173.013 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -67.31 -36.57 81.76 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.373 1.069 . . . . 1.94 112.621 -179.085 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -65.81 -28.44 69.0 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 112.747 0.647 . . . . 3.91 112.747 172.628 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 tt -91.94 -21.72 20.41 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.409 1.083 . . . . 2.41 113.121 -178.366 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -59.21 -19.1 42.56 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.014 1.116 . . . . 2.57 114.014 162.15 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.66 -9.28 59.8 Favored 'General case' 0 CA--C 1.553 1.096 0 N-CA-C 115.26 1.578 . . . . 2.62 115.26 164.849 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -148.13 59.22 1.1 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 120.547 1.521 . . . . 3.16 114.048 -166.116 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.9 t60 -168.64 112.93 0.59 Allowed 'General case' 0 N--CA 1.48 1.029 0 O-C-N 120.11 -1.619 . . . . 4.65 113.34 -173.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.93 30.38 0.17 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.276 2.23 . . . . 7.16 113.864 -175.785 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.93 8.06 72.25 Favored Glycine 0 CA--C 1.537 1.424 0 O-C-N 120.07 -1.644 . . . . 3.16 113.468 -169.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 10.8 mmt-85 -98.98 98.7 9.72 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 125.964 1.706 . . . . 4.91 108.909 -178.148 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.5 mm -68.69 113.16 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 N-CA-C 105.729 -1.952 . . . . 2.2 105.729 164.801 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.8 m -80.25 165.64 22.16 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.049 0.841 . . . . 1.42 112.297 167.798 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -59.59 -48.75 80.42 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 122.508 1.147 . . . . 2.05 110.407 161.607 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.1 -22.73 66.04 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.722 2.009 . . . . 2.87 113.482 177.457 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -66.66 -50.13 63.95 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.304 0.957 . . . . 2.81 111.098 174.968 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -56.09 -49.8 72.83 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 120.857 -1.152 . . . . 1.8 111.694 173.314 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.1 t-105 -63.64 -47.99 79.1 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 121.69 -0.631 . . . . 0.52 112.206 -176.095 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 t -67.04 -26.79 66.93 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.354 -0.831 . . . . 1.58 111.978 -179.945 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.6 mt -72.43 -35.59 68.37 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.306 -1.331 . . . . 0.61 112.921 171.725 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.5 mm -57.47 -39.29 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 CA-C-N 121.605 2.002 . . . . 0.69 111.912 178.271 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.5 -10.84 67.44 Favored Glycine 0 N--CA 1.475 1.298 0 C-N-CA 124.291 0.948 . . . . 0.74 114.045 175.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.99 -17.91 66.34 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.792 1.187 . . . . 0.77 113.562 176.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.418 HG12 ' HB2' ' A' ' 59' ' ' ALA . 0.2 OUTLIER -104.09 -45.7 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.667 1.187 . . . . 1.03 109.637 166.999 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 30.7 m -75.02 96.53 3.21 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.103 1.361 . . . . 1.31 109.042 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -168.97 -74.02 0.04 OUTLIER Glycine 0 CA--C 1.532 1.127 0 CA-C-O 118.44 -1.2 . . . . 0.98 113.481 -175.807 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -63.18 -45.81 11.5 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.652 2.235 . . . . 1.2 111.531 179.325 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.1 pt -71.82 -13.53 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 114.019 1.118 . . . . 1.1 114.019 176.013 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.78 -52.96 63.33 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.148 1.34 . . . . 1.06 112.922 177.916 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -61.01 -33.56 73.45 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.423 -1.423 . . . . 3.08 112.669 173.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.6 -45.55 86.48 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.478 0.711 . . . . 1.06 110.865 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.8 mt -49.77 -58.3 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.273 0.629 . . . . 0.99 110.277 168.363 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -73.16 -20.01 61.0 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.434 0.901 . . . . 2.56 113.434 -169.643 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.287 4.0 pt-20 -88.07 -21.9 24.46 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.586 0.754 . . . . 2.69 111.987 175.055 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -79.96 -38.72 31.7 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 125.057 1.343 . . . . 2.74 114.336 172.23 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.62 9.84 0.58 Allowed 'General case' 0 N--CA 1.487 1.391 0 CA-C-O 123.659 1.695 . . . . 2.56 112.682 177.438 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 . . . . . 0 C--N 1.327 -0.398 0 C-N-CA 126.827 2.051 . . . . 2.69 109.965 175.208 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 114.992 1.479 . . . . 2.18 114.992 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.7 p -65.29 156.29 32.47 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.232 1.013 . . . . 1.01 110.252 -173.494 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -58.25 -33.82 69.78 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 118.555 0.616 . . . . 2.35 112.39 179.767 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 tt -67.57 -44.11 78.99 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.769 1.628 . . . . 0.91 110.605 177.956 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -72.83 -46.01 55.33 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.35 -0.844 . . . . 2.77 111.287 -178.428 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -53.05 -39.23 63.1 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.828 1.651 . . . . 5.31 111.101 165.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.869 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.08 -44.85 78.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 120.686 -1.259 . . . . 0.54 112.73 173.269 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 75.7 t -55.4 -41.5 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 121.132 1.787 . . . . 0.65 110.608 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 91.1 mt -56.35 -48.33 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 119.322 0.965 . . . . 0.79 111.465 170.583 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 37.7 t -65.01 -36.58 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 119.887 1.221 . . . . 0.48 113.3 178.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.99 -45.83 80.19 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.13 -0.981 . . . . 0.94 110.783 172.602 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 48.2 t -62.49 -40.67 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.105 1.362 . . . . 0.73 111.647 176.116 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -64.67 -49.07 72.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.462 1.505 . . . . 3.02 111.347 176.163 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -80.65 14.0 2.3 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.232 1.013 . . . . 2.81 113.672 -179.052 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -108.31 -58.14 2.03 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.271 1.428 . . . . 2.11 111.321 163.963 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -64.35 -27.46 69.04 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 120.71 -1.244 . . . . 1.82 113.506 -175.993 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 17.3 mtpt -45.98 -37.41 6.52 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.186 1.18 . . . . 2.4 114.186 164.62 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -90.74 -34.6 15.3 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.956 1.302 . . . . 2.69 111.258 -176.431 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 67.3 t . . . . . 0 N--CA 1.482 1.138 0 C-N-CA 124.93 1.292 . . . . 3.21 113.485 175.233 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 14.4 pt . . . . . 0 N--CA 1.471 0.607 0 CA-C-O 121.334 0.588 . . . . 2.74 111.993 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 51.5 m -93.45 138.66 31.54 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 108.621 -0.881 . . . . 2.32 108.621 156.63 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . 0.459 ' HE2' ' CD2' ' B' ' 173' ' ' HIS . 78.5 mttt -55.03 -32.13 61.61 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 119.918 1.235 . . . . 2.2 113.313 -173.762 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 50.1 p -64.82 -17.3 64.11 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.533 1.533 . . . . 1.64 114.798 176.078 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 43.4 m -85.8 -35.94 20.38 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.947 1.249 . . . . 1.21 112.329 -179.608 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.507 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 11.3 t80 -49.92 -54.14 21.59 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.542 1.137 . . . . 2.16 111.047 173.756 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -62.11 -17.83 58.93 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.213 0.82 . . . . 2.26 113.213 179.505 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -94.94 -43.83 7.99 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.671 1.588 . . . . 2.31 112.516 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -49.39 -41.59 39.86 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.926 -1.109 . . . . 1.26 110.483 162.275 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . 0.45 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 17.2 mt -67.49 -8.25 32.11 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 116.389 1.996 . . . . 1.44 116.389 171.073 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -93.88 -23.02 18.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.95 1.3 . . . . 2.62 113.697 164.843 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.13 -60.99 1.43 Allowed 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.841 1.201 . . . . 1.74 113.54 -178.502 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -76.46 -10.68 59.57 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.619 -1.3 . . . . 3.19 112.638 -174.573 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.88 31.75 5.24 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 128.012 2.525 . . . . 1.58 111.678 175.142 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -69.16 -29.64 67.69 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.967 1.469 . . . . 1.28 114.967 -171.717 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -86.83 -24.98 24.77 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.391 0.996 . . . . 1.55 111.416 -171.786 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 5.0 tpp -61.81 -17.54 56.57 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.189 0.996 . . . . 1.86 112.719 167.869 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 16.8 tp -80.9 88.71 5.87 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 123.258 1.504 . . . . 2.83 112.168 -169.993 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 40.2 t -71.27 65.37 0.41 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 113.825 -1.534 . . . . 4.34 110.63 158.269 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 35.2 t70 95.38 156.09 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 129.37 3.068 . . . . 3.85 115.936 166.761 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.6 m -34.16 -38.6 0.06 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 130.878 3.671 . . . . 2.48 114.496 158.94 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -57.89 -43.49 94.79 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 120.1 1.318 . . . . 1.66 111.748 176.131 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -68.93 -21.36 64.21 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 113.413 0.894 . . . . 3.53 113.413 172.857 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -75.06 -45.45 41.41 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 121.182 1.81 . . . . 6.56 112.741 167.617 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -53.18 -40.61 64.49 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.548 0.613 . . . . 4.04 111.419 175.367 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -51.85 -45.28 63.96 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.388 0.884 . . . . 1.56 113.388 171.698 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -63.49 -38.65 91.96 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.175 0.99 . . . . 0.85 113.176 177.011 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -32.77 74.5 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.694 0.998 . . . . 2.41 113.694 175.537 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -53.63 -40.95 66.23 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.423 1.01 . . . . 3.3 111.795 173.138 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.38 -39.87 92.25 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.149 -0.932 . . . . 0.8 111.416 179.202 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 24.8 mm -61.58 -46.92 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 123.887 0.875 . . . . 0.91 110.967 -178.107 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -69.29 -37.48 77.85 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.036 0.446 . . . . 2.36 112.184 177.579 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 -64.61 -26.73 68.53 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 112.646 0.61 . . . . 3.63 112.646 176.706 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.55 -28.12 18.7 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.613 0.765 . . . . 2.45 113.02 179.616 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.42 -37.95 40.55 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.715 0.806 . . . . 2.98 112.663 164.11 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -63.89 -10.67 22.14 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 115.5 1.667 . . . . 2.99 115.5 173.681 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -131.46 6.54 4.45 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.86 1.43 . . . . 3.1 114.86 -173.069 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . 0.463 ' CD2' ' H ' ' B' ' 175' ' ' GLY . 8.2 t60 -156.99 114.92 3.2 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 116.121 1.897 . . . . 3.49 116.121 -158.459 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.35 6.74 9.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 128.328 2.651 . . . . 5.48 114.977 -170.137 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . 0.463 ' H ' ' CD2' ' B' ' 173' ' ' HIS . . . 92.04 10.94 60.66 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 125.689 1.614 . . . . 2.66 112.952 -166.395 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -76.03 67.56 2.39 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.301 1.84 . . . . 5.8 110.877 170.11 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 41.4 mm -52.7 133.65 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.431 1.092 . . . . 2.35 110.483 175.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.74 164.99 16.49 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.094 1.758 . . . . 1.74 110.678 -179.496 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -66.22 -43.21 87.34 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 122.171 0.986 . . . . 2.23 111.534 169.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.15 -25.56 67.09 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.815 2.446 . . . . 3.06 113.391 177.251 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -62.75 -59.68 4.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 118.76 0.709 . . . . 3.68 110.269 175.525 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -52.82 -49.03 66.48 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.612 -0.68 . . . . 2.05 110.653 178.327 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 21.0 t-105 -61.84 -48.48 80.38 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.447 0.536 . . . . 0.61 112.447 -177.185 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.5 t -70.72 -27.15 63.76 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.078 -0.963 . . . . 1.55 112.075 -179.279 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.507 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 53.2 mt -72.99 -38.98 66.43 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 116.895 -1.526 . . . . 0.64 112.656 171.775 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 25.9 mm -52.96 -42.66 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 CA-C-N 121.683 2.038 . . . . 0.6 111.579 178.775 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.65 -14.32 64.79 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.556 1.074 . . . . 0.65 114.688 177.305 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -79.27 -20.33 69.86 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 118.493 1.147 . . . . 0.75 112.916 176.289 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . 0.407 ' H ' HD12 ' B' ' 189' ' ' ILE . 0.4 OUTLIER -101.36 -40.78 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 CA-C-N 118.317 1.058 . . . . 1.1 110.046 167.019 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 14.0 m -79.17 86.74 4.94 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.606 1.562 . . . . 1.39 109.0 -178.724 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -164.21 -72.91 0.03 OUTLIER Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.39 1.472 . . . . 0.85 113.204 -174.491 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -62.4 -45.69 14.16 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.999 2.466 . . . . 1.01 111.913 178.902 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 21.0 pt -68.92 -17.7 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 113.889 1.07 . . . . 0.93 113.889 174.42 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -55.11 -56.23 22.24 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.216 1.371 . . . . 0.98 113.629 -178.849 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -60.81 -35.02 75.44 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.685 -1.259 . . . . 3.32 112.439 175.701 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 5.4 tt -61.48 -47.16 86.95 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.189 0.996 . . . . 1.4 110.249 178.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 45.9 mt -51.17 -59.83 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.386 1.074 . . . . 1.03 110.835 171.545 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -71.13 -18.28 62.52 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.423 0.897 . . . . 2.53 113.423 -174.264 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.328 5.0 pt-20 -85.39 -28.12 25.35 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.868 0.758 . . . . 2.82 112.462 173.262 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -80.02 -35.43 37.31 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.059 1.344 . . . . 2.84 114.579 174.407 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -72.6 8.75 1.31 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 123.527 1.632 . . . . 2.34 112.266 176.325 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -125.41 -67.64 0.88 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 126.661 1.985 . . . . 2.88 110.089 174.42 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 . . . . . 0 N--CA 1.48 1.064 0 C-N-CA 128.839 2.855 . . . . 4.52 115.349 171.53 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 114.489 1.292 . . . . 2.6 114.489 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 p -73.2 150.93 41.69 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.212 0.605 . . . . 1.17 110.362 -161.973 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -59.62 -34.19 72.45 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.59 1.086 . . . . 2.93 113.507 -176.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.62 -56.86 13.9 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.161 -0.681 . . . . 1.36 109.161 172.066 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -62.58 -61.36 2.48 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 124.13 0.972 . . . . 3.04 110.318 -172.132 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -20.93 66.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.035 0.534 . . . . 5.33 110.761 -172.597 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.458 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -75.13 -23.64 57.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 120.195 -1.566 . . . . 0.78 113.541 172.679 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.8 t -57.09 -32.76 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.674 1.579 . . . . 0.68 110.784 168.306 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.7 mt -56.08 -57.74 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 CA-C-N 118.661 0.664 . . . . 0.85 109.869 167.542 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.1 t -55.7 -39.72 56.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 125.301 1.44 . . . . 0.79 112.377 -178.483 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 mp -67.13 -24.32 65.9 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.676 1.19 . . . . 0.95 113.425 176.323 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.0 t -89.33 -45.9 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.824 0.738 . . . . 0.88 111.537 175.692 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -45.94 -55.76 6.35 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.215 1.406 . . . . 3.38 111.843 -178.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -47.5 -43.29 24.47 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.968 1.707 . . . . 3.1 114.515 178.705 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -81.83 -21.55 37.53 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.127 0.971 . . . . 2.16 113.209 -174.742 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -85.77 -32.06 22.03 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.154 -0.966 . . . . 2.2 112.454 165.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.8 tttp -50.39 -38.63 43.75 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.585 1.954 . . . . 4.26 113.843 178.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -85.5 8.95 17.26 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.321 1.449 . . . . 2.37 114.212 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.8 m . . . . . 0 N--CA 1.475 0.807 0 C-N-CA 125.541 1.536 . . . . 2.29 110.37 178.006 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.8 pt . . . . . 0 N--CA 1.477 0.896 0 N-CA-C 110.01 -0.367 . . . . 2.48 110.01 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.8 t -81.48 137.61 35.59 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.457 -1.402 . . . . 2.55 108.285 157.026 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -58.47 -32.5 68.81 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.917 -1.114 . . . . 2.25 110.986 170.219 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m -66.26 -18.68 65.5 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.849 1.659 . . . . 2.09 114.182 170.052 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 53.2 m -69.21 -41.94 76.4 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.742 1.61 . . . . 1.1 111.386 173.057 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -50.46 -50.42 52.41 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.664 1.186 . . . . 2.09 113.009 -171.459 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -59.7 -25.66 64.96 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.835 1.654 . . . . 3.99 113.757 178.586 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -98.96 -44.44 6.32 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 124.991 1.316 . . . . 2.76 111.851 -175.641 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 17.9 ptm -57.42 -32.43 66.86 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.66 -1.275 . . . . 2.85 111.848 169.514 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.3 mt -61.14 -14.1 22.4 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.388 1.625 . . . . 1.06 115.388 166.109 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -109.44 -5.35 15.82 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 120.322 1.419 . . . . 2.18 114.175 169.082 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.76 -74.72 0.5 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.74 1.155 . . . . 1.51 109.824 166.445 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -59.1 -34.52 72.1 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.555 1.142 . . . . 3.38 113.823 -177.284 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.18 9.47 34.12 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.243 1.572 . . . . 1.63 115.243 -173.583 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -48.16 -34.58 10.19 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.518 1.673 . . . . 1.34 115.518 -172.181 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.402 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 73.5 m-70 -62.01 -34.98 77.2 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.965 -1.085 . . . . 1.68 112.931 -177.333 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.9 tpp -85.0 -3.04 58.63 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.949 1.7 . . . . 1.95 112.871 -178.467 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.2 mp -96.61 112.32 24.12 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.182 1.393 . . . . 2.72 111.351 -178.813 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 t -75.56 62.96 1.47 Allowed 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.418 -0.801 . . . . 4.27 109.376 152.565 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.6 t70 38.29 -109.61 0.08 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.234 2.214 . . . . 7.15 111.802 -166.661 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.84 -14.44 36.92 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 126.481 1.913 . . . . 2.33 114.213 -173.896 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -63.85 -30.86 78.92 Favored Glycine 0 CA--C 1.533 1.166 0 CA-C-N 120.732 1.606 . . . . 3.16 111.175 168.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -78.46 -75.65 0.22 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.16 0.584 . . . . 3.63 110.464 157.793 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.0 ttp-105 -51.91 -28.75 17.39 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 117.837 2.532 . . . . 5.31 117.837 -161.816 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -53.69 -35.85 61.54 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 121.122 1.783 . . . . 3.64 112.684 170.311 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.33 -26.37 68.4 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.796 1.406 . . . . 1.18 114.796 172.888 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.33 -42.59 68.38 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.561 1.073 . . . . 0.88 111.366 171.224 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -68.31 -29.67 68.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.747 1.219 . . . . 1.97 112.991 -175.778 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -48.69 -40.05 26.8 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.013 0.911 . . . . 3.51 113.042 165.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.9 mt -78.55 -36.65 44.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.729 -1.123 . . . . 1.08 111.672 -176.596 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.9 mm -54.68 -53.69 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 122.99 0.516 . . . . 1.13 110.386 175.41 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -65.45 -34.42 78.25 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.284 0.846 . . . . 2.08 113.284 -179.508 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -62.59 -29.22 70.44 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.312 1.045 . . . . 2.63 112.584 176.201 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -88.56 -37.23 15.86 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.246 1.018 . . . . 2.71 111.669 170.865 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.84 -24.43 67.74 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.914 -1.116 . . . . 3.38 113.945 177.618 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.86 -11.99 21.9 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.927 1.455 . . . . 3.11 114.927 169.823 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -160.31 -17.89 0.06 Allowed 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 118.609 2.818 . . . . 2.91 118.609 -171.747 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -96.47 114.68 26.37 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 121.511 1.959 . . . . 4.36 111.149 175.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -63.54 -18.27 63.67 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.943 2.497 . . . . 4.05 115.631 -172.207 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 118.0 2.03 16.49 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.943 -0.921 . . . . 2.75 113.269 -160.736 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -66.18 145.49 55.73 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.726 1.263 . . . . 4.18 110.057 137.731 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 13.6 mt -128.33 149.57 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 127.227 2.211 . . . . 2.66 106.02 167.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.7 t -123.75 159.98 28.29 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 114.0 1.111 . . . . 1.47 114.0 -174.372 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -73.74 -30.56 62.89 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 120.49 -1.381 . . . . 2.36 113.647 -173.177 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -70.3 -25.61 63.41 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.169 1.388 . . . . 3.94 112.739 168.882 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.5 tt0 -58.01 -58.19 9.5 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.276 1.03 . . . . 3.35 111.33 -175.523 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -56.14 -46.86 79.09 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.963 -1.086 . . . . 2.23 112.403 -176.287 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.8 t-105 -61.46 -45.94 92.16 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.856 -0.592 . . . . 0.64 111.278 178.223 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -38.22 90.11 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.595 0.758 . . . . 1.58 111.61 178.504 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.2 mt -60.75 -46.05 91.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 118.269 -0.872 . . . . 0.77 111.754 174.782 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 31.0 mm -51.35 -40.56 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 CA-C-N 120.485 1.493 . . . . 0.7 112.872 -178.726 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.86 -16.81 57.35 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.079 0.847 . . . . 0.68 114.452 177.151 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.4 -19.61 76.19 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 121.124 -1.221 . . . . 0.89 113.358 172.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.8 mp -103.02 -48.67 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 118.695 1.248 . . . . 0.91 109.879 171.083 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.6 m -72.44 53.76 0.31 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.587 2.355 . . . . 1.34 110.077 163.634 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -127.46 -71.46 0.17 Allowed Glycine 0 CA--C 1.528 0.886 0 C-N-CA 128.422 2.915 . . . . 0.76 107.998 172.111 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.9 -52.3 0.7 Allowed 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.441 2.76 . . . . 0.97 113.484 175.844 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -72.29 -18.95 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 119.632 1.105 . . . . 1.11 113.716 -173.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -51.15 -59.63 3.98 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.191 1.397 . . . . 0.88 112.325 -178.522 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -56.09 -45.29 79.43 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.477 0.547 . . . . 2.64 112.477 175.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -56.97 -42.65 80.54 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 125.094 1.358 . . . . 1.27 111.286 -174.704 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.2 mt -54.95 -55.92 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.776 0.83 . . . . 1.64 110.756 176.374 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -63.43 -37.39 87.09 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.446 -0.784 . . . . 2.13 112.189 -179.568 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -66.37 -32.57 74.04 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.004 0.921 . . . . 3.05 110.932 177.117 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -69.97 -40.44 75.37 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 117.496 -1.24 . . . . 2.71 113.414 170.456 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -59.33 -41.5 89.29 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.2 1.364 . . . . 2.74 111.432 177.578 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.715 0 O-C-N 121.456 -0.778 . . . . 2.98 111.01 179.194 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.402 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 15.2 m-85 . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 112.501 0.556 . . . . 2.48 112.501 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 3.1 p -74.3 152.08 39.71 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.434 0.294 . . . . 1.2 111.059 -160.06 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -60.1 -21.96 62.16 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.218 1.192 . . . . 2.38 114.218 -177.61 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 tt -80.56 -48.04 13.31 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.767 0.827 . . . . 1.66 110.183 171.614 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -67.36 -58.48 4.7 Favored 'General case' 0 C--N 1.333 -0.131 0 C-N-CA 123.404 0.682 . . . . 2.92 111.036 -175.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -20.1 56.75 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.152 0.981 . . . . 4.89 112.072 -176.689 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.458 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.3 -34.33 74.52 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.321 -1.487 . . . . 0.61 113.425 170.183 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 58.6 t -58.02 -32.9 44.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.254 0.934 . . . . 0.62 110.905 175.703 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 44.0 mt -55.92 -57.66 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 109.079 -0.711 . . . . 1.0 109.079 168.735 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 72.3 t -60.74 -36.54 71.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 125.756 1.622 . . . . 0.79 112.932 -176.251 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.65 -38.57 84.02 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.641 -0.662 . . . . 1.0 112.135 175.121 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 60.2 t -76.32 -39.05 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-N 118.503 0.592 . . . . 0.78 110.955 178.464 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -51.93 -45.88 64.48 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.868 1.667 . . . . 2.8 111.36 175.562 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -58.97 -33.77 71.04 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.362 1.465 . . . . 3.33 114.405 175.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -80.82 -43.78 19.51 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.656 0.662 . . . . 2.05 112.311 -179.541 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -72.3 -27.31 62.37 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.406 -0.809 . . . . 2.16 112.654 176.452 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -42.2 -43.74 3.49 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.179 1.792 . . . . 3.34 114.128 171.432 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 -97.77 18.67 15.18 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.132 1.373 . . . . 2.45 113.732 -172.159 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 34.9 m . . . . . 0 N--CA 1.479 0.996 0 C-N-CA 126.152 1.781 . . . . 2.22 110.278 178.224 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 43.3 pt . . . . . 0 N--CA 1.482 1.135 0 N-CA-C 110.325 -0.25 . . . . 2.59 110.325 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 33.7 t -85.52 136.55 33.37 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.595 -1.316 . . . . 2.44 108.703 157.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 17.5 ttpt -59.47 -30.72 68.73 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.97 -1.081 . . . . 2.32 111.628 174.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 1.7 m -67.62 -18.59 65.02 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.918 1.687 . . . . 1.99 113.879 171.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.6 m -70.59 -40.78 73.05 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 120.29 1.405 . . . . 1.09 112.316 175.168 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.427 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 64.7 t80 -51.21 -53.55 34.04 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.646 1.179 . . . . 2.18 113.12 -173.409 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -54.75 -22.43 14.09 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.074 1.75 . . . . 4.21 114.076 178.254 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -106.46 -38.24 6.25 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.999 1.32 . . . . 3.26 113.064 -176.268 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -47.31 -43.16 22.4 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.778 1.231 . . . . 1.46 110.847 161.613 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 25.5 mt -63.26 -12.1 26.48 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 116.174 1.916 . . . . 1.31 116.174 171.578 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -113.98 -8.13 13.09 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.106 1.521 . . . . 2.38 115.106 167.672 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -76.41 0.44 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.363 0.983 . . . . 1.46 110.015 167.225 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -58.92 -36.3 74.52 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.525 1.511 . . . . 3.58 114.4 -178.856 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.25 9.5 43.26 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 115.359 1.614 . . . . 1.69 115.359 -174.35 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -47.17 -33.62 5.43 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.197 1.925 . . . . 1.39 116.197 -170.522 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -65.07 -35.38 80.98 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.942 1.246 . . . . 1.73 113.341 -175.5 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 18.3 tpp -78.99 -8.76 59.2 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.304 1.442 . . . . 1.93 113.142 -177.09 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.5 mp -92.34 114.43 26.98 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 120.58 -1.325 . . . . 2.72 112.522 -172.185 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 29.8 t -73.93 60.75 0.76 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 115.784 -0.644 . . . . 4.26 109.533 154.059 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 35.3 t70 36.86 -107.64 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.832 2.053 . . . . 6.77 112.007 -165.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.04 -17.92 26.91 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 126.805 2.042 . . . . 2.47 113.853 -174.189 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -62.55 -29.33 73.23 Favored Glycine 0 N--CA 1.473 1.164 0 CA-C-N 120.908 1.685 . . . . 3.24 111.259 169.614 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -81.18 -74.57 0.32 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.896 0.878 . . . . 3.34 110.95 160.492 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 25.8 ttp-105 -53.69 -27.86 30.29 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 117.67 2.47 . . . . 5.32 117.67 -164.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -54.12 -37.46 64.37 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 121.344 1.884 . . . . 3.66 112.454 171.905 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.63 -26.54 63.83 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.747 1.388 . . . . 1.18 114.747 172.329 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.44 -43.24 50.72 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.895 1.278 . . . . 0.9 111.37 174.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.64 -28.35 67.65 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.678 1.191 . . . . 1.89 112.354 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -50.24 -39.47 44.77 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 122.068 0.937 . . . . 3.29 112.923 165.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 9.5 mt -77.21 -35.49 55.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.755 -1.111 . . . . 1.03 111.819 -174.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 37.7 mm -56.09 -52.14 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 122.781 0.432 . . . . 1.0 110.208 176.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -65.42 -34.12 77.55 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.14 0.793 . . . . 2.04 113.14 -179.633 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -62.3 -29.25 70.3 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.05 0.94 . . . . 2.59 112.455 176.419 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -90.04 -34.76 15.83 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.513 1.125 . . . . 2.91 111.654 171.606 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.28 -22.4 66.94 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.517 -1.364 . . . . 3.42 114.135 175.319 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.34 -11.59 43.49 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.031 1.493 . . . . 3.01 115.031 168.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -162.05 -15.27 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.19 0 N-CA-C 119.097 2.999 . . . . 3.0 119.097 -170.648 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -101.23 116.2 32.26 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.986 2.175 . . . . 4.5 110.935 175.601 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -68.51 -11.5 59.94 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 128.406 2.682 . . . . 3.92 116.732 -166.546 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 110.89 0.15 28.72 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-O 118.694 -1.059 . . . . 2.75 113.283 -160.396 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -67.15 144.76 55.85 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 119.199 1.499 . . . . 4.33 109.612 136.916 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 13.3 mt -129.89 146.16 34.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 C-N-CA 126.666 1.986 . . . . 3.0 106.137 167.126 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.4 t -106.32 177.74 4.77 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.293 1.037 . . . . 1.52 113.658 -176.895 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -80.81 -48.94 11.73 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.029 -1.045 . . . . 2.0 111.954 171.53 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -64.35 -27.58 69.12 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.734 1.613 . . . . 3.71 112.451 176.726 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -54.4 -54.11 45.06 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.363 0.665 . . . . 3.33 110.938 173.62 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -62.61 -47.16 84.99 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.801 -1.187 . . . . 2.49 112.324 -175.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 49.0 t-105 -60.58 -46.99 88.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 119.182 -0.437 . . . . 0.6 111.228 178.236 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.99 -31.94 69.88 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.725 -0.655 . . . . 1.64 112.105 -178.469 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.427 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 28.2 mt -60.46 -47.86 84.27 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.129 0.877 . . . . 0.58 111.459 171.164 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.9 mm -53.15 -37.71 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 120.188 1.358 . . . . 0.81 112.592 179.27 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -59.42 -19.86 48.94 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 118.925 0.784 . . . . 0.67 113.898 175.216 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.33 -19.96 79.17 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-N 118.545 1.173 . . . . 0.87 113.846 173.239 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -106.06 -35.43 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.484 1.642 . . . . 1.04 110.977 173.495 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 40.7 m -72.75 65.35 0.7 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.537 1.935 . . . . 1.44 109.445 167.155 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -150.51 -78.87 0.02 OUTLIER Glycine 0 CA--C 1.529 0.929 0 C-N-CA 126.088 1.804 . . . . 0.9 111.329 -174.711 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -63.26 -46.51 9.79 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.129 2.553 . . . . 1.16 112.446 179.288 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 5.8 pt -75.93 -23.34 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 N-CA-C 113.447 0.906 . . . . 1.29 113.447 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -53.73 -56.67 15.36 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.475 1.11 . . . . 0.86 112.173 -173.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -57.62 -46.5 84.02 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.88 0.696 . . . . 2.88 112.88 174.61 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.4 tt -57.78 -40.35 79.62 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 125.351 1.461 . . . . 1.49 111.304 -173.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 20.1 mt -56.21 -57.81 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.269 1.028 . . . . 1.77 110.345 175.924 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -60.76 -36.83 79.93 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.522 -0.736 . . . . 2.12 112.088 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -67.33 -33.49 75.36 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.7 0.8 . . . . 3.01 110.766 177.688 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -68.72 -40.72 79.79 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.123 1.369 . . . . 2.8 113.019 171.873 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -61.23 -37.34 82.68 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 120.256 1.389 . . . . 2.67 111.644 178.396 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.44 -41.8 84.15 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.624 -0.672 . . . . 2.7 110.889 178.021 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 . . . . . 0 CA--C 1.541 0.617 0 CA-C-N 114.545 -1.207 . . . . 5.79 112.616 177.082 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 110.096 -0.335 . . . . 2.27 110.096 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.8 p -106.6 162.04 14.1 Favored 'General case' 0 N--CA 1.485 1.32 0 O-C-N 121.284 -0.885 . . . . 1.02 111.089 167.762 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -70.27 -23.37 62.87 Favored 'General case' 0 C--O 1.22 -0.458 0 O-C-N 121.47 -0.769 . . . . 2.91 112.98 172.876 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -40.79 97.76 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.903 1.683 . . . . 0.92 108.788 172.374 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -67.98 -63.85 0.98 Allowed 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 125.151 1.38 . . . . 2.6 111.641 178.016 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -50.81 -27.75 7.94 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.012 1.733 . . . . 5.63 114.05 170.827 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.708 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -70.34 -45.08 66.87 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 119.938 -1.726 . . . . 0.72 113.204 167.789 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 67.3 t -59.24 -32.81 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-N 121.046 1.748 . . . . 0.77 110.86 170.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.6 mt -59.0 -60.14 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.362 -1.304 . . . . 0.78 110.503 165.086 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.5 t -56.08 -33.9 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 126.218 1.807 . . . . 0.63 113.056 -176.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.75 -39.56 91.2 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.32 -0.863 . . . . 1.07 111.605 171.068 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 71.1 t -73.23 -40.35 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.657 1.183 . . . . 0.8 111.545 174.198 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -54.85 -46.01 74.61 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.184 1.356 . . . . 5.67 109.977 171.426 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -76.41 -24.05 54.04 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.143 1.164 . . . . 2.04 114.143 -177.193 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -75.32 -45.75 37.63 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.144 -1.598 . . . . 2.57 110.921 167.62 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -71.52 -21.17 61.95 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.718 1.007 . . . . 2.82 113.718 -172.795 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -48.64 -20.08 0.42 Allowed 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 114.512 1.301 . . . . 3.84 114.512 169.172 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -100.56 -6.23 25.66 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.935 1.694 . . . . 2.92 115.336 -179.364 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.481 1.105 0 CA-C-N 119.804 1.184 . . . . 2.97 111.93 -175.316 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 12.1 pt . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 112.063 0.394 . . . . 2.81 112.063 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.5 m -121.71 135.66 54.95 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.2 -0.938 . . . . 2.65 111.037 -179.728 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -62.8 -32.73 73.97 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.078 -1.014 . . . . 2.58 111.947 -178.771 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 m -57.34 -19.42 22.58 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.418 1.887 . . . . 2.38 115.109 169.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.7 m -82.81 -30.18 28.98 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.177 0.899 . . . . 1.52 112.905 178.119 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.464 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 36.6 t80 -57.22 -47.88 80.21 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.533 1.515 . . . . 2.07 112.317 -176.831 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -57.8 -23.09 50.84 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.086 1.354 . . . . 2.32 114.215 174.435 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -100.18 -37.18 9.04 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.264 1.425 . . . . 3.24 112.259 -175.474 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 3.5 ttm -48.32 -44.76 34.4 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.355 -1.466 . . . . 1.28 110.283 157.539 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.447 HD11 ' CE1' ' A' ' 38' ' ' PHE . 26.3 mt -64.82 -33.33 75.74 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 114.827 1.417 . . . . 1.07 114.827 175.656 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -87.68 -11.55 48.02 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 120.358 1.436 . . . . 2.4 114.028 -178.769 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.89 -64.2 1.08 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 126.388 1.875 . . . . 2.69 111.691 173.514 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -74.52 -22.56 58.98 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 118.099 -0.953 . . . . 3.79 113.489 -173.377 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 24.2 mt -113.63 31.82 6.24 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.73 1.212 . . . . 2.13 112.707 165.771 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -55.69 -31.1 62.14 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.348 -1.47 . . . . 1.6 114.247 -175.404 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -78.55 -49.45 13.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.666 0.786 . . . . 1.58 109.893 -168.703 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.4 mtm -79.35 -18.68 51.97 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.939 1.088 . . . . 2.29 113.939 174.842 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mp -65.25 -48.99 71.35 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 120.208 1.367 . . . . 2.97 110.355 161.45 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.6 m 73.81 -40.71 0.47 Allowed 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.684 1.994 . . . . 4.35 114.623 168.427 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -157.47 161.49 38.88 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 123.845 1.783 . . . . 4.2 112.614 -179.031 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -33.05 -44.77 0.12 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 130.605 3.562 . . . . 2.59 114.445 163.194 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -67.46 -47.22 64.08 Favored Glycine 0 N--CA 1.468 0.777 0 C-N-CA 124.657 1.122 . . . . 2.18 112.469 -174.943 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -65.22 -38.93 91.97 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 117.58 0.69 . . . . 2.73 111.334 173.26 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.7 ttt-85 -58.28 -24.35 59.2 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.981 -1.074 . . . . 4.68 113.392 177.77 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -57.16 -35.65 69.8 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.793 -1.192 . . . . 3.41 112.927 170.648 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.42 -14.66 63.16 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.524 1.305 . . . . 1.24 114.524 176.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.66 -54.14 4.91 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.698 1.199 . . . . 0.99 111.872 165.288 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.14 -32.15 73.61 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.167 0.587 . . . . 2.02 112.402 -176.498 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -57.21 -30.14 64.3 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.223 -0.923 . . . . 2.67 112.905 172.746 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.6 mt -75.41 -37.24 60.57 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.857 -0.527 . . . . 1.1 111.517 177.254 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.9 mm -56.54 -50.54 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 123.378 0.671 . . . . 1.16 110.495 -177.764 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -64.28 -41.78 96.73 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.364 1.066 . . . . 1.97 112.969 179.039 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -59.5 -32.5 70.35 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.107 1.363 . . . . 2.32 112.6 174.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.42 -31.29 20.13 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.792 1.237 . . . . 2.29 110.961 175.601 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.18 -35.3 79.85 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.702 1.601 . . . . 3.83 114.528 -177.55 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.39 -10.6 3.31 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 114.432 1.271 . . . . 2.91 114.432 171.357 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -131.14 -10.91 3.73 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.98 1.844 . . . . 3.31 115.98 -167.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.84 134.89 11.11 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 121.803 2.092 . . . . 3.67 114.674 -160.049 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -74.41 12.65 0.72 Allowed 'General case' 0 N--CA 1.479 0.976 0 O-C-N 120.172 -1.58 . . . . 4.87 112.817 167.974 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.84 49.8 16.13 Favored Glycine 0 C--N 1.339 0.706 0 C-N-CA 124.474 1.035 . . . . 4.58 111.07 -172.5 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.1 mmt85 -65.88 85.25 0.08 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 105.65 -1.982 . . . . 6.08 105.65 159.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 9.3 mm -69.85 86.91 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 108.384 -0.969 . . . . 2.85 108.384 -173.021 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.4 m -66.61 159.26 27.9 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.141 0.976 . . . . 2.28 110.315 171.776 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -51.76 -42.87 62.7 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 122.276 1.036 . . . . 2.65 110.873 171.939 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -74.98 -20.22 59.76 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 131.288 3.835 . . . . 3.62 114.872 173.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -68.27 -55.04 13.56 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 122.003 2.183 . . . . 3.79 107.243 167.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -57.92 -52.45 65.43 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.049 -1.032 . . . . 1.71 112.712 176.657 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -64.25 -41.24 97.05 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.266 -0.897 . . . . 0.85 113.065 -176.697 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.59 -37.37 73.9 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.19 0.904 . . . . 1.86 111.054 177.652 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.464 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 64.6 mt -66.03 -40.32 90.95 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 117.947 -1.025 . . . . 0.9 112.289 177.325 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 36.7 mm -56.46 -34.27 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-N 121.417 1.917 . . . . 0.73 112.303 177.502 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -73.81 -1.88 59.84 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.247 1.403 . . . . 1.15 114.917 176.178 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.72 -28.21 19.58 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-N 118.715 1.257 . . . . 0.67 114.211 173.086 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.504 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.5 OUTLIER -93.68 -40.23 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-N 118.417 1.109 . . . . 0.94 110.104 172.724 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 11.5 m -75.65 124.58 27.48 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.357 1.463 . . . . 1.72 108.415 176.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 139.25 -70.66 0.46 Allowed Glycine 0 N--CA 1.472 1.047 0 CA-C-O 117.918 -1.49 . . . . 1.08 113.21 -176.023 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -59.87 -45.58 23.88 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.021 2.481 . . . . 1.04 111.677 178.276 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -84.97 -5.46 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 113.403 0.89 . . . . 1.3 113.403 175.225 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.05 81.9 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.815 1.188 . . . . 1.06 112.711 -174.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -65.91 -36.62 83.9 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.106 -0.996 . . . . 3.58 113.564 174.131 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -60.5 -38.64 84.96 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 117.87 -1.062 . . . . 1.83 110.385 177.061 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.7 mt -49.25 -65.52 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 123.63 0.772 . . . . 1.38 111.133 170.247 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -61.72 -33.59 74.29 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.903 -0.498 . . . . 2.37 111.994 -175.115 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.308 2.8 pt-20 -86.97 -9.91 54.46 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 119.029 -0.51 . . . . 3.23 112.244 -176.048 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -78.05 -36.11 48.79 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.025 1.73 . . . . 3.03 113.16 163.525 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -71.08 8.11 1.04 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 124.026 1.869 . . . . 2.45 112.208 174.326 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 . . . . . 0 C--N 1.324 -0.538 0 C-N-CA 127.007 2.123 . . . . 3.0 109.515 176.501 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.522 0.201 . . . . 2.35 110.49 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.2 p -104.93 158.44 16.54 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.968 0.907 . . . . 1.05 110.662 169.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -68.54 -25.27 64.84 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 118.945 0.793 . . . . 3.15 112.366 175.544 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.03 -40.9 99.12 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 120.48 1.491 . . . . 0.76 108.895 172.784 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -67.58 -63.04 1.14 Allowed 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.788 1.235 . . . . 2.62 111.781 177.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 36.7 tptt -49.9 -28.97 7.35 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 121.022 1.737 . . . . 6.4 114.104 169.472 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.708 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.41 -46.46 66.81 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 119.69 -1.881 . . . . 0.8 113.237 167.536 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 85.9 t -56.9 -33.95 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 CA-C-N 121.626 2.012 . . . . 0.88 110.868 170.37 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 17.7 mt -59.01 -61.08 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-O 117.684 -1.151 . . . . 0.88 110.91 166.111 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 10.6 t -55.75 -35.83 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 126.444 1.898 . . . . 0.75 112.519 -176.088 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.2 mp -63.35 -36.71 84.59 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.441 -0.787 . . . . 1.1 111.323 173.088 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.8 t -80.3 -37.95 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 125.344 1.458 . . . . 1.02 111.768 176.083 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -53.4 -45.85 69.47 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.104 1.32 . . . . 5.56 110.399 169.634 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -72.36 -18.24 61.77 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.088 1.144 . . . . 2.01 114.088 -178.624 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -80.71 -48.13 13.0 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 120.338 -1.476 . . . . 2.16 111.146 167.26 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -71.34 -20.76 62.13 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.262 0.838 . . . . 2.49 113.262 -167.497 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -46.73 -19.71 0.1 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.49 1.516 . . . . 3.79 114.504 164.169 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -107.52 5.73 27.39 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.384 1.874 . . . . 2.8 115.429 -178.513 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.48 1.026 0 CA-C-N 119.972 1.26 . . . . 2.34 111.291 179.287 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 9.7 pt . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 113.058 0.762 . . . . 3.11 113.058 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 42.8 t -135.56 132.99 37.88 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.83 1.652 . . . . 2.93 109.384 175.303 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -62.12 -18.38 60.67 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.217 1.007 . . . . 2.23 112.999 177.352 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.4 m -70.69 -17.99 62.83 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.797 1.639 . . . . 2.36 114.333 170.298 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 9.1 m -89.9 -19.51 24.48 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.957 1.095 . . . . 2.33 113.957 177.556 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.459 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 59.5 t80 -53.89 -52.55 60.14 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 120.888 1.676 . . . . 2.26 111.072 177.811 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 33.8 ptt180 -57.48 -24.65 57.05 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.722 1.609 . . . . 2.37 114.468 174.283 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -100.95 -38.36 8.24 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.931 1.692 . . . . 3.53 111.722 -168.813 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 6.3 tmm? -47.88 -43.93 29.04 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.393 -1.442 . . . . 1.18 110.969 152.726 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . 0.448 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 93.9 mt -74.34 -24.75 59.24 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.769 1.396 . . . . 1.17 114.769 178.095 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -83.64 -16.82 43.72 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.827 1.649 . . . . 2.71 113.518 173.579 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -100.84 -63.61 1.12 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.928 1.691 . . . . 2.72 113.131 176.066 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -74.66 -17.08 60.74 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 119.434 1.015 . . . . 3.73 113.552 -173.252 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 46.0 mt -117.2 30.55 7.25 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.827 1.651 . . . . 2.01 112.441 165.447 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -57.25 -28.72 63.19 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.231 -1.543 . . . . 1.66 113.525 -176.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -76.95 -51.59 10.91 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.446 -0.784 . . . . 1.62 109.374 -168.819 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 24.4 mtm -76.65 -17.32 59.22 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.943 1.09 . . . . 2.36 113.943 174.391 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.3 mp -66.7 -51.14 59.43 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.172 1.351 . . . . 2.96 110.396 162.315 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 14.2 m 73.63 -48.92 0.68 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.754 2.022 . . . . 4.4 113.733 171.436 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -145.01 162.75 36.16 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 123.884 1.802 . . . . 4.43 113.409 175.69 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -32.79 -42.88 0.08 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 131.094 3.758 . . . . 2.81 114.32 161.064 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -66.82 -34.1 86.19 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 124.399 1.0 . . . . 2.26 113.336 -179.198 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -76.98 -41.83 41.38 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 117.818 0.809 . . . . 2.69 111.068 172.708 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 10.2 ttt180 -51.15 -30.1 15.65 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 120.604 -1.31 . . . . 4.94 114.017 174.156 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -50.86 -37.54 43.93 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.633 -1.292 . . . . 3.9 112.5 173.014 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -71.78 -14.24 61.93 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 114.979 1.474 . . . . 1.36 114.979 178.451 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.06 -52.73 6.06 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.374 0.988 . . . . 0.97 111.214 163.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -30.81 70.9 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.508 0.723 . . . . 1.96 111.858 -172.501 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -54.06 -33.01 56.34 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.297 -0.877 . . . . 2.71 112.875 169.579 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 18.0 mt -77.21 -36.26 54.93 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 121.733 -0.604 . . . . 1.04 111.339 -177.721 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 40.8 mm -55.51 -55.84 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 124.079 0.952 . . . . 1.18 109.486 177.864 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -62.3 -34.99 77.66 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.183 0.808 . . . . 2.06 113.183 -178.19 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -38.61 91.5 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.045 1.338 . . . . 2.7 113.044 172.975 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.43 -35.89 18.02 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.431 1.093 . . . . 2.34 110.674 -175.345 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -55.95 -40.75 73.65 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.85 1.26 . . . . 3.23 114.33 -175.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.61 -11.57 5.1 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 114.833 1.419 . . . . 2.27 114.833 173.212 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -130.04 3.99 4.85 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.734 1.383 . . . . 3.03 114.734 -168.91 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -152.14 102.52 2.8 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.216 -1.552 . . . . 3.31 111.707 -167.882 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -78.8 69.59 5.0 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.707 2.003 . . . . 3.81 112.952 -167.163 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 78.45 -11.43 24.97 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.946 1.736 . . . . 4.07 114.588 175.066 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.51 162.84 3.51 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.231 1.812 . . . . 6.03 111.297 176.631 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 17.8 mm -133.49 129.5 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.773 1.629 . . . . 3.36 106.671 164.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.7 m -127.92 157.38 40.71 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.09 1.356 . . . . 3.36 112.856 -170.033 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -68.35 -46.49 70.01 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.266 -0.897 . . . . 2.49 113.176 -171.562 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -73.65 -35.18 65.23 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.59 2.356 . . . . 3.8 111.739 178.087 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -55.55 -58.55 7.32 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.361 1.064 . . . . 3.06 110.272 167.258 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -49.6 -51.03 40.26 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.569 -0.707 . . . . 2.22 111.565 177.112 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 40.0 t-105 -66.88 -46.42 75.0 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.621 -0.674 . . . . 0.94 112.775 -177.767 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -69.04 -35.23 76.36 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.177 0.991 . . . . 1.84 111.27 -176.267 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.459 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 87.1 mt -64.05 -37.87 89.0 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 118.152 -0.928 . . . . 0.8 112.194 173.594 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 41.6 mm -57.08 -35.75 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 121.425 1.921 . . . . 0.73 111.953 174.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -72.17 1.12 35.4 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 124.974 1.273 . . . . 1.13 114.48 174.46 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -96.81 -30.27 7.65 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.289 1.424 . . . . 0.72 114.654 173.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . 0.459 ' H ' HD12 ' B' ' 189' ' ' ILE . 0.6 OUTLIER -87.51 -44.23 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 118.925 1.363 . . . . 0.93 109.777 170.289 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.72 145.0 45.5 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.977 1.311 . . . . 2.11 108.861 175.497 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . 122.55 -72.61 0.39 Allowed Glycine 0 CA--C 1.531 1.039 0 CA-C-O 117.791 -1.561 . . . . 1.21 112.074 -176.395 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -62.19 -45.02 16.85 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.621 2.214 . . . . 1.01 111.524 179.935 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.5 pp -82.8 -5.83 9.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 113.397 0.888 . . . . 1.27 113.397 174.257 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.16 -35.63 79.36 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.697 1.135 . . . . 1.16 112.99 -175.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -65.19 -36.46 84.26 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 113.46 0.911 . . . . 4.11 113.46 175.763 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.2 tt -61.8 -39.07 90.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.914 -1.041 . . . . 2.25 110.408 177.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 32.6 mt -49.21 -65.54 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-O 121.632 0.729 . . . . 1.58 111.231 171.56 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 64.9 t60 -63.13 -33.31 75.18 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.827 -0.545 . . . . 2.64 111.467 -174.541 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.297 2.9 pt-20 -85.88 -10.04 55.98 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.523 0.564 . . . . 3.35 112.523 -176.355 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.67 -36.37 51.41 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 126.197 1.799 . . . . 3.19 113.278 164.408 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.09 7.6 1.19 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 126.673 1.989 . . . . 2.59 112.064 174.215 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -128.92 -66.94 0.8 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 127.005 2.122 . . . . 3.18 109.319 176.209 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 . . . . . 0 N--CA 1.478 0.948 0 C-N-CA 130.572 3.549 . . . . 5.46 115.379 177.862 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 112.902 0.705 . . . . 2.73 112.902 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 56.3 p -76.11 167.43 21.87 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.767 0.827 . . . . 1.29 111.759 -165.588 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -55.5 -49.82 71.56 Favored 'General case' 0 C--O 1.217 -0.651 0 CA-C-O 117.833 -1.08 . . . . 3.0 109.877 168.536 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.01 -48.74 61.37 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.44 1.018 . . . . 1.01 110.538 178.494 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -68.39 -58.74 3.89 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 118.455 -0.784 . . . . 3.42 111.252 -178.362 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -52.74 -27.49 17.93 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 120.194 1.361 . . . . 6.06 112.751 173.333 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.846 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -75.29 -41.76 56.32 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 120.586 -1.321 . . . . 0.6 112.702 172.949 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -56.08 -47.05 80.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 CA-C-N 120.503 1.502 . . . . 0.59 109.877 165.844 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.1 mt -53.08 -47.48 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.438 1.095 . . . . 0.87 111.007 171.564 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.6 t -68.72 -33.73 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 120.099 1.318 . . . . 0.7 113.055 178.329 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.84 -35.64 77.19 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.266 -1.521 . . . . 0.95 110.836 171.707 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 t -69.3 -39.44 79.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 125.517 1.527 . . . . 0.61 110.999 174.138 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -62.2 -51.25 68.54 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.956 0.902 . . . . 3.17 110.552 169.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.519 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 2.8 t30 -61.1 -18.37 57.59 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.104 1.15 . . . . 2.2 114.104 -179.5 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -80.82 -68.47 0.68 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.402 0.681 . . . . 1.96 111.974 162.949 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -64.23 -25.96 68.3 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.873 1.064 . . . . 1.77 113.873 -163.659 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.519 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 7.4 ptmt -51.54 -26.34 8.39 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 120.054 1.297 . . . . 2.2 113.056 172.282 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -98.53 5.19 48.11 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.373 1.469 . . . . 2.11 114.907 -175.763 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 18.0 m . . . . . 0 N--CA 1.48 1.057 0 C-N-CA 124.374 1.069 . . . . 2.25 110.217 172.131 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 18.5 pt . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 113.702 1.001 . . . . 3.49 113.702 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.4 m -76.28 139.82 41.27 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.198 -0.939 . . . . 2.58 110.109 162.909 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -50.71 -28.63 9.44 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.318 1.447 . . . . 2.93 114.405 -178.033 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.1 p -60.17 -21.93 62.28 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.952 1.464 . . . . 1.98 114.952 172.937 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 62.1 m -71.85 -49.62 36.7 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 118.539 -0.743 . . . . 1.66 112.377 176.082 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -49.52 -52.48 29.34 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.611 1.165 . . . . 2.14 112.107 -178.027 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -57.54 -12.43 2.72 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.007 1.114 . . . . 2.45 114.007 178.708 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -116.9 -23.38 8.08 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 114.841 1.423 . . . . 4.89 114.841 174.284 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -53.37 -39.23 64.04 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 120.197 1.362 . . . . 1.44 110.47 158.723 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 mt -59.72 -22.89 62.66 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 114.317 1.229 . . . . 1.33 114.317 169.426 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -98.26 -16.27 19.48 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.88 1.272 . . . . 3.35 113.056 -179.231 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -97.66 -70.76 0.71 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.817 0.847 . . . . 1.96 110.721 169.324 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -62.19 -34.38 76.33 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.815 1.189 . . . . 3.65 113.347 -177.109 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.8 19.38 20.56 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 114.33 1.233 . . . . 1.81 114.33 -178.939 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -51.46 -34.26 34.58 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 115.057 1.503 . . . . 1.45 115.057 -171.823 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.533 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 9.0 m-70 -57.68 -27.64 63.08 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.834 2.054 . . . . 1.66 113.988 -175.879 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 28.2 tpp -107.93 1.35 22.57 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.578 1.551 . . . . 2.16 113.433 -169.21 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.1 mp -70.38 168.23 16.49 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.96 1.304 . . . . 2.88 112.004 175.11 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -164.34 102.28 0.84 Allowed 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.02 -1.675 . . . . 3.9 108.96 -168.535 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.6 t70 53.84 -166.83 0.08 Allowed 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 122.285 1.04 . . . . 4.5 110.648 -160.587 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.6 p -71.91 -27.65 62.97 Favored 'General case' 0 CA--C 1.518 -0.269 0 O-C-N 120.381 -1.449 . . . . 2.89 112.653 154.226 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.02 -42.12 53.85 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 124.617 1.104 . . . . 1.86 112.817 -175.289 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -55.25 -55.69 28.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.464 1.106 . . . . 3.22 111.62 169.167 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -55.65 -47.72 76.2 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.522 1.055 . . . . 5.0 112.391 178.34 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -63.39 -19.12 64.39 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 120.758 -1.214 . . . . 3.33 113.66 -175.114 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.14 -38.87 74.14 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.17 0.896 . . . . 1.77 112.023 166.522 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.15 99.58 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.594 0.758 . . . . 0.94 112.093 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.73 -30.72 70.15 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.742 1.217 . . . . 2.79 113.792 175.317 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.2 mtmt -61.96 -34.82 76.82 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.851 -1.156 . . . . 3.9 111.762 170.714 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.0 mt -70.93 -40.04 72.32 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.466 0.706 . . . . 0.9 111.954 175.368 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.8 mm -52.16 -53.28 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.55 0.74 . . . . 0.94 110.612 177.933 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -71.35 -38.32 71.63 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 124.65 1.219 . . . . 2.21 112.679 -176.753 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.4 t30 -54.83 -35.88 64.42 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.533 0.682 . . . . 2.6 111.629 168.402 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.4 tp -86.23 -19.82 29.42 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 120.826 -1.171 . . . . 2.4 113.319 -178.287 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -62.18 -22.7 66.11 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.281 0.845 . . . . 3.04 113.281 173.508 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.18 -6.24 41.39 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 114.506 1.299 . . . . 2.67 114.506 168.285 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -139.99 14.63 2.46 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 125.152 1.381 . . . . 2.65 114.416 -168.313 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -128.35 88.56 2.77 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.471 -1.393 . . . . 6.12 113.13 -163.226 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -67.84 32.35 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 128.049 2.54 . . . . 5.84 114.623 178.643 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.49 -8.44 9.99 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 126.085 1.802 . . . . 2.5 115.6 175.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.0 mmt-85 -78.84 -170.59 2.22 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.898 1.349 . . . . 6.59 111.085 168.359 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.8 mm -137.7 135.75 45.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 104.872 -2.269 . . . . 2.46 104.872 164.597 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.2 m -96.94 167.12 11.27 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.927 0.891 . . . . 1.92 110.403 165.62 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -66.08 -58.75 4.78 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 120.655 -1.278 . . . . 2.08 111.74 -178.883 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -69.3 -14.62 63.04 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.682 1.593 . . . . 2.64 112.848 -173.586 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -53.69 -54.12 42.33 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.59 1.556 . . . . 3.22 111.028 171.147 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -65.09 -42.37 94.1 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.086 -1.634 . . . . 3.07 112.819 175.316 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.6 t-105 -60.79 -43.67 97.8 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.756 -0.59 . . . . 0.61 111.305 -179.021 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.5 t -73.57 -26.98 61.08 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 117.306 -1.331 . . . . 1.74 111.939 176.91 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 22.2 mt -65.69 -43.0 90.57 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 120.39 1.45 . . . . 0.7 112.582 169.568 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 38.0 mm -52.48 -36.47 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-N 120.801 1.637 . . . . 0.65 112.018 176.066 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.24 -29.51 68.85 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-O 119.07 -0.85 . . . . 0.69 113.573 175.185 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.09 -26.84 65.49 Favored Glycine 0 CA--C 1.534 1.25 0 CA-C-N 119.182 1.491 . . . . 0.57 114.427 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -92.85 -35.6 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 CA-C-N 119.351 1.576 . . . . 0.83 111.162 169.737 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.4 m -72.08 -37.46 69.59 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.194 1.398 . . . . 2.77 112.652 -177.598 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.84 -47.09 66.56 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 125.412 1.482 . . . . 1.11 114.877 -177.543 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.74 -42.5 6.62 Favored 'Trans proline' 0 C--N 1.352 0.757 0 CA-C-N 120.976 2.388 . . . . 1.33 112.898 174.307 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.5 pt -84.58 -31.3 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 115.193 1.553 . . . . 1.17 115.193 -171.28 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.25 71.12 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 120.13 1.332 . . . . 1.24 113.579 -168.43 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -62.59 -23.38 67.0 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.403 0.89 . . . . 6.21 113.403 175.578 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.61 -30.75 24.7 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.919 1.288 . . . . 2.04 111.073 174.033 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.5 mt -51.68 -55.53 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.328 0.967 . . . . 1.11 111.004 174.27 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -52.69 -41.43 63.88 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.664 1.12 . . . . 3.91 113.495 178.1 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -72.64 -8.36 54.91 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.014 0.925 . . . . 4.74 112.488 -179.13 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -97.71 -35.01 10.7 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.594 1.958 . . . . 2.97 112.941 165.195 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -62.37 -5.33 2.37 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 120.358 1.435 . . . . 2.42 112.586 163.97 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 . . . . . 0 C--N 1.331 -0.232 0 C-N-CA 125.894 1.678 . . . . 2.4 111.039 171.927 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 113.514 0.931 . . . . 2.34 113.514 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 71.7 p -83.64 155.0 23.41 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.194 0.998 . . . . 1.27 111.191 -177.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -53.69 -33.17 54.57 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.712 1.005 . . . . 2.46 113.712 178.894 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.82 -47.41 69.13 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.005 0.522 . . . . 1.68 111.083 177.427 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -72.02 -52.7 15.71 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.53 -0.544 . . . . 3.01 109.53 -177.211 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.6 tmtt? -54.0 -29.62 44.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.193 0.997 . . . . 5.11 111.899 174.465 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.846 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -70.01 -32.79 71.14 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 119.697 -1.877 . . . . 0.58 113.687 171.489 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 48.8 t -55.01 -43.5 69.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 120.613 1.551 . . . . 1.05 109.673 174.195 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 48.2 mt -51.24 -55.49 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.197 0.599 . . . . 1.18 110.32 171.924 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.53 -40.13 88.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 123.908 0.883 . . . . 0.61 113.084 -177.11 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.3 -31.12 70.34 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.077 -1.014 . . . . 1.36 111.541 176.752 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 41.5 t -73.56 -42.68 55.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.928 1.691 . . . . 0.78 111.241 172.544 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . 0.444 ' CD ' ' HZ2' ' B' ' 124' ' ' LYS . 14.5 tm-20 -57.07 -50.48 72.64 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.606 1.162 . . . . 3.55 111.66 173.939 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . 0.506 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 3.0 t30 -65.9 -10.77 41.61 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 114.162 1.171 . . . . 2.51 114.162 -173.838 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -87.82 -63.91 1.23 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.386 1.474 . . . . 1.97 112.146 164.418 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -61.23 -29.94 70.14 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.693 0.997 . . . . 1.73 113.693 -165.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . 0.506 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 8.4 ptmt -50.67 -26.9 6.0 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 119.43 1.013 . . . . 1.95 113.508 173.697 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -93.35 5.57 51.11 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.23 1.812 . . . . 2.06 114.726 -179.517 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 13.2 m . . . . . 0 N--CA 1.482 1.134 0 CA-C-N 119.97 1.259 . . . . 2.17 110.971 173.977 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 14.4 pt . . . . . 0 N--CA 1.483 1.177 0 N-CA-C 114.14 1.163 . . . . 3.66 114.14 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 73.5 m -74.63 139.7 43.79 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.378 -0.826 . . . . 2.6 110.934 163.831 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -51.79 -24.78 6.44 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.59 1.556 . . . . 2.92 114.736 -174.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 62.1 p -58.19 -23.65 56.32 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.735 1.383 . . . . 2.09 114.735 171.649 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 61.1 m -74.35 -46.15 42.54 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.256 0.935 . . . . 1.69 113.002 -179.407 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -53.23 -52.47 58.83 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.784 1.175 . . . . 2.07 112.263 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -57.37 -10.65 1.45 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.714 1.005 . . . . 2.52 113.714 177.535 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -117.83 -27.6 6.17 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 120.182 1.355 . . . . 4.31 114.387 177.584 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.7 tmm? -53.01 -35.83 59.83 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 119.704 1.138 . . . . 1.39 111.375 161.732 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.29 -26.59 68.49 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.053 1.131 . . . . 1.46 114.053 170.307 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -92.14 -24.17 19.18 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 121.208 -0.932 . . . . 3.0 112.951 179.494 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.72 -67.37 0.83 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.17 0.895 . . . . 1.49 111.573 172.261 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -69.06 -29.17 67.24 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.378 1.251 . . . . 3.53 114.378 -175.551 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.59 19.36 19.32 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.064 1.346 . . . . 1.71 113.762 -179.693 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -45.07 -38.31 4.89 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 117.647 2.462 . . . . 1.65 117.647 -165.467 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . 0.487 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 0.0 OUTLIER -61.92 -28.57 69.62 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.118 2.167 . . . . 2.29 113.342 -178.407 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 40.6 tpp -77.94 -4.75 48.46 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.119 1.768 . . . . 1.91 113.776 -174.11 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.79 177.21 7.07 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.136 1.375 . . . . 3.06 112.95 -175.385 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 6.4 m -176.76 110.47 0.08 Allowed 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.567 2.347 . . . . 3.79 107.956 -176.668 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . 0.474 ' CB ' ' H ' ' B' ' 157' ' ' GLY . 21.1 t0 48.39 -175.57 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.299 0 CA-C-O 123.844 1.783 . . . . 4.96 109.992 -147.597 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 65.4 p -56.9 -14.88 3.9 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 120.097 -1.627 . . . . 3.74 112.836 142.144 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . 0.474 ' H ' ' CB ' ' B' ' 155' ' ' ASP . . . -51.92 -38.43 46.35 Favored Glycine 0 N--CA 1.476 1.324 0 C-N-CA 126.906 2.193 . . . . 2.09 113.547 -177.179 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -62.8 -58.85 5.98 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.89 1.276 . . . . 3.23 111.547 169.283 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -50.85 -43.79 59.37 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.698 1.599 . . . . 5.04 114.561 174.597 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . 0.454 ' HE2' ' HA2' ' B' ' 157' ' ' GLY . 34.1 mtmt -60.22 -19.01 52.56 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.681 1.992 . . . . 4.62 115.281 178.745 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -66.33 -41.42 89.64 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.392 1.077 . . . . 1.71 112.041 167.777 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -61.25 -40.56 94.5 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.106 0.962 . . . . 0.9 111.159 176.503 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -56.88 -39.71 74.87 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.73 1.212 . . . . 2.21 113.054 173.775 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -59.53 -34.25 72.4 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.332 -0.855 . . . . 3.94 111.962 174.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 8.8 mt -69.8 -42.99 73.01 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 118.656 -0.688 . . . . 0.85 112.03 174.07 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 35.3 mm -50.04 -53.86 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.889 0.768 . . . . 0.87 110.391 177.47 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -71.1 -38.22 72.38 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.059 1.344 . . . . 2.23 112.961 -176.313 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -54.02 -33.86 58.37 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.559 0.695 . . . . 2.61 111.862 167.462 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 9.2 tp -93.59 -14.21 26.78 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 120.63 -1.294 . . . . 2.26 113.964 -179.439 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -65.02 -16.59 63.62 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.573 0.749 . . . . 3.1 112.978 171.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.23 -6.92 58.66 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.464 1.283 . . . . 2.48 114.464 165.086 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -142.97 27.56 1.62 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.182 1.393 . . . . 2.67 114.294 -164.93 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -143.56 93.81 2.52 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 120.049 -1.657 . . . . 5.88 111.621 -170.406 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -68.68 31.23 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 128.258 2.623 . . . . 5.76 114.009 179.041 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.63 -11.93 6.59 Favored Glycine 0 CA--C 1.534 1.223 0 O-C-N 119.802 -1.811 . . . . 2.49 114.999 178.905 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 35.2 mmt-85 -83.75 144.81 29.09 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.539 1.67 . . . . 6.78 109.745 163.247 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 7.4 mm -93.79 135.29 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 106.97 -1.493 . . . . 2.77 106.97 163.653 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 18.5 m -98.18 159.07 15.17 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.256 1.422 . . . . 2.05 110.941 166.685 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -62.97 -54.38 39.28 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.33 -1.482 . . . . 1.83 112.311 -174.651 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -68.63 -14.02 62.74 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.64 1.976 . . . . 2.97 113.301 -176.215 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -56.69 -54.06 50.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.159 1.784 . . . . 3.22 111.168 174.137 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -57.19 -44.7 83.85 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 120.624 -1.297 . . . . 2.25 112.311 173.068 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -62.66 -43.25 99.28 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 121.985 -0.447 . . . . 0.6 111.845 -178.028 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.9 t -75.3 -26.07 58.42 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 117.409 -1.281 . . . . 1.65 112.496 175.927 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 54.0 mt -68.8 -41.12 79.14 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.677 1.58 . . . . 0.54 112.395 171.948 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 21.9 mm -51.58 -36.72 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 CA-C-N 120.509 1.504 . . . . 0.62 112.417 177.612 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -57.28 -32.3 63.56 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 118.505 0.593 . . . . 0.65 113.688 173.77 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -73.13 -19.24 79.56 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-N 118.793 1.296 . . . . 0.63 114.903 -179.785 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -98.21 -35.62 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 CA-C-N 119.019 1.409 . . . . 0.79 111.147 167.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 68.6 m -75.1 -41.88 57.74 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.913 1.685 . . . . 2.78 113.177 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -54.48 -42.58 76.01 Favored Glycine 0 CA--C 1.537 1.461 0 CA-C-O 118.086 -1.397 . . . . 1.12 115.74 -174.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.09 -44.29 7.53 Favored 'Trans proline' 0 C--N 1.354 0.832 0 CA-C-N 121.0 2.4 . . . . 1.14 112.444 174.374 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 35.0 pt -90.38 -24.7 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 115.607 1.706 . . . . 1.13 115.607 -168.271 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -56.35 -36.16 68.46 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.767 1.227 . . . . 1.03 113.834 -171.072 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.0 ptpp? -57.62 -31.67 66.47 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.735 1.214 . . . . 5.63 113.107 173.175 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.66 -30.11 25.12 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.454 1.502 . . . . 2.09 110.947 179.115 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 65.0 mt -52.36 -52.81 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.183 0.993 . . . . 0.92 110.508 172.207 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -46.79 -50.26 18.57 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 118.761 0.709 . . . . 3.58 112.786 173.132 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -68.32 -12.99 61.94 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.813 1.245 . . . . 4.55 113.657 -177.018 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -98.57 -30.34 12.55 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.461 1.504 . . . . 2.41 113.58 170.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -68.18 -17.44 64.33 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 120.552 1.524 . . . . 2.32 111.555 165.901 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -93.87 -54.87 3.44 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.18 -0.95 . . . . 2.0 111.787 174.084 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 . . . . . 0 N--CA 1.477 0.895 0 C-N-CA 129.115 2.966 . . . . 6.11 116.043 176.583 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 . . . . . 0 N--CA 1.474 0.766 0 N-CA-C 108.586 -0.894 . . . . 2.15 108.586 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 31.5 p -76.23 154.68 35.06 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.566 0.747 . . . . 0.98 110.15 174.194 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -62.33 -31.76 72.42 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-O 118.818 -0.61 . . . . 2.46 111.897 178.14 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.68 -42.52 88.69 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 120.065 1.302 . . . . 0.79 110.224 176.508 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -62.91 1.25 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.822 1.249 . . . . 2.84 110.443 179.295 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -52.39 -33.87 45.44 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 114.404 1.261 . . . . 5.9 114.404 172.971 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.88 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -67.24 -49.01 66.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 119.938 1.245 . . . . 0.49 111.808 173.008 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 52.8 t -57.22 -35.08 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 120.017 1.28 . . . . 0.83 110.439 173.641 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.6 mt -59.65 -47.64 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 O-C-N 121.483 -0.761 . . . . 1.08 112.305 168.209 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.3 t -64.61 -34.65 71.17 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 CA-C-N 120.279 1.399 . . . . 0.78 113.414 175.006 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -63.23 -41.81 99.15 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 120.636 -1.29 . . . . 0.93 111.04 171.643 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.2 t -62.56 -40.19 87.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 123.774 0.83 . . . . 0.58 110.881 173.689 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -66.04 -36.64 83.8 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.644 1.111 . . . . 3.13 113.129 173.609 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.428 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 36.1 t30 -62.11 -23.07 66.32 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.756 1.162 . . . . 2.01 113.556 -177.883 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -81.91 -50.19 9.46 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.037 1.335 . . . . 1.95 112.797 171.213 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -75.74 -16.44 60.14 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.667 1.358 . . . . 2.27 114.667 -174.019 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 18' ' ' ASN . 5.4 ptmt -66.87 -25.66 66.51 Favored 'General case' 0 CA--C 1.553 1.059 0 O-C-N 120.218 -1.552 . . . . 2.69 112.116 161.075 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -97.89 -36.25 10.23 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 115.277 1.584 . . . . 3.1 115.277 -178.018 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.486 1.331 0 CA-C-N 120.509 1.504 . . . . 3.93 112.238 172.23 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.0 tt . . . . . 0 CA--C 1.541 0.629 0 N-CA-C 109.296 -0.631 . . . . 3.44 109.296 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.2 m -143.04 168.6 19.34 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.507 -1.371 . . . . 2.62 109.245 159.08 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -59.26 -34.95 72.86 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.274 -1.516 . . . . 2.56 112.048 -173.237 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 p -57.21 -21.28 32.42 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.358 1.863 . . . . 1.84 114.57 171.823 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 m -74.65 -39.8 61.84 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.19 -0.944 . . . . 1.71 112.395 171.275 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.421 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 71.7 t80 -58.27 -49.72 76.12 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.742 1.155 . . . . 2.12 113.066 -175.36 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -53.18 -23.02 7.43 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.001 0.92 . . . . 2.84 112.874 172.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -99.68 -45.82 5.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.931 1.693 . . . . 3.54 113.244 -170.271 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 16.7 ptm -52.53 -37.16 56.99 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.979 0.809 . . . . 3.4 110.444 161.154 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.8 mt -58.72 -64.17 1.03 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.954 0.902 . . . . 1.43 111.865 167.306 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -70.0 -12.17 61.42 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.585 1.538 . . . . 3.05 115.12 -173.458 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.1 -49.21 6.32 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.506 1.048 . . . . 1.75 112.419 170.616 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -80.97 -36.48 30.78 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 120.06 1.3 . . . . 2.72 112.529 -175.091 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.8 mt -103.81 27.32 7.65 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.957 1.303 . . . . 2.11 112.666 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -58.5 -16.77 16.76 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 115.766 1.765 . . . . 1.54 115.766 -169.407 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.12 -36.15 15.0 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 119.517 1.053 . . . . 1.79 113.089 174.858 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.8 ttm -71.31 -22.27 61.95 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.909 1.284 . . . . 3.04 112.292 176.316 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.9 mp -61.9 90.35 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 123.528 1.632 . . . . 2.49 111.046 171.114 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.6 m -74.39 75.77 1.9 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 113.535 -1.666 . . . . 4.55 109.701 173.818 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.9 t70 71.77 169.89 0.32 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 128.312 2.645 . . . . 4.04 112.999 -176.064 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m -30.77 -45.86 0.07 Allowed 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 127.376 2.27 . . . . 2.34 111.989 150.062 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.56 -50.17 54.43 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.433 1.492 . . . . 1.69 113.654 177.223 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -62.65 -41.67 99.18 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.794 1.297 . . . . 3.5 112.001 172.208 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 44.2 ttt-85 -57.01 -40.49 76.74 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.735 0.698 . . . . 5.26 112.521 173.729 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.29 -19.06 64.25 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 120.443 1.474 . . . . 3.59 113.609 176.164 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.494 ' HA ' ' HG2' ' A' ' 61' ' ' LYS . . . -79.09 -17.61 54.84 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.127 1.158 . . . . 1.05 114.127 170.999 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.29 -53.11 9.31 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.481 1.112 . . . . 0.78 110.525 160.559 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -57.01 -35.77 69.63 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.086 0.954 . . . . 2.3 112.923 -176.451 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.494 ' HG2' ' HA ' ' A' ' 58' ' ' ALA . 2.9 ptmm? -57.59 -23.83 52.98 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 120.377 -1.452 . . . . 3.94 114.763 171.654 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.2 mt -82.84 -37.05 24.92 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.465 -0.772 . . . . 1.56 112.308 174.676 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.2 mm -52.53 -51.56 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.766 1.226 . . . . 0.98 110.823 -178.326 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -55.14 -48.93 73.0 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 122.176 0.988 . . . . 3.06 112.359 177.426 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 -66.01 -21.19 66.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.744 1.218 . . . . 3.11 113.316 -178.691 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.47 -34.9 14.63 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.849 0.75 . . . . 2.13 112.533 178.428 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -61.88 -25.36 67.5 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.3 -0.875 . . . . 3.23 112.511 164.695 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.67 -14.01 62.3 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 114.484 1.29 . . . . 2.06 114.484 167.251 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -123.91 -19.47 5.68 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 116.119 1.896 . . . . 2.59 116.119 -173.411 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.93 127.02 22.49 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.08 1.763 . . . . 3.64 112.435 -171.488 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -85.91 -7.66 58.54 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.804 1.409 . . . . 4.66 114.804 -169.353 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 130.8 -13.65 5.55 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 124.762 1.172 . . . . 2.52 113.628 -163.116 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.5 mmt-85 -76.61 147.03 37.86 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.244 1.522 . . . . 4.91 109.467 153.273 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 37.4 mm -133.22 146.2 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 127.458 2.303 . . . . 2.31 107.317 -178.307 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 10.6 m -109.44 151.52 26.58 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 118.977 0.808 . . . . 1.7 110.289 173.809 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -55.72 -40.46 72.46 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-O 122.658 1.218 . . . . 2.06 111.137 172.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.8 -32.2 65.45 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 129.772 3.229 . . . . 3.05 112.782 178.688 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -54.76 9.76 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.395 1.478 . . . . 3.25 110.0 -170.4 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -52.77 -43.46 65.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.092 0.557 . . . . 1.93 112.028 174.169 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.7 t-105 -63.26 -48.14 79.44 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.709 -0.62 . . . . 0.87 111.375 177.532 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 88.5 m -58.37 -37.45 75.24 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.501 1.921 . . . . 2.28 111.694 176.453 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.421 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 75.2 mt -62.14 -50.5 71.64 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 118.25 -0.881 . . . . 1.02 111.955 174.114 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.0 mm -52.62 -41.84 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 CA-C-N 120.215 1.37 . . . . 0.95 113.441 -173.591 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.28 -19.46 59.66 Favored Glycine 0 N--CA 1.475 1.282 0 C-N-CA 123.637 0.637 . . . . 0.98 113.499 177.993 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.0 -11.63 85.4 Favored Glycine 0 CA--C 1.534 1.252 0 CA-C-O 117.85 -1.528 . . . . 1.14 114.993 173.979 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.3 -45.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 119.796 1.798 . . . . 1.39 111.036 175.939 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 40.6 m -76.28 87.19 3.09 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 105.997 -1.853 . . . . 1.43 105.997 172.688 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -160.4 -77.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.916 0 CA-C-O 118.038 -1.423 . . . . 0.98 112.549 -167.762 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -61.57 -33.37 87.27 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 122.856 2.371 . . . . 1.14 112.311 175.263 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.3 pt -75.85 -16.9 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 114.047 1.128 . . . . 1.19 114.047 173.885 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.12 -65.05 0.63 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.997 1.271 . . . . 1.76 112.958 -169.47 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp -55.2 -40.75 71.13 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.349 -0.845 . . . . 3.34 113.185 178.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.69 -38.27 74.89 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.648 0.779 . . . . 1.39 111.216 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 51.2 mt -54.93 -62.43 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 118.973 0.806 . . . . 1.38 111.111 171.117 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -57.11 -27.98 62.26 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.299 0.852 . . . . 1.7 113.299 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -81.36 -25.89 35.98 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.048 -1.033 . . . . 2.9 112.261 177.605 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -74.96 -33.49 61.92 Favored 'General case' 0 C--O 1.227 -0.086 0 N-CA-C 113.776 1.028 . . . . 2.18 113.776 178.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -70.47 6.69 1.29 Allowed 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 123.305 1.526 . . . . 2.34 112.031 172.151 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 N--CA 1.466 0.365 0 C-N-CA 126.416 1.887 . . . . 2.32 110.306 170.599 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 . . . . . 0 CA--C 1.55 0.976 0 N-CA-C 114.238 1.199 . . . . 2.31 114.238 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.4 p -85.27 159.79 19.99 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.575 -0.703 . . . . 1.07 109.311 160.42 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -59.61 -45.06 93.05 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.599 -0.715 . . . . 2.79 111.657 174.505 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.59 -43.04 75.63 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.581 1.082 . . . . 1.03 111.211 -174.46 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -56.75 7.6 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.993 0.517 . . . . 2.77 110.239 -177.381 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -50.2 -37.61 36.05 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.755 1.222 . . . . 5.24 112.268 172.103 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.88 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.35 -44.67 74.76 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 120.37 -1.456 . . . . 0.51 113.51 172.588 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 79.6 t -61.72 -34.53 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 CA-C-N 121.009 1.731 . . . . 0.77 111.017 172.399 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 44.4 mt -56.03 -52.48 49.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.681 1.128 . . . . 0.76 110.913 165.154 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 9.3 t -58.03 -41.37 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 119.407 1.003 . . . . 0.57 112.657 178.569 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.37 -39.36 94.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.02 0.928 . . . . 0.99 112.298 175.007 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 99.2 t -70.93 -44.86 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-O 118.455 -0.783 . . . . 0.57 110.895 177.873 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -61.24 -39.2 89.44 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.552 1.069 . . . . 4.2 112.042 178.625 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . 0.515 HD21 ' HG3' ' B' ' 148' ' ' GLU . 6.9 t30 -67.51 -14.85 63.3 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.523 1.305 . . . . 2.35 114.523 -177.469 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -102.11 -40.18 6.94 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.55 1.54 . . . . 2.42 113.155 174.881 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -68.69 -26.08 65.11 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 120.862 -1.149 . . . . 2.08 112.827 175.874 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 42.2 pttt -59.23 -34.78 72.61 Favored 'General case' 0 CA--C 1.551 0.994 0 O-C-N 119.444 -2.035 . . . . 2.44 112.248 164.298 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -81.86 -33.46 30.6 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 116.993 -1.479 . . . . 2.56 114.876 178.95 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 9.6 p . . . . . 0 N--CA 1.483 1.191 0 CA-C-N 120.573 1.533 . . . . 3.88 113.162 176.576 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 5.3 tt . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 109.334 -0.617 . . . . 3.27 109.334 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 74.2 m -142.55 163.53 32.59 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.049 1.74 . . . . 2.67 108.722 155.992 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 38.4 mmtm -56.15 -32.6 64.44 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.523 -1.36 . . . . 2.87 112.699 -174.219 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 9.1 p -56.7 -23.0 39.14 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.032 1.733 . . . . 1.92 113.854 174.497 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 6.0 m -76.56 -26.61 55.29 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.882 -1.137 . . . . 1.41 113.159 173.518 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -65.17 -53.51 43.82 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.73 1.605 . . . . 1.92 111.656 -179.212 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 6.3 ptt180 -52.14 -25.26 8.51 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.581 1.152 . . . . 2.55 112.622 176.128 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.27 -45.08 7.31 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.269 1.827 . . . . 3.48 112.077 -173.115 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.3 tmm? -49.95 -44.08 50.41 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.13 0.972 . . . . 1.6 110.232 162.283 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.9 mt -55.01 -63.62 1.1 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.666 1.587 . . . . 1.49 111.967 166.945 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -68.56 -15.16 63.44 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 115.338 1.607 . . . . 2.96 115.338 -174.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.92 -48.12 7.43 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.462 1.028 . . . . 1.69 112.331 172.362 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.515 ' HG3' HD21 ' B' ' 121' ' ' ASN . 50.6 mm-40 -87.36 -33.88 19.0 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.68 1.127 . . . . 2.79 113.043 -172.861 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.5 mt -101.62 27.38 6.42 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.899 1.28 . . . . 2.2 112.317 176.22 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -60.76 -12.59 11.1 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 116.166 1.913 . . . . 1.44 116.166 -169.662 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -92.1 -59.77 2.02 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.606 1.162 . . . . 1.43 111.587 -175.281 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 27.7 ttp -61.44 -13.58 21.56 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 114.917 1.451 . . . . 1.79 114.917 169.315 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.9 tp -58.39 91.44 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.726 1.61 . . . . 2.43 110.185 176.306 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 63.7 m -82.92 70.22 9.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.489 1.116 . . . . 4.57 110.879 -167.571 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 25.9 t70 74.62 167.22 0.29 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 128.316 2.646 . . . . 4.15 112.695 -175.159 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -27.6 -47.34 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.4 0 C-N-CA 127.792 2.437 . . . . 2.61 112.697 151.549 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.06 -52.42 52.94 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-N 120.232 1.378 . . . . 1.9 113.756 -178.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.19 -38.8 80.74 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.913 0.885 . . . . 3.1 111.325 173.818 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.2 ttt-85 -62.06 -45.87 91.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.719 0.808 . . . . 4.6 113.099 172.444 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -21.72 66.05 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 120.024 -1.672 . . . . 3.76 113.182 -177.709 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -61.3 -28.79 69.45 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 117.325 -1.322 . . . . 1.36 113.476 167.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.27 73.18 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.199 1.0 . . . . 1.12 111.484 167.089 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -62.88 -32.78 74.1 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.656 0.783 . . . . 2.12 111.944 -175.057 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt -47.17 -42.25 19.34 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 122.402 1.096 . . . . 2.56 113.663 166.845 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . 0.441 HD11 ' HA3' ' B' ' 188' ' ' GLY . 5.5 mt -78.67 -42.2 29.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 113.973 -1.467 . . . . 1.14 110.551 -174.41 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.9 mm -46.48 -56.85 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.302 1.441 . . . . 1.3 111.67 175.08 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -58.76 -40.73 84.74 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.592 1.187 . . . . 3.08 112.47 -177.145 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -77.24 -18.46 57.62 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.131 1.372 . . . . 3.47 112.455 -175.776 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.57 -36.24 15.43 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.781 0.833 . . . . 2.42 112.329 173.288 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -58.88 -35.99 73.91 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.3 0.955 . . . . 3.77 111.946 166.761 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -60.1 -15.97 27.95 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.846 1.424 . . . . 2.27 114.846 169.906 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -120.5 -14.53 8.66 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 115.573 1.694 . . . . 2.69 115.573 -176.254 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -138.89 108.13 6.09 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.777 1.626 . . . . 3.85 112.407 -166.73 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -76.77 56.15 1.14 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 128.357 2.663 . . . . 4.29 112.484 -169.501 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 67.87 -14.14 0.61 Allowed Glycine 0 N--CA 1.479 1.563 0 O-C-N 119.854 -1.779 . . . . 2.49 114.145 -171.388 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.9 mmt-85 -73.1 141.89 47.54 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.83 1.652 . . . . 5.05 107.726 164.797 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 40.6 mm -126.32 141.81 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.078 1.351 . . . . 2.32 108.812 -168.879 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 70.8 m -99.74 155.13 17.79 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 117.891 0.314 . . . . 1.81 111.68 173.839 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -63.32 -50.47 69.9 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.943 -1.098 . . . . 2.41 110.509 172.585 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -70.19 -6.45 34.56 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.668 1.187 . . . . 4.46 113.203 -178.066 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -59.3 -57.78 11.53 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.196 0.998 . . . . 3.15 109.937 171.551 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -52.11 -48.79 64.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.545 0.738 . . . . 2.17 112.035 176.378 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 21.0 t-105 -59.0 -49.82 76.45 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 119.244 -0.407 . . . . 0.84 111.729 178.979 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.5 m -55.32 -43.61 75.06 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.75 1.62 . . . . 1.76 111.865 174.611 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 48.9 mt -69.36 -38.37 78.06 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 118.177 -0.915 . . . . 0.75 113.271 179.745 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 30.2 mm -56.79 -41.34 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 120.542 1.519 . . . . 0.63 111.662 178.26 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.74 -18.8 57.43 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-O 119.365 -0.686 . . . . 0.71 114.174 -179.258 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . 0.441 ' HA3' HD11 ' B' ' 165' ' ' LEU . . . -80.8 -11.7 83.6 Favored Glycine 0 CA--C 1.535 1.334 0 CA-C-N 118.866 1.333 . . . . 0.68 114.076 175.133 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.7 mp -108.54 -45.04 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.657 1.183 . . . . 0.87 110.325 171.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 23.6 m -80.57 77.51 7.37 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 125.17 1.388 . . . . 1.34 107.982 176.292 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -158.44 -74.39 0.02 OUTLIER Glycine 0 CA--C 1.53 1.03 0 C-N-CA 125.502 1.525 . . . . 0.82 112.019 -172.084 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -63.11 -34.81 68.03 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.004 2.469 . . . . 1.08 113.418 177.851 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.9 pt -83.67 -6.92 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 114.035 1.124 . . . . 0.91 114.035 174.722 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -50.07 -55.26 15.58 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.093 1.357 . . . . 1.57 113.919 -172.758 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 mtpp -66.51 -39.63 88.77 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-O 116.987 -1.483 . . . . 5.37 112.86 174.336 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.5 tt -50.29 -41.81 51.39 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 120.783 1.629 . . . . 1.75 111.675 177.896 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 85.1 mt -52.15 -54.99 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.351 1.06 . . . . 1.1 112.432 169.028 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 57.8 t60 -73.33 -20.15 60.86 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.454 0.909 . . . . 2.23 113.454 -178.067 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.07 -44.29 69.41 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.923 0.889 . . . . 3.74 109.487 168.09 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -60.64 -44.07 96.81 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.755 1.222 . . . . 2.33 113.387 -176.277 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -70.69 1.46 5.3 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 122.529 1.157 . . . . 2.56 112.825 -179.235 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -116.21 -53.5 2.54 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 120.725 -1.234 . . . . 2.65 109.755 175.38 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.683 0 CA-C-N 114.598 -1.183 . . . . 4.12 114.167 178.604 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 . . . . . 0 N--CA 1.472 0.657 0 CA-C-O 118.893 -0.575 . . . . 2.25 109.605 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.6 p -62.37 151.82 35.79 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.511 1.05 . . . . 0.97 109.521 174.73 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -58.87 -49.61 77.13 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.876 0.735 . . . . 2.49 109.169 177.717 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -43.92 -49.47 8.42 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.381 1.873 . . . . 1.06 111.499 176.331 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -56.53 4.93 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.875 -0.516 . . . . 3.03 111.807 -171.089 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.41 ' HA ' ' HB ' ' A' ' 13' ' ' ILE . 28.8 mmtt -59.15 -22.16 60.49 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.856 -1.153 . . . . 6.92 113.455 170.163 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.907 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.06 -46.35 68.06 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 120.566 -1.334 . . . . 0.48 112.181 168.105 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 96.5 t -59.58 -39.85 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 121.081 1.764 . . . . 0.89 110.318 170.596 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.41 ' HB ' ' HA ' ' A' ' 10' ' ' LYS . 1.1 mt -55.47 -47.07 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 118.558 -0.734 . . . . 1.49 111.344 169.358 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.55 -37.64 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.137 1.375 . . . . 0.58 112.753 175.978 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.43 -37.29 86.73 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.8 1.182 . . . . 0.93 111.009 172.67 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 74.2 t -72.04 -40.9 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.833 0.853 . . . . 0.68 110.697 174.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -55.51 -60.1 3.89 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.72 1.146 . . . . 3.04 110.709 172.325 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.514 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -63.85 -30.6 71.67 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.151 0.797 . . . . 2.91 113.151 -170.101 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -67.98 -60.64 2.35 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.589 0.755 . . . . 2.07 110.951 169.815 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -60.97 -26.12 67.33 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 118.146 -0.93 . . . . 2.1 112.388 -176.158 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.514 ' HE2' ' HA ' ' A' ' 18' ' ' ASN . 10.7 ttmm -43.88 -42.17 5.59 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.805 2.042 . . . . 2.24 112.81 167.596 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -82.69 -19.0 38.92 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.014 1.116 . . . . 2.96 114.014 178.315 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.7 t . . . . . 0 N--CA 1.481 1.106 0 C-N-CA 126.57 1.948 . . . . 2.48 110.387 -179.101 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.8 tt . . . . . 0 N--CA 1.472 0.64 0 N-CA-C 107.578 -1.267 . . . . 2.4 107.578 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 t -147.84 -175.63 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 122.036 0.922 . . . . 4.09 110.84 167.897 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -29.36 24.4 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.651 2.38 . . . . 2.0 114.498 -176.188 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.5 p -61.18 -26.27 67.6 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.157 1.383 . . . . 2.25 114.349 172.515 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.4 m -91.3 -40.9 11.23 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.316 1.228 . . . . 1.28 114.316 -175.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.418 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 42.5 t80 -54.82 -52.22 63.38 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.217 0.917 . . . . 2.1 113.226 -167.06 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -54.37 -30.74 52.84 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.594 1.558 . . . . 2.97 113.862 173.529 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -87.76 -50.83 6.21 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.574 1.149 . . . . 3.11 109.782 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -47.49 -45.16 26.03 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.627 1.171 . . . . 1.59 111.915 167.437 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 mt -54.85 -31.2 59.23 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.497 1.295 . . . . 1.19 114.497 177.383 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.431 ' HB2' ' HE ' ' A' ' 56' ' ' ARG . 0.9 OUTLIER -87.97 -4.11 58.84 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 120.168 1.349 . . . . 2.26 113.651 178.133 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.14 -43.68 7.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.004 1.321 . . . . 1.59 111.373 168.243 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.465 ' OE2' ' HE3' ' A' ' 21' ' ' LYS . 7.4 mm-40 -97.71 -25.79 14.97 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.487 0.921 . . . . 2.94 113.487 -166.231 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.63 34.71 5.08 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.211 1.404 . . . . 1.89 110.621 -176.984 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -83.66 -5.95 59.32 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 117.243 2.312 . . . . 1.42 117.243 -149.052 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -94.16 -50.27 5.36 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 120.223 1.374 . . . . 1.81 109.93 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.9 tpp -46.46 -40.57 12.54 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.58 1.952 . . . . 1.96 112.527 164.751 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -84.59 91.29 7.86 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-O 122.834 1.302 . . . . 3.3 110.159 177.297 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.9 t -91.04 -90.69 0.15 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.445 -1.252 . . . . 3.99 109.926 -176.137 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -72.65 156.51 38.9 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.604 1.161 . . . . 3.9 113.682 -178.452 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.7 m -63.87 -30.0 71.13 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.322 1.449 . . . . 2.64 111.667 171.494 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.11 -37.7 92.03 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.296 1.427 . . . . 2.17 112.525 168.066 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.34 -36.19 74.08 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.044 0.922 . . . . 3.57 111.601 171.241 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.431 ' HE ' ' HB2' ' A' ' 43' ' ' GLN . 48.1 mtt85 -65.73 -24.26 66.93 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.509 0.929 . . . . 7.05 113.509 176.169 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt -59.07 -17.21 23.82 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.868 -1.145 . . . . 4.21 113.725 166.121 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.47 -19.2 53.61 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.267 1.58 . . . . 1.36 115.267 169.2 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.17 -55.29 4.84 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.739 1.216 . . . . 0.94 110.422 163.565 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -64.08 -28.89 70.09 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 113.996 1.109 . . . . 2.77 113.996 -176.962 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.3 ptmm? -53.02 -33.58 52.39 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 120.074 1.306 . . . . 3.6 112.596 167.688 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.5 mt -77.16 -41.43 41.74 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 122.138 -0.351 . . . . 0.92 111.459 -179.839 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.3 mm -53.3 -56.12 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 C-N-CA 124.102 0.961 . . . . 1.16 110.191 -179.827 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -57.44 -40.43 78.42 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.7 0.8 . . . . 1.88 112.906 -179.018 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -64.34 -38.92 92.75 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 112.935 0.717 . . . . 4.01 112.935 175.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.42 -38.92 16.87 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.412 0.685 . . . . 2.34 111.962 -173.074 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.5 -22.52 66.18 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.829 0.851 . . . . 2.92 112.826 177.137 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.37 -17.31 61.83 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.314 1.227 . . . . 2.84 114.314 168.503 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -128.63 -8.93 5.08 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 115.158 1.54 . . . . 3.35 115.158 -166.545 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -137.87 107.68 6.28 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.489 1.495 . . . . 4.25 111.929 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.0 p-10 -78.6 77.23 5.09 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.482 1.513 . . . . 4.09 112.423 -174.714 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.86 10.7 77.52 Favored Glycine 0 N--CA 1.476 1.332 0 C-N-CA 124.117 0.865 . . . . 2.55 114.587 175.197 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -64.87 153.64 39.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.557 1.543 . . . . 5.79 111.921 179.132 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -140.65 86.57 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 124.819 1.247 . . . . 4.28 107.883 175.573 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.7 t -89.66 149.63 22.71 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 125.296 1.438 . . . . 1.59 112.085 169.6 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -58.27 -41.51 84.48 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.756 -0.59 . . . . 2.78 111.907 169.536 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -79.04 -23.2 44.43 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.084 0.772 . . . . 4.1 113.084 -174.269 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -54.83 -59.04 5.26 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.262 -1.014 . . . . 3.42 108.262 167.08 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -55.45 -43.78 75.75 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.234 -0.916 . . . . 3.02 113.006 179.57 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -65.76 -49.26 69.02 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.304 -0.873 . . . . 1.06 112.957 -178.861 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 4.6 t -67.97 -25.65 65.54 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.114 0.87 . . . . 2.03 112.498 178.379 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 89.5 mt -65.51 -49.61 68.32 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.277 -0.868 . . . . 0.67 111.362 171.541 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 34.4 mm -54.85 -40.34 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 CA-C-N 120.561 1.528 . . . . 0.59 113.538 -177.553 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.69 -28.24 71.23 Favored Glycine 0 CA--C 1.529 0.939 0 CA-C-O 119.477 -0.624 . . . . 0.65 112.751 175.048 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.05 -14.66 74.36 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-O 117.63 -1.65 . . . . 0.84 116.535 -174.683 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.4 mp -87.33 -31.36 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-N 119.637 1.719 . . . . 1.08 110.795 163.193 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.1 m -71.55 168.92 16.56 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.195 1.798 . . . . 3.34 108.712 176.342 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.69 -73.07 0.3 Allowed Glycine 0 CA--C 1.531 1.078 0 CA-C-O 117.821 -1.544 . . . . 1.39 113.03 179.763 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -63.72 -43.64 16.05 Favored 'Trans proline' 0 C--N 1.351 0.666 0 CA-C-N 120.539 2.169 . . . . 1.43 110.138 174.584 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.1 pt -67.43 -22.55 28.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 113.62 0.97 . . . . 1.4 113.62 170.875 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.437 ' HA ' HD12 ' A' ' 94' ' ' ILE . . . -57.73 -55.7 31.53 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.976 1.262 . . . . 1.48 112.7 -171.79 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -29.3 70.23 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.831 -1.168 . . . . 3.9 112.389 176.712 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.44 -41.45 72.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.343 1.457 . . . . 1.36 110.572 -177.195 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.437 HD12 ' HA ' ' A' ' 91' ' ' ALA . 62.9 mt -48.98 -60.17 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 1.19 109.585 165.256 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -55.9 -44.66 78.45 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-O 118.38 -0.819 . . . . 1.98 111.7 -177.978 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -55.36 -43.08 74.74 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.137 1.335 . . . . 4.13 112.805 173.483 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 24.2 mm100 -79.26 -30.54 43.11 Favored 'General case' 0 CA--C 1.527 0.079 0 N-CA-C 113.95 1.092 . . . . 2.7 113.95 -172.553 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -71.89 -32.92 67.91 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.873 1.215 . . . . 2.43 111.15 170.317 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.482 1.13 0 O-C-N 121.132 -0.98 . . . . 2.62 110.674 173.778 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 . . . . . 0 CA--C 1.537 0.474 0 CA-C-O 118.722 -0.656 . . . . 2.36 109.505 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 26.9 p -61.8 147.65 45.7 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.234 0.925 . . . . 1.06 109.703 171.641 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.44 -48.09 72.11 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.772 -0.633 . . . . 2.88 110.348 173.612 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -47.92 -49.91 28.58 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.797 1.639 . . . . 0.73 111.976 177.183 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.42 -54.23 8.8 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.422 -0.799 . . . . 2.98 111.091 -171.727 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 28.0 mmtt -56.36 -24.79 46.47 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.883 -1.135 . . . . 7.45 113.48 169.064 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.907 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.86 -45.27 75.05 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.652 -1.28 . . . . 0.53 112.62 168.027 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 93.7 t -57.66 -38.08 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 CA-C-N 120.834 1.652 . . . . 0.77 110.468 169.117 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 2.3 mt -59.71 -49.49 83.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 121.481 -0.762 . . . . 1.41 112.23 170.031 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.9 t -60.81 -38.8 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.777 1.631 . . . . 0.57 112.256 178.472 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.79 -40.47 97.42 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.401 1.0 . . . . 0.99 111.048 172.438 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 66.8 t -66.67 -41.35 88.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-O 117.467 -1.254 . . . . 0.69 110.957 177.156 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -67.56 -39.41 84.93 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 121.185 1.811 . . . . 4.44 113.982 169.399 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -61.55 -24.39 66.6 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.35 -1.469 . . . . 3.49 113.162 177.216 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -81.01 -66.19 0.92 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.736 1.214 . . . . 1.88 112.559 164.345 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -60.29 -31.39 70.21 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 118.195 -0.907 . . . . 2.11 112.774 -167.862 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -52.24 -31.72 33.63 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.278 1.399 . . . . 2.34 113.4 175.034 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -82.66 -16.56 47.8 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.803 -1.185 . . . . 2.23 113.605 177.213 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 25.6 t . . . . . 0 N--CA 1.475 0.801 0 C-N-CA 127.105 2.162 . . . . 2.56 108.976 -176.981 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 10.2 tt . . . . . 0 N--CA 1.467 0.38 0 N-CA-C 107.316 -1.365 . . . . 2.29 107.316 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 9.1 t -148.43 -175.19 4.82 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 122.759 1.266 . . . . 4.09 111.157 171.229 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.17 -35.69 27.26 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.981 2.912 . . . . 2.01 114.349 -177.824 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 26.8 p -58.83 -26.47 64.19 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.089 1.356 . . . . 2.03 114.409 173.821 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 19.3 m -91.53 -40.33 11.42 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.394 1.078 . . . . 1.34 113.756 -178.848 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 53.4 t80 -55.45 -51.59 66.41 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.789 1.177 . . . . 2.16 113.473 -166.476 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.35 -32.29 48.47 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.202 1.401 . . . . 2.83 114.024 171.28 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -84.06 -52.49 6.26 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.021 1.328 . . . . 3.02 109.459 -173.183 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 13.9 tmm? -44.96 -45.08 10.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.138 1.775 . . . . 1.52 112.395 165.501 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.2 mt -58.86 -27.91 65.59 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.614 1.166 . . . . 1.21 114.112 179.622 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -92.53 3.84 54.73 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.894 1.225 . . . . 2.16 113.862 173.191 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -44.44 5.84 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.044 0.938 . . . . 1.49 111.614 165.605 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.01 -18.59 19.32 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 113.735 1.013 . . . . 2.88 113.735 -170.935 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.85 26.77 8.03 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.311 1.845 . . . . 1.83 111.574 -179.365 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -71.93 1.93 6.38 Favored 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 117.832 2.531 . . . . 1.44 117.832 -157.94 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -99.64 -57.82 2.06 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.701 1.201 . . . . 1.88 110.007 178.025 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . 0.441 ' SD ' HD12 ' B' ' 193' ' ' ILE . 8.1 ttp -65.36 -27.65 68.73 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.28 1.032 . . . . 2.05 113.058 168.223 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 6.1 mp -98.53 82.04 2.8 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.799 1.182 . . . . 4.14 110.871 157.445 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 6.3 t -104.52 -64.06 1.15 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.892 2.077 . . . . 4.77 110.785 178.345 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -72.57 140.93 48.38 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.15 0.98 . . . . 4.25 112.433 176.58 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 77.0 m -71.91 -26.09 62.17 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.572 1.949 . . . . 3.11 112.72 175.98 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -61.61 -45.69 95.8 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-N 119.222 0.919 . . . . 2.06 111.064 165.927 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.14 -37.41 82.74 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.796 0.839 . . . . 3.55 111.739 169.598 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 -64.81 -25.56 67.96 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.779 1.172 . . . . 7.36 113.642 177.881 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.7 mtmt -58.63 -17.78 25.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.141 1.337 . . . . 4.32 113.465 167.739 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.6 -19.13 56.07 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 115.315 1.598 . . . . 1.54 115.315 168.511 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.82 -55.71 4.79 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.207 1.003 . . . . 1.08 110.382 163.136 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -64.6 -28.96 69.98 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.734 1.013 . . . . 2.98 113.734 -175.425 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 5.5 ptmm? -52.53 -32.97 43.26 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 119.654 1.115 . . . . 3.87 112.412 168.722 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 48.8 mt -76.96 -42.44 39.08 Favored 'General case' 0 C--O 1.224 -0.265 0 O-C-N 121.704 -0.622 . . . . 0.97 111.675 -179.653 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 35.6 mm -52.01 -53.68 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 125.099 1.36 . . . . 1.34 110.485 -179.179 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -59.53 -42.51 92.48 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.214 0.82 . . . . 1.96 113.214 -179.949 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -64.62 -30.0 71.02 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.293 0.637 . . . . 3.99 112.709 175.682 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -85.8 -47.24 9.91 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.17 0.988 . . . . 2.68 112.026 -176.8 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -63.78 -23.3 67.31 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.197 0.908 . . . . 3.08 112.692 178.358 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -67.71 -15.01 63.43 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.63 1.344 . . . . 2.85 114.63 170.656 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -136.53 -20.43 1.36 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.619 1.711 . . . . 3.45 115.619 -169.009 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -122.46 99.75 6.58 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.716 -1.24 . . . . 4.91 111.666 -167.758 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -77.6 76.95 4.13 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.818 1.247 . . . . 3.92 113.687 -169.996 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 72.2 11.51 75.38 Favored Glycine 0 N--CA 1.477 1.37 0 O-C-N 120.943 -1.098 . . . . 2.63 114.345 176.75 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -65.93 152.16 45.13 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.772 1.629 . . . . 5.62 111.935 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 2.5 mp -140.23 78.64 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.779 1.232 . . . . 4.18 108.353 174.605 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 27.7 t -82.61 151.67 26.24 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.5 1.12 . . . . 1.58 112.171 169.261 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -57.84 -42.11 83.74 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.621 -0.674 . . . . 2.76 111.545 170.04 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.95 -22.71 39.38 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.031 0.752 . . . . 3.82 113.031 -173.061 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -56.59 -53.11 61.42 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.714 -0.847 . . . . 3.72 108.714 166.276 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -58.16 -46.87 84.96 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.274 -0.891 . . . . 2.99 112.484 176.505 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 49.7 t-105 -65.4 -47.78 75.11 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 120.924 -1.11 . . . . 0.97 113.369 -176.373 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.6 t -63.44 -32.86 74.41 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.481 1.037 . . . . 1.94 111.914 176.321 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.414 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 67.6 mt -61.54 -49.47 76.55 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.263 -0.898 . . . . 0.82 112.249 173.711 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.2 mm -57.14 -40.12 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 CA-C-N 120.418 1.463 . . . . 0.78 113.023 -176.712 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.02 -29.74 75.3 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 119.206 -0.774 . . . . 0.82 112.735 174.803 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.84 -16.16 75.81 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.404 1.478 . . . . 0.84 116.297 -173.807 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.1 mp -86.68 -31.41 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 CA-C-N 119.249 1.524 . . . . 0.99 110.82 164.297 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.5 m -74.01 171.13 14.03 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.988 1.715 . . . . 3.05 108.546 178.209 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . 115.43 -73.86 0.25 Allowed Glycine 0 N--CA 1.473 1.153 0 CA-C-O 117.752 -1.582 . . . . 1.2 113.399 179.532 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.27 -41.0 22.98 Favored 'Trans proline' 0 C--N 1.351 0.687 0 CA-C-N 121.276 2.538 . . . . 1.3 110.348 175.616 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . 0.441 HD12 ' SD ' ' B' ' 152' ' ' MET . 12.4 pt -69.26 -21.2 24.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 113.577 0.955 . . . . 1.33 113.577 170.727 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . 0.454 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -60.26 -45.73 92.27 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.185 1.357 . . . . 1.27 112.628 -178.448 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -65.68 -35.52 81.01 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 120.68 -1.262 . . . . 3.51 112.89 170.521 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.4 mt -64.35 -41.79 96.57 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.696 -1.145 . . . . 1.86 111.172 179.317 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . 0.454 HD12 ' HA ' ' B' ' 194' ' ' ALA . 75.1 mt -49.57 -58.1 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 119.625 1.102 . . . . 1.28 110.1 164.569 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -58.44 -36.23 73.33 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 118.433 -0.794 . . . . 1.98 112.611 -172.372 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -68.57 -49.78 56.8 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.669 1.988 . . . . 4.01 112.693 171.84 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -70.47 -32.17 69.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.368 1.067 . . . . 2.59 113.466 -172.124 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -66.55 -35.71 80.9 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 119.951 1.251 . . . . 2.5 111.207 170.952 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -65.95 -42.38 90.07 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 120.643 -1.285 . . . . 2.25 110.588 178.146 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 . . . . . 0 CA--C 1.541 0.602 0 C-N-CA 126.417 1.887 . . . . 4.36 112.754 177.735 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 108.376 -0.972 . . . . 2.12 108.376 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.47 153.25 35.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.458 -1.401 . . . . 1.04 110.425 178.385 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -63.96 -34.13 77.28 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 119.648 1.113 . . . . 2.06 111.437 174.443 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.01 -45.81 87.29 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 120.108 1.322 . . . . 1.1 109.375 177.049 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -66.13 -55.74 14.91 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.94 1.296 . . . . 3.02 112.057 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -58.64 -29.72 66.76 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 120.868 -1.145 . . . . 5.38 112.099 172.284 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.789 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.38 -41.37 76.57 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 119.649 -1.907 . . . . 0.67 112.488 169.078 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.437 ' HA ' ' HG ' ' A' ' 15' ' ' LEU . 85.9 t -56.66 -37.54 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 CA-C-N 119.733 1.151 . . . . 0.72 110.773 167.887 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.1 mt -55.92 -56.75 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 CA-C-N 120.924 1.693 . . . . 1.05 111.852 166.073 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.1 t -52.85 -43.75 46.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 119.382 0.992 . . . . 1.0 112.218 -177.773 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.437 ' HG ' ' HA ' ' A' ' 12' ' ' VAL . 1.8 pp -71.44 -18.94 62.29 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.161 1.171 . . . . 4.27 114.161 177.956 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.2 t -81.95 -43.52 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.291 0.95 . . . . 0.94 110.261 179.177 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -56.68 -41.45 77.33 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.227 0.467 . . . . 3.38 110.593 171.988 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -66.75 -23.8 66.13 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 115.397 1.629 . . . . 2.63 115.397 -178.243 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -79.61 -52.91 7.39 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.567 -0.708 . . . . 1.94 111.852 170.97 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.423 ' HA ' HG22 ' A' ' 23' ' ' VAL . 37.4 m-85 -68.22 -30.75 69.9 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 117.995 -1.002 . . . . 1.79 113.668 -172.065 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.39 -26.31 66.56 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.492 1.293 . . . . 3.74 114.492 172.638 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -93.1 -31.14 14.93 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.76 1.022 . . . . 2.31 113.76 177.847 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.423 HG22 ' HA ' ' A' ' 20' ' ' TYR . 18.9 m . . . . . 0 N--CA 1.474 0.756 0 O-C-N 121.605 -0.684 . . . . 2.82 110.736 174.68 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 7.2 pt . . . . . 0 N--CA 1.475 0.824 0 CA-C-O 122.459 1.123 . . . . 3.0 112.872 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.3 t -78.93 150.52 32.08 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.169 -0.923 . . . . 3.1 110.576 154.762 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -43.55 -32.3 0.9 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.745 1.618 . . . . 2.24 113.075 171.659 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 82.4 p -67.92 -18.09 64.67 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 115.68 1.733 . . . . 1.76 115.68 -178.952 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.7 m -65.61 -43.49 89.46 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 121.114 1.779 . . . . 1.24 112.128 177.986 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.489 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 10.8 t80 -50.4 -53.02 32.45 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.29 1.036 . . . . 2.02 112.866 -178.327 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -61.52 -17.93 56.91 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.318 0.858 . . . . 2.45 113.318 179.481 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -95.66 -42.3 8.46 Favored 'General case' 0 C--O 1.225 -0.184 0 C-N-CA 124.699 1.2 . . . . 3.44 112.329 178.438 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -44.39 -53.39 6.89 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.26 1.024 . . . . 1.71 109.544 162.363 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.489 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 11.8 mt -52.84 -15.88 0.86 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.12 2.168 . . . . 1.31 116.568 174.071 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.21 1.09 10.78 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.667 1.576 . . . . 2.43 114.187 174.746 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.92 -43.99 6.51 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.985 0.914 . . . . 1.88 111.766 164.643 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -88.03 -40.36 13.91 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.977 1.711 . . . . 3.24 112.496 -179.08 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.84 25.19 10.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.592 1.557 . . . . 2.21 112.253 -175.68 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -67.5 -23.84 65.51 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 120.917 -1.114 . . . . 1.74 113.708 -174.23 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -86.13 -20.55 28.49 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.245 0.93 . . . . 1.84 112.128 -169.026 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.7 mtm -98.23 -8.24 27.72 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 114.954 1.464 . . . . 2.62 114.954 168.275 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tp -77.72 71.47 4.2 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 120.445 1.475 . . . . 2.44 111.821 -176.43 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.0 m -70.69 3.56 3.08 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 117.416 2.376 . . . . 4.2 117.416 -166.587 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -177.32 158.39 1.44 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 127.333 2.253 . . . . 5.59 110.502 -179.418 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 53.8 m -58.24 -30.47 66.56 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.783 2.033 . . . . 2.94 112.405 171.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.8 -33.41 68.0 Favored Glycine 0 N--CA 1.472 1.085 0 CA-C-N 120.48 1.491 . . . . 2.32 113.605 175.938 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -64.63 -45.69 85.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.327 0.651 . . . . 3.37 110.938 171.684 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.1 mmm-85 -61.94 -43.87 97.95 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 120.662 -1.274 . . . . 5.25 113.638 169.082 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -53.35 -34.96 59.61 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 121.554 1.979 . . . . 3.43 111.916 173.879 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.44 -17.55 60.77 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 115.013 1.486 . . . . 1.32 115.013 174.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -80.22 -48.7 12.7 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.374 0.988 . . . . 0.93 110.822 163.794 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -63.06 -39.6 95.2 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.352 1.061 . . . . 2.59 111.943 -174.826 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.4 ptmm? -52.43 -29.12 22.88 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 113.841 1.052 . . . . 3.74 113.841 172.588 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.1 mt -78.85 -36.45 42.32 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 124.045 0.938 . . . . 0.97 111.986 -177.704 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.0 mm -57.69 -51.07 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.608 1.163 . . . . 1.12 109.835 -178.199 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -70.55 -31.62 68.73 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.882 1.273 . . . . 1.9 112.959 -179.708 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -65.47 -35.39 80.76 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.626 0.77 . . . . 3.07 112.158 167.568 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.7 tp -75.11 -20.48 59.42 Favored 'General case' 0 C--O 1.221 -0.421 0 O-C-N 120.9 -1.125 . . . . 2.92 111.562 174.216 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -70.43 -5.14 26.31 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 115.585 1.698 . . . . 2.72 115.585 170.275 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.77 -2.83 31.65 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 113.444 0.905 . . . . 3.26 113.444 157.321 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -143.02 179.61 6.94 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 127.264 2.225 . . . . 3.21 110.815 -169.662 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 26.9 t60 101.03 71.64 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 128.231 2.613 . . . . 5.82 112.31 159.149 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.86 46.7 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 130.325 3.45 . . . . 6.44 114.692 -169.534 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.28 -14.75 2.21 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 126.262 1.886 . . . . 3.34 114.275 -176.074 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.2 mmt85 -90.37 -167.53 1.86 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.662 1.985 . . . . 7.0 112.059 -177.538 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.7 mm -139.65 132.06 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 127.637 2.375 . . . . 3.35 106.542 175.434 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 71.0 m -113.26 146.83 38.7 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.833 0.853 . . . . 1.99 110.727 162.584 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -60.65 -38.02 83.48 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.348 0.87 . . . . 2.13 113.348 -174.935 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -71.97 -8.83 56.77 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.317 1.047 . . . . 4.48 112.883 -176.443 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.82 -56.33 18.42 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.119 0.872 . . . . 3.99 111.095 175.526 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -58.58 -33.2 69.69 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.207 -1.558 . . . . 2.31 112.212 176.007 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 23.5 t-105 -67.72 -59.49 3.28 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.951 0.723 . . . . 1.08 112.951 178.108 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.9 t -60.28 -23.9 64.52 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.023 1.329 . . . . 1.72 112.147 178.181 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 65.0 mt -73.97 -46.67 42.46 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 117.807 -1.092 . . . . 0.63 113.44 169.355 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 8.2 mm -55.05 -40.8 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 CA-C-N 121.732 2.06 . . . . 0.89 112.423 -178.298 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.74 -21.79 63.46 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-N 118.251 0.478 . . . . 0.6 113.39 177.135 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.8 -19.45 76.79 Favored Glycine 0 CA--C 1.532 1.143 0 O-C-N 121.236 -1.155 . . . . 0.67 114.068 177.963 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -110.2 -34.19 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.904 1.281 . . . . 1.05 111.502 170.495 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.5 m -77.4 85.18 3.8 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.285 1.434 . . . . 1.37 108.226 177.667 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -170.33 -68.4 0.04 OUTLIER Glycine 0 CA--C 1.532 1.134 0 C-N-CA 126.077 1.799 . . . . 0.98 111.846 -172.753 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -59.28 -67.83 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.654 2.903 . . . . 1.23 110.877 168.563 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.8 pt -65.84 -20.78 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 117.717 -1.135 . . . . 1.39 113.614 177.677 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.54 71.19 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.632 1.56 . . . . 0.93 112.32 173.677 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -63.67 -41.23 98.21 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.848 -1.157 . . . . 4.09 112.585 173.9 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.81 -35.17 75.81 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.219 1.008 . . . . 1.34 112.722 178.945 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.2 mt -55.45 -52.71 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 120.854 -1.154 . . . . 1.01 110.161 171.173 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -67.27 -35.71 80.08 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.683 0.623 . . . . 1.81 112.683 -176.237 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.263 4.6 pt-20 -75.41 -19.67 59.37 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 119.582 1.083 . . . . 3.05 112.514 174.748 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.49 -43.64 22.79 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 117.56 -1.209 . . . . 2.34 114.212 172.72 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -61.65 -17.85 57.09 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 119.785 1.175 . . . . 2.37 111.762 177.286 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.566 0 C-N-CA 125.325 1.45 . . . . 2.26 110.058 176.175 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 . . . . . 0 N--CA 1.477 0.886 0 N-CA-C 109.59 -0.522 . . . . 2.38 109.59 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 22.3 p -70.48 152.55 43.9 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 119.81 1.186 . . . . 1.04 111.339 -172.931 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -59.31 -36.08 74.98 Favored 'General case' 0 C--O 1.221 -0.443 0 O-C-N 121.526 -0.734 . . . . 2.13 111.851 -177.42 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -44.72 89.19 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.497 1.044 . . . . 1.36 111.149 175.261 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -65.68 -56.46 12.0 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.077 0.951 . . . . 2.84 111.004 -179.569 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.0 tmtt? -58.33 -27.72 64.41 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 120.941 -1.099 . . . . 4.64 112.611 172.137 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.789 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.98 -42.14 76.96 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 119.344 -2.097 . . . . 0.59 113.08 167.842 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 22.1 t -59.81 -31.08 46.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 CA-C-N 120.299 1.409 . . . . 0.72 111.663 168.746 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 69.9 mt -58.57 -60.68 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 O-C-N 120.354 -1.467 . . . . 1.01 111.217 163.097 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 32.9 t -52.94 -44.28 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 124.41 1.084 . . . . 1.02 112.652 -175.601 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 2.6 pp -70.65 -25.11 62.85 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.32 -0.863 . . . . 4.18 112.777 -179.007 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 42.4 t -78.0 -31.66 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 124.199 1.0 . . . . 0.93 110.57 178.045 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -54.14 -49.86 68.25 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.719 0.808 . . . . 2.84 110.284 164.801 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -63.82 -19.26 64.88 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 115.165 1.543 . . . . 2.28 115.165 -178.804 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -80.97 -62.11 1.76 Allowed 'General case' 0 C--O 1.237 0.434 0 O-C-N 121.308 -0.87 . . . . 2.28 112.266 173.471 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -69.61 -21.22 63.59 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 113.598 0.962 . . . . 1.77 113.598 -171.393 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.42 -20.8 66.53 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.429 1.27 . . . . 3.07 114.429 168.497 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 14.3 m-30 -106.3 -36.68 6.78 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.707 1.203 . . . . 2.16 114.055 177.785 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.478 0.969 0 CA-C-N 119.168 0.894 . . . . 3.05 111.449 172.309 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 7.8 pt . . . . . 0 N--CA 1.473 0.707 0 CA-C-O 122.248 1.023 . . . . 3.05 112.041 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 36.0 t -82.48 154.11 25.28 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.189 -0.914 . . . . 3.02 109.907 157.601 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -49.49 -34.42 16.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.211 1.004 . . . . 2.22 112.027 170.679 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 99.7 p -61.73 -15.75 43.4 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.194 1.183 . . . . 1.62 114.194 177.669 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 69.7 m -65.89 -37.2 85.5 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.931 1.242 . . . . 1.28 112.208 169.442 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.42 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 17.8 t80 -58.42 -49.23 78.03 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.184 1.357 . . . . 2.61 113.295 -173.793 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 16.2 ptt85 -57.54 -12.44 2.73 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.286 1.034 . . . . 3.3 113.215 174.243 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -109.82 -42.79 4.16 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 125.93 1.692 . . . . 3.31 114.303 179.374 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -40.95 -49.88 3.26 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.885 1.674 . . . . 2.03 110.217 163.135 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.6 mt -61.63 -24.64 66.85 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 114.633 1.346 . . . . 1.2 114.633 177.849 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -103.83 2.78 33.13 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.411 1.46 . . . . 2.54 114.124 175.91 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.09 -44.17 4.44 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.448 1.099 . . . . 1.57 113.22 167.246 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -96.9 -15.58 21.12 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.803 1.241 . . . . 3.64 114.222 -178.777 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.91 26.17 8.28 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.286 1.834 . . . . 1.82 112.271 176.265 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -68.76 -16.12 63.71 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 116.046 1.869 . . . . 1.32 116.046 -167.868 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -93.54 -38.23 11.49 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 119.644 1.111 . . . . 1.74 110.509 -175.141 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 36.5 mtm -77.64 -10.19 59.38 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 113.914 1.079 . . . . 2.63 113.914 167.808 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.49 44.04 0.07 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.692 1.997 . . . . 2.38 111.946 167.413 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.78 29.72 0.26 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.84 1.656 . . . . 4.56 113.598 -167.801 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -174.41 163.89 3.75 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.308 2.643 . . . . 6.62 108.886 -161.991 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 47.2 m -107.43 -17.94 13.99 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 125.384 1.474 . . . . 2.75 112.816 178.054 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -65.77 -41.69 95.57 Favored Glycine 0 CA--C 1.528 0.878 0 CA-C-N 119.234 0.924 . . . . 2.24 112.036 175.44 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -57.53 -43.25 84.18 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 117.816 0.808 . . . . 3.33 112.643 174.066 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.39 -50.27 72.08 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 124.133 0.973 . . . . 4.95 112.957 171.395 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -61.57 -33.01 73.14 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.835 0.743 . . . . 3.12 112.02 177.838 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . 0.508 ' HA ' ' HG2' ' B' ' 164' ' ' LYS . . . -68.07 -15.74 63.72 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.395 1.257 . . . . 1.17 114.395 173.722 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.44 -44.97 23.38 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.957 0.799 . . . . 0.92 110.955 164.301 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -61.91 -40.23 94.74 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.978 0.911 . . . . 2.72 112.375 -175.722 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . 0.508 ' HG2' ' HA ' ' B' ' 161' ' ' ALA . 2.9 ptmm? -52.95 -26.31 14.71 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.133 1.16 . . . . 4.0 114.133 170.053 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 44.5 mt -83.08 -29.96 28.37 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 118.08 -0.962 . . . . 1.55 112.797 176.886 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 41.0 mm -58.33 -55.01 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 118.922 0.783 . . . . 1.21 108.933 177.868 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -61.53 -34.14 75.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.777 1.029 . . . . 2.58 113.777 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -70.24 -33.7 71.96 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.598 1.159 . . . . 3.11 111.979 175.147 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 24.3 tp -78.5 -21.96 48.16 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 123.87 0.868 . . . . 2.76 111.205 172.275 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.52 -8.85 50.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.939 1.696 . . . . 2.96 115.455 174.48 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -73.31 -3.45 27.11 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 113.84 1.052 . . . . 3.2 113.84 158.874 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -142.87 179.72 6.85 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 127.187 2.195 . . . . 3.11 111.402 -169.447 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 27.1 t60 100.71 80.42 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 128.461 2.704 . . . . 5.52 112.027 160.364 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -72.57 42.57 0.1 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 129.036 2.935 . . . . 6.5 114.404 -167.773 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 75.93 -17.73 3.58 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 126.127 1.822 . . . . 3.29 114.671 -179.499 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -87.57 -155.89 0.32 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.8 1.64 . . . . 7.06 111.727 177.91 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.4 mm -145.98 136.09 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 128.213 2.605 . . . . 3.29 106.134 178.406 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.5 m -113.88 153.14 29.71 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.606 0.762 . . . . 2.04 111.257 159.894 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -65.17 -42.43 93.68 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 112.743 0.646 . . . . 1.87 112.743 -176.268 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -68.97 -14.27 62.94 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.877 1.271 . . . . 4.33 113.087 -173.986 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -56.59 -57.98 10.02 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.8 0.84 . . . . 4.11 109.822 174.157 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -54.12 -39.71 66.67 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.026 -1.047 . . . . 2.51 112.611 178.354 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -70.68 -53.9 13.93 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.749 0.648 . . . . 1.39 112.749 -179.259 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -62.75 -20.42 64.93 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.701 1.2 . . . . 1.6 113.117 -178.24 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.42 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 95.9 mt -76.38 -41.11 49.08 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.83 -1.169 . . . . 0.61 113.933 168.143 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 13.8 mm -58.39 -46.26 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 CA-C-N 120.935 1.698 . . . . 0.75 112.278 -173.976 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.65 -21.72 60.9 Favored Glycine 0 CA--C 1.533 1.2 0 CA-C-N 118.441 0.564 . . . . 0.67 113.4 177.33 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.05 -8.78 65.45 Favored Glycine 0 CA--C 1.535 1.287 0 O-C-N 121.078 -1.248 . . . . 0.89 114.183 175.845 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.2 mp -120.39 -37.76 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 126.035 1.734 . . . . 1.32 111.544 166.222 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 8.0 m -78.87 78.76 5.3 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.223 1.809 . . . . 1.4 108.088 177.974 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -169.06 -65.78 0.03 OUTLIER Glycine 0 CA--C 1.524 0.627 0 CA-C-O 118.282 -1.288 . . . . 0.91 111.127 -174.644 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -57.74 -62.89 0.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.906 2.404 . . . . 0.94 110.817 166.05 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.1 pp -74.96 -14.66 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.903 1.229 . . . . 1.06 113.142 -177.535 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.28 -36.41 84.02 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.599 0.592 . . . . 1.0 112.599 176.514 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -62.93 -41.4 99.47 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 120.624 -1.298 . . . . 4.16 111.454 171.417 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.97 -37.09 73.56 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.261 1.424 . . . . 1.59 113.019 174.14 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 84.9 mt -54.35 -54.15 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 O-C-N 121.094 -1.004 . . . . 0.92 110.755 169.032 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -67.71 -34.62 77.24 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.478 0.918 . . . . 1.71 113.478 -175.495 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -74.14 -20.24 60.3 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 118.521 -0.752 . . . . 3.66 112.268 173.758 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -78.61 -40.85 33.28 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 114.996 1.48 . . . . 2.21 114.996 172.924 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -62.98 -13.65 37.79 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 120.72 1.6 . . . . 2.36 112.144 174.133 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.08 -71.5 0.71 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.308 1.443 . . . . 2.44 109.616 175.974 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 . . . . . 0 N--CA 1.484 1.229 1 C-N-CA 134.251 5.02 . . . . 4.47 116.092 172.814 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 109.808 -0.441 . . . . 2.32 109.808 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -88.16 146.01 25.62 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.893 -0.78 . . . . 1.07 108.893 159.01 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -67.26 -23.9 65.74 Favored 'General case' 0 C--O 1.212 -0.899 0 CA-C-O 117.325 -1.322 . . . . 2.93 112.172 177.978 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -49.82 72.96 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 121.828 2.104 . . . . 1.02 109.5 173.487 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -66.52 -55.13 16.95 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 119.294 -0.384 . . . . 2.86 111.752 -176.45 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.2 tptt -63.33 -25.51 68.34 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.868 -1.145 . . . . 6.56 113.823 175.121 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.754 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -67.7 -43.94 78.9 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.082 -1.637 . . . . 0.54 112.571 166.072 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 19.0 t -56.89 -39.93 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.317 1.417 . . . . 0.68 110.262 170.212 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.6 mt -58.61 -52.39 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-O 118.052 -0.975 . . . . 1.11 111.281 169.623 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.3 t -57.39 -36.34 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 125.248 1.419 . . . . 0.57 112.585 178.868 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.25 -41.01 74.07 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 121.268 -0.895 . . . . 0.96 111.877 174.128 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.16 -44.82 95.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.077 0.551 . . . . 0.65 111.041 176.076 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -62.72 -41.6 99.23 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 119.074 -0.488 . . . . 3.54 110.719 173.707 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.477 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 10.4 t30 -62.4 -23.91 67.1 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.408 1.262 . . . . 2.15 114.408 -174.585 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -78.02 -59.13 2.91 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.206 1.002 . . . . 1.88 111.063 169.666 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -62.31 -31.88 72.55 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.543 0.942 . . . . 2.12 113.543 -174.967 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.477 ' HD3' ' HA ' ' A' ' 18' ' ' ASN . 9.2 ptmt -56.4 -22.14 29.62 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 120.241 1.382 . . . . 2.67 114.148 176.746 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -88.72 -12.69 41.57 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.137 1.162 . . . . 2.73 114.137 175.98 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 28.8 m . . . . . 0 N--CA 1.482 1.166 0 CA-C-N 120.094 1.316 . . . . 2.57 111.78 -179.004 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 31.6 pt . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 110.147 -0.316 . . . . 2.9 110.147 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.5 m -88.07 159.14 18.38 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.055 -1.028 . . . . 2.67 111.347 171.611 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -43.2 -35.07 1.27 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.365 1.866 . . . . 2.4 115.574 -179.451 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.5 m -56.42 -29.98 62.23 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.897 1.443 . . . . 2.04 114.897 174.153 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.1 m -81.33 -18.88 44.16 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.754 1.02 . . . . 1.24 113.754 -173.362 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 63.8 t80 -64.85 -51.7 60.62 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.421 1.01 . . . . 2.1 110.932 174.164 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.4 ptt180 -65.23 -31.77 73.09 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.319 0.647 . . . . 2.17 112.458 179.673 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -70.45 -52.28 23.27 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.494 1.118 . . . . 3.9 110.057 174.741 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -50.25 -43.23 52.98 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 121.179 -0.951 . . . . 1.3 111.88 172.072 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.403 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 12.6 mt -62.28 -15.31 46.7 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 115.921 1.823 . . . . 1.04 115.921 174.617 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -106.66 -7.75 17.21 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.314 1.416 . . . . 2.62 114.144 169.705 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -56.26 4.33 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.647 1.112 . . . . 3.12 110.97 160.809 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -85.64 -48.42 8.89 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.26 0.624 . . . . 2.63 111.624 -167.868 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 tt -106.14 50.24 0.78 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.14 1.376 . . . . 2.03 110.841 -168.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -94.5 -20.96 19.2 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 117.267 2.321 . . . . 1.35 117.267 -170.758 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.15 -26.8 39.18 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 121.786 2.085 . . . . 1.66 112.962 -177.071 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.1 tpp -65.94 24.84 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 128.965 2.906 . . . . 1.68 115.66 175.949 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.2 mp -109.62 128.3 55.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 128.108 2.563 . . . . 3.4 110.874 -173.611 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.7 m -106.22 -17.68 14.23 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.741 1.216 . . . . 4.18 112.789 172.765 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -177.15 166.58 2.39 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 129.24 3.016 . . . . 4.3 108.289 -173.389 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -27.59 -50.32 0.06 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 128.787 2.835 . . . . 2.28 112.754 156.415 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.31 -38.48 49.76 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.725 1.631 . . . . 1.56 114.484 -176.943 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -60.78 -33.01 72.32 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.317 1.058 . . . . 3.88 112.003 178.55 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.72 -39.7 18.2 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.754 1.222 . . . . 8.14 112.876 171.016 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.3 mmmt -61.38 -30.41 70.52 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.902 1.228 . . . . 3.28 112.814 179.862 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -48.78 -47.49 41.85 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.954 0.902 . . . . 1.21 112.789 165.73 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.41 -41.66 98.72 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.077 1.351 . . . . 0.73 112.241 174.692 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -61.41 -36.68 80.99 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.348 0.659 . . . . 2.27 112.566 178.077 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.9 mtmt -52.3 -37.77 56.65 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.437 1.017 . . . . 3.42 112.499 174.378 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.5 mt -72.27 -31.53 65.85 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.551 1.54 . . . . 0.85 112.992 -179.024 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.46 -36.26 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 118.555 0.616 . . . . 0.92 111.125 175.476 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -64.76 -50.25 67.56 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.29 1.436 . . . . 2.57 111.047 173.596 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -56.05 -29.95 61.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.99 0.916 . . . . 3.42 112.301 178.147 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.5 mt -89.25 -18.2 27.51 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 114.763 1.394 . . . . 2.77 114.763 177.189 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.36 -22.18 66.87 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.382 0.992 . . . . 3.85 112.665 169.999 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.9 -18.74 46.17 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.363 1.616 . . . . 2.65 115.363 168.892 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -129.95 -19.1 3.29 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 116.179 1.918 . . . . 2.84 116.179 -166.008 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -144.28 154.44 43.07 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.6 1.091 . . . . 4.88 113.267 -155.037 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.7 t0 99.38 158.38 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 129.848 3.259 . . . . 8.38 108.903 -176.404 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 74.1 -54.68 2.26 Favored Glycine 0 CA--C 1.533 1.186 0 O-C-N 120.561 -1.337 . . . . 3.58 110.999 -160.417 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -105.32 142.82 34.42 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.429 1.492 . . . . 6.09 110.541 158.311 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.6 mm -104.67 149.05 8.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 N-CA-C 107.769 -1.197 . . . . 2.46 107.769 163.229 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.4 t -125.41 145.55 50.01 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.28 1.032 . . . . 1.54 108.563 174.064 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -72.63 -51.72 18.4 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 122.418 1.104 . . . . 2.02 111.475 -170.51 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -42.66 -38.01 1.9 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 129.866 3.266 . . . . 3.24 114.416 170.799 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -67.53 -37.82 83.32 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.658 0.984 . . . . 4.93 113.658 -177.288 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -60.83 -47.92 84.15 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 120.54 1.518 . . . . 1.8 111.248 172.437 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -63.44 -39.59 94.89 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 119.102 -0.475 . . . . 0.54 110.817 -179.509 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 95.2 m -57.22 -52.74 64.12 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.425 1.49 . . . . 1.95 110.296 171.15 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 27.8 mt -52.5 -44.33 65.61 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 118.247 -0.882 . . . . 0.84 113.293 178.378 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 30.3 mm -55.49 -37.0 43.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 120.072 1.305 . . . . 0.59 111.955 -175.585 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.09 -15.68 58.8 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.031 0.824 . . . . 0.6 114.447 176.773 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.73 -16.2 77.88 Favored Glycine 0 CA--C 1.534 1.236 0 CA-C-N 118.699 1.25 . . . . 0.86 113.682 172.006 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 mp -103.42 -53.31 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-N 118.638 1.219 . . . . 0.99 109.368 167.669 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.1 m -73.92 61.75 0.81 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 128.002 2.521 . . . . 1.38 109.326 171.25 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -139.14 -78.3 0.06 OUTLIER Glycine 0 CA--C 1.527 0.812 0 C-N-CA 125.87 1.7 . . . . 0.89 110.017 174.066 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -58.8 -49.19 12.16 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.122 2.548 . . . . 0.99 111.669 179.034 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -75.95 -10.98 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 114.105 1.15 . . . . 1.02 114.105 176.32 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.59 -38.12 74.01 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.213 -0.929 . . . . 1.16 112.641 -176.155 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -59.94 -39.73 86.54 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 120.432 1.469 . . . . 2.66 111.165 165.309 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.78 -38.13 74.92 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 124.301 1.041 . . . . 1.28 111.374 -178.667 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.5 mt -50.17 -57.77 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.623 1.101 . . . . 1.02 111.076 169.963 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 79.1 t60 -75.68 -5.15 44.17 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 114.148 1.166 . . . . 1.76 114.148 -176.852 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.265 1.9 pt-20 -107.52 -11.43 15.49 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 119.841 -1.787 . . . . 3.2 114.014 167.461 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -83.63 -45.45 13.45 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.877 1.671 . . . . 2.58 110.13 171.144 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -73.71 11.49 0.83 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 123.879 1.799 . . . . 2.88 111.524 176.185 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 . . . . . 0 C--N 1.327 -0.405 0 C-N-CA 126.862 2.065 . . . . 2.01 110.411 165.878 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 . . . . . 0 N--CA 1.486 1.366 0 N-CA-C 108.806 -0.813 . . . . 2.54 108.806 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.3 p -99.63 150.37 22.33 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.068 0.849 . . . . 1.0 109.477 162.343 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -69.57 -22.6 63.52 Favored 'General case' 0 C--O 1.212 -0.88 0 CA-C-O 117.545 -1.217 . . . . 2.96 112.643 178.232 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -53.79 53.38 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 121.954 2.161 . . . . 1.0 109.084 171.915 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -53.45 52.4 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 122.763 0.425 . . . . 2.56 110.897 -177.367 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -65.35 -27.37 68.53 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 120.969 -1.082 . . . . 7.4 113.858 177.045 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.754 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -66.19 -39.89 90.01 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.042 -1.661 . . . . 0.52 113.156 165.217 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 34.8 t -57.54 -39.79 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 120.718 1.599 . . . . 0.63 110.126 169.354 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 2.9 mt -58.38 -54.05 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-O 118.332 -0.842 . . . . 1.25 112.254 169.041 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 20.4 t -56.47 -44.04 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 125.903 1.681 . . . . 0.68 112.922 179.467 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.2 mp -64.46 -44.73 90.16 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.492 1.117 . . . . 1.08 110.967 178.244 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 55.8 t -65.73 -40.97 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 118.692 -0.67 . . . . 0.7 111.157 179.409 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.64 -42.76 84.07 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.773 0.715 . . . . 3.38 111.608 168.292 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.35 -23.98 67.09 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.016 1.487 . . . . 2.15 115.016 -175.344 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -79.36 -59.4 2.77 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.4 0.68 . . . . 2.12 111.065 168.71 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -61.98 -31.71 72.1 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.563 0.949 . . . . 2.12 113.563 -173.69 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -55.68 -21.25 17.33 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.318 1.447 . . . . 2.47 114.159 176.708 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -89.06 -15.38 34.16 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.096 1.147 . . . . 2.55 114.096 175.796 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.48 1.057 0 CA-C-N 119.723 1.147 . . . . 2.61 111.919 -178.12 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 30.8 pt . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 109.468 -0.567 . . . . 2.98 109.468 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 47.0 m -92.85 163.63 13.64 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.939 -1.101 . . . . 2.68 111.704 172.161 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -39.28 -41.05 0.84 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.691 1.996 . . . . 2.65 115.338 178.393 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.1 m -57.92 -29.56 65.21 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.349 1.24 . . . . 1.99 114.349 179.154 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 36.8 m -79.58 -21.13 45.43 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.777 1.029 . . . . 1.33 113.777 -173.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.434 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 56.0 t80 -64.7 -52.42 57.26 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.187 0.903 . . . . 1.8 110.829 174.517 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -65.87 -31.72 72.83 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 122.974 0.51 . . . . 2.44 112.296 179.487 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -69.05 -51.22 41.18 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.888 0.875 . . . . 3.97 110.409 174.163 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -51.8 -42.82 62.77 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.552 1.141 . . . . 1.14 112.434 173.107 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 15.2 mt -60.12 -13.59 12.77 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.87 1.668 . . . . 1.06 115.492 173.415 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.26 -2.85 15.56 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.367 1.439 . . . . 2.65 114.061 170.488 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.52 -56.38 3.77 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.381 0.991 . . . . 3.15 110.756 159.653 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -88.38 -43.41 11.52 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 122.011 -0.43 . . . . 2.63 111.358 -166.578 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 tt -111.33 46.95 1.05 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.067 1.747 . . . . 2.06 110.643 -169.795 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -93.7 -14.21 26.6 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 116.303 1.964 . . . . 1.38 116.303 -170.872 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.57 -19.06 26.81 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 121.082 1.765 . . . . 1.46 112.311 -178.67 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.7 tpp -72.48 24.38 0.05 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 127.405 2.282 . . . . 1.69 114.158 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 9.6 mp -110.51 128.42 55.62 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.681 2.392 . . . . 3.33 110.761 -169.809 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 4.2 m -103.33 -21.58 13.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.665 1.186 . . . . 4.28 112.327 171.737 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -173.66 167.94 4.45 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.126 2.971 . . . . 4.57 107.978 -173.98 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -27.7 -49.64 0.05 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 128.491 2.716 . . . . 2.47 112.546 156.265 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.59 -38.83 36.5 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 126.017 1.77 . . . . 1.62 114.825 -177.63 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -62.1 -35.42 78.63 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.517 1.158 . . . . 3.87 111.855 179.567 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . 0.42 ' HA ' HH11 ' B' ' 159' ' ' ARG . 0.0 OUTLIER -84.01 -36.43 23.14 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.623 1.169 . . . . 8.57 112.544 172.37 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -61.06 -30.35 70.28 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.725 1.148 . . . . 3.39 113.171 175.566 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -52.7 -44.07 66.07 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.193 0.997 . . . . 1.1 112.816 167.577 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -65.01 -42.84 94.1 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.161 1.384 . . . . 0.67 111.446 173.323 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -61.29 -35.95 78.73 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.582 0.956 . . . . 2.05 113.582 178.314 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -51.95 -37.98 54.87 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.411 1.005 . . . . 3.33 112.192 172.786 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 17.9 mt -72.03 -39.21 69.29 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 125.28 1.432 . . . . 0.68 113.015 -178.14 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 30.7 mm -52.27 -34.68 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 125.101 1.361 . . . . 0.9 111.98 175.825 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -61.94 -52.24 64.85 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.715 1.206 . . . . 2.71 111.617 173.953 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -63.2 -32.44 73.84 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.608 1.163 . . . . 3.57 112.478 177.649 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.09 -26.0 64.71 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.661 1.984 . . . . 3.19 111.947 172.43 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.06 -25.35 64.41 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.866 1.061 . . . . 3.69 113.866 172.242 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.65 -24.1 39.22 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.076 1.139 . . . . 2.61 114.076 174.23 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -121.92 -19.36 6.72 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 116.248 1.944 . . . . 2.72 116.248 -167.138 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -138.49 158.41 44.31 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.08 1.309 . . . . 4.77 114.147 -157.276 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.5 t0 98.35 157.9 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 129.698 3.199 . . . . 8.27 108.633 -179.231 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.65 -58.23 2.1 Favored Glycine 0 CA--C 1.532 1.113 0 O-C-N 120.635 -1.291 . . . . 3.61 110.716 -159.493 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 -101.06 139.14 37.16 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.639 1.176 . . . . 6.1 110.662 157.886 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 42.0 mm -102.17 144.74 12.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 107.623 -1.251 . . . . 2.7 107.623 164.599 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.1 t -117.53 144.07 45.46 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.321 -0.992 . . . . 1.57 108.321 172.192 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -74.31 -52.84 11.05 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 122.891 1.329 . . . . 2.11 111.163 -171.867 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -42.89 -35.34 1.17 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 129.979 3.312 . . . . 3.19 114.927 168.056 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -67.31 -38.5 85.05 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.904 0.705 . . . . 4.66 112.904 -178.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -58.81 -48.34 81.63 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.122 -1.612 . . . . 1.91 111.168 172.202 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 27.7 t-105 -63.38 -41.29 98.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.85 0.46 . . . . 0.57 110.898 -178.706 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 90.1 m -56.06 -52.44 64.27 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.391 1.477 . . . . 1.97 110.354 172.102 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.434 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 25.8 mt -56.6 -43.37 80.07 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 113.684 0.994 . . . . 0.71 113.684 179.635 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 28.5 mm -53.33 -38.85 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-N 120.22 1.373 . . . . 0.58 111.685 -178.254 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.61 -16.89 59.43 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.17 0.891 . . . . 0.56 114.295 177.89 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.72 -13.88 80.71 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 118.682 1.241 . . . . 0.89 113.713 172.685 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -102.57 -54.85 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-N 118.758 1.279 . . . . 0.99 109.007 165.16 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 24.7 m -73.71 64.52 0.93 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 127.316 2.246 . . . . 1.54 108.935 171.582 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -143.64 -79.78 0.05 OUTLIER Glycine 0 CA--C 1.524 0.6 0 C-N-CA 125.601 1.572 . . . . 0.95 109.892 177.396 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -60.33 -46.72 16.9 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.027 2.485 . . . . 1.14 111.894 178.57 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.9 pt -77.42 -10.29 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 N-CA-C 114.023 1.12 . . . . 1.0 114.023 176.764 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . 0.405 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -68.45 -39.21 81.54 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 120.791 -1.193 . . . . 1.07 113.022 -176.804 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -59.4 -46.15 89.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.911 -1.118 . . . . 2.79 111.289 167.291 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 9.3 tt -53.07 -41.81 65.24 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 124.013 0.925 . . . . 1.8 111.487 179.199 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . 0.405 HD12 ' HA ' ' B' ' 194' ' ' ALA . 88.9 mt -49.76 -59.39 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-N 119.521 1.055 . . . . 1.07 111.544 171.2 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -70.94 -15.92 62.62 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.809 -1.182 . . . . 1.71 113.429 -178.361 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -78.97 -12.67 60.04 Favored 'General case' 0 CA--C 1.551 0.984 0 O-C-N 120.468 -1.395 . . . . 3.69 112.187 167.534 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -111.72 -31.75 6.87 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.954 1.702 . . . . 3.6 114.439 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -63.77 -6.65 6.02 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 121.241 1.837 . . . . 2.62 111.922 164.37 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -108.12 -80.16 0.57 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.356 1.462 . . . . 2.03 111.272 168.206 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 . . . . . 0 N--CA 1.477 0.895 0 C-N-CA 130.783 3.633 . . . . 3.84 115.433 -178.028 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.142 0 N-CA-C 117.13 2.271 . . . . 3.03 117.13 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.3 p 53.19 -172.4 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.33 2.652 . . . . 2.06 111.21 -162.465 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -94.04 -40.63 9.98 Favored 'General case' 0 C--O 1.222 -0.388 0 O-C-N 120.902 -1.124 . . . . 2.77 110.865 158.044 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.12 -38.83 74.02 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.763 0.825 . . . . 0.93 111.02 -171.087 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -69.53 -62.92 1.19 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 118.631 -0.7 . . . . 2.53 111.105 -178.66 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -54.43 -29.76 50.38 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 120.429 1.468 . . . . 6.14 113.743 172.495 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.83 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -70.36 -43.78 69.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 120.186 1.357 . . . . 0.52 111.254 173.341 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.0 t -57.24 -42.61 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 121.008 1.731 . . . . 0.81 110.429 168.089 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.7 mt -55.32 -46.87 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-N 119.712 1.142 . . . . 1.09 111.55 171.344 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.0 t -64.41 -41.34 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 120.234 1.379 . . . . 0.63 112.57 178.541 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.7 mp -64.21 -35.84 82.13 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.384 0.673 . . . . 0.97 111.308 175.01 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.1 t -73.66 -35.72 44.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.707 1.603 . . . . 0.9 112.176 175.018 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -61.04 -58.02 10.17 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.309 1.044 . . . . 3.73 109.987 176.435 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.448 HD21 ' CE ' ' A' ' 41' ' ' MET . 24.3 t30 -55.77 -14.96 2.62 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.17 1.544 . . . . 2.29 115.17 179.764 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -80.03 -66.07 0.92 Allowed 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.367 -1.458 . . . . 2.09 111.613 162.592 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -62.41 -26.95 68.76 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.174 1.176 . . . . 2.54 114.174 -172.724 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.567 ' HE3' ' CE1' ' A' ' 22' ' ' TYR . 5.7 ttpp -50.47 -19.94 1.0 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.802 2.041 . . . . 5.15 115.108 174.793 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.567 ' CE1' ' HE3' ' A' ' 21' ' ' LYS . 91.5 m-85 -103.7 -11.73 17.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.103 1.361 . . . . 2.77 114.103 177.15 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.471 0.616 0 CA-C-N 118.927 0.785 . . . . 3.07 110.877 176.036 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.8 tt . . . . . 0 N--CA 1.471 0.608 0 CA-C-O 123.207 1.48 . . . . 2.71 108.961 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -64.44 165.64 9.52 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 114.803 -1.089 . . . . 2.73 109.06 169.42 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.488 ' HB3' HG23 ' A' ' 63' ' ' ILE . 3.6 mppt? -45.37 -33.75 2.68 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.941 1.089 . . . . 2.51 113.941 173.486 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 6.9 m -58.44 -33.76 70.07 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.893 1.442 . . . . 2.03 114.893 174.707 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.0 m -85.62 -37.64 19.29 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.087 0.858 . . . . 1.31 111.72 -177.859 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.487 ' CE2' HD11 ' A' ' 42' ' ' LEU . 79.7 t80 -58.57 -49.52 77.12 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.295 -0.878 . . . . 2.44 111.818 179.177 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -59.78 -29.65 68.35 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.107 1.151 . . . . 3.15 114.107 177.771 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -86.29 -51.1 6.46 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.746 1.618 . . . . 3.39 110.312 -176.242 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . 0.448 ' CE ' HD21 ' A' ' 18' ' ' ASN . 15.4 tmm? -51.25 -37.27 46.16 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.751 1.22 . . . . 1.5 112.439 170.411 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.487 HD11 ' CE2' ' A' ' 38' ' ' PHE . 16.8 mt -70.29 -4.44 22.0 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 116.282 1.956 . . . . 1.55 116.282 174.618 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -103.7 -4.29 23.92 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.489 1.495 . . . . 2.23 114.009 163.11 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -54.11 3.53 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.19 0.996 . . . . 1.88 113.027 168.776 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -84.91 -22.45 29.28 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.199 1.555 . . . . 3.14 115.199 -166.205 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.403 HD23 ' HG3' ' B' ' 112' ' ' GLU . 1.9 mt -126.73 50.55 1.93 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.889 2.076 . . . . 1.89 108.504 -177.488 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -91.13 -23.14 20.37 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.519 1.303 . . . . 1.59 114.519 -166.323 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.423 ' NE2' ' HA ' ' B' ' 108' ' ' TYR . 22.7 m-70 -90.91 -33.93 15.41 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.285 1.034 . . . . 1.45 112.464 -170.785 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.7 ptp -66.91 -4.51 9.61 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.343 1.457 . . . . 3.21 114.275 173.756 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.3 tp -76.11 117.57 17.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 125.961 1.704 . . . . 3.01 111.837 -161.163 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.1 m -75.61 56.62 0.91 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.89 -1.131 . . . . 5.14 111.348 161.19 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.565 ' CG ' ' H ' ' A' ' 53' ' ' THR . 33.4 t70 52.32 -150.52 0.32 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 127.806 2.443 . . . . 4.66 113.913 175.467 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.565 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 52.7 p -54.82 -32.46 60.47 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 127.953 2.501 . . . . 2.53 112.092 170.192 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.91 -50.89 52.9 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 124.431 1.015 . . . . 1.67 111.583 174.949 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.23 -36.95 82.75 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 117.492 0.646 . . . . 3.53 112.603 173.481 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.475 HH22 ' HB3' ' A' ' 42' ' ' LEU . 2.0 mmp_? -56.01 -34.15 65.54 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.417 -1.427 . . . . 5.5 113.089 -178.369 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -64.37 -22.25 66.89 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.858 1.429 . . . . 4.03 114.858 173.165 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.83 -17.93 59.65 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.589 1.156 . . . . 1.11 114.081 169.143 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -79.41 -51.04 9.91 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.257 0.935 . . . . 0.75 110.804 163.971 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -70.49 -23.31 62.65 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.757 1.021 . . . . 2.32 113.757 -174.918 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -56.43 -30.06 62.37 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.524 1.511 . . . . 3.18 112.464 167.091 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.475 ' HB3' HD22 ' A' ' 82' ' ' LEU . 15.7 mt -81.01 -32.65 34.12 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.663 0.785 . . . . 1.13 112.109 -179.039 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.488 HG23 ' HB3' ' A' ' 35' ' ' LYS . 27.0 mm -60.36 -49.68 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.115 1.366 . . . . 1.02 111.489 174.858 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -64.05 -38.01 89.5 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.347 0.659 . . . . 2.22 112.074 175.794 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -61.97 -30.95 71.27 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.95 0.9 . . . . 3.33 112.876 175.221 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.7 mt -88.51 -19.4 26.47 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 114.847 1.425 . . . . 2.49 114.847 169.992 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -20.26 64.13 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.884 1.674 . . . . 3.64 112.122 170.481 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.37 -17.68 51.23 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.556 1.687 . . . . 2.18 115.556 166.61 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -118.22 -21.83 7.99 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.673 1.578 . . . . 2.88 114.476 -174.272 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.05 160.61 42.98 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.503 1.047 . . . . 4.35 112.115 -162.674 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -98.27 -116.05 0.14 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.432 1.893 . . . . 6.12 111.829 -175.108 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -90.24 -3.33 72.73 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 125.425 1.488 . . . . 4.63 113.471 159.07 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.4 mmt-85 -84.48 165.44 18.1 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.314 1.557 . . . . 8.36 112.304 164.538 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.3 pp -149.56 156.06 7.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 130.264 3.426 . . . . 3.46 107.787 174.109 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.4 t -97.77 175.32 6.21 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.588 1.155 . . . . 1.71 112.27 167.047 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -66.51 -54.61 21.97 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.366 1.066 . . . . 2.52 112.643 178.295 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.52 -30.42 70.62 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 126.232 1.813 . . . . 2.98 111.655 -175.936 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -64.3 -54.38 34.09 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 117.79 -1.1 . . . . 3.94 111.014 175.415 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -50.9 -48.14 60.53 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 120.642 1.564 . . . . 2.44 111.955 177.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.8 t-105 -60.94 -43.13 99.08 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 119.292 -0.385 . . . . 0.69 111.54 179.659 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 87.2 m -60.87 -39.5 89.4 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.398 1.479 . . . . 1.82 111.966 173.17 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.475 HD22 ' HB3' ' A' ' 62' ' ' LEU . 94.1 mt -60.68 -55.39 33.81 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-O 118.121 -0.942 . . . . 0.83 110.35 177.013 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.4 mm -47.52 -42.36 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 CA-C-N 119.583 1.083 . . . . 0.83 112.919 -176.82 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.15 -30.06 69.77 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-O 118.943 -0.92 . . . . 0.72 113.292 177.479 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.14 -21.64 64.81 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 118.259 -1.301 . . . . 0.58 115.423 -177.366 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.0 mp -86.14 -39.67 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 CA-C-N 119.231 1.515 . . . . 1.32 110.587 168.537 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 33.8 m -69.73 -39.91 76.53 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.979 1.711 . . . . 3.26 111.549 -174.671 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -27.49 -67.02 0.07 OUTLIER Glycine 0 CA--C 1.535 1.332 0 C-N-CA 128.241 2.829 . . . . 1.09 116.391 -175.396 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.8 -33.56 2.18 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.147 2.565 . . . . 0.97 113.41 -173.626 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.4 pt -82.72 -20.97 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 118.981 0.81 . . . . 1.4 113.177 -175.987 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -52.68 -50.29 63.58 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.072 2.149 . . . . 0.94 113.107 -178.175 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -48.11 -53.7 15.73 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.744 0.783 . . . . 3.6 110.981 172.888 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.95 -38.35 76.1 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 118.211 -0.9 . . . . 2.1 111.549 -172.925 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 25.7 mt -47.6 -62.87 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.458 1.103 . . . . 1.91 111.4 165.996 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -59.8 -42.37 93.28 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.959 0.8 . . . . 1.86 111.245 -177.164 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.394 3.3 pt-20 -77.32 -9.01 58.57 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 121.226 -0.921 . . . . 2.87 112.534 -178.505 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -88.17 -26.59 22.34 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 116.589 2.07 . . . . 2.34 116.589 165.096 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -68.74 0.25 4.51 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 120.62 1.554 . . . . 2.94 111.576 169.866 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 . . . . . 0 CA--C 1.532 0.285 0 C-N-CA 127.682 2.393 . . . . 3.26 110.84 -176.213 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.423 ' HA ' ' NE2' ' A' ' 48' ' ' HIS . 0.3 OUTLIER . . . . . 0 CA--C 1.556 1.206 0 N-CA-C 115.446 1.647 . . . . 3.04 115.446 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 14.2 p 47.41 -161.0 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 127.974 2.509 . . . . 2.39 111.081 -153.93 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -102.28 -33.99 9.39 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 120.082 1.31 . . . . 2.62 111.487 149.071 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.11 -42.17 72.61 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.337 0.655 . . . . 0.87 109.763 -169.727 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . 0.403 ' HG3' HD23 ' A' ' 46' ' ' LEU . 17.1 tt0 -64.43 -64.11 0.96 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.499 -1.238 . . . . 2.55 111.485 176.464 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -51.84 -31.79 29.18 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 121.762 2.074 . . . . 6.75 114.095 177.155 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.83 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -74.55 -41.34 60.75 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.789 1.177 . . . . 0.72 112.501 174.983 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 39.5 t -60.0 -42.91 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-N 120.55 1.523 . . . . 1.07 110.107 166.71 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 6.3 mt -54.36 -48.79 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-O 117.812 -1.089 . . . . 1.28 109.919 171.061 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.6 t -60.59 -43.06 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 120.643 1.565 . . . . 0.81 112.859 177.677 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 3.6 mp -60.44 -41.99 95.19 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.958 0.799 . . . . 1.16 111.997 173.939 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 40.2 t -69.39 -41.23 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 125.477 1.511 . . . . 1.11 111.985 177.659 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.91 -57.07 14.18 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 124.401 1.081 . . . . 4.11 108.326 179.235 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -52.43 -24.75 8.41 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.461 1.282 . . . . 2.29 114.461 -178.775 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -74.08 -62.96 1.33 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.453 1.024 . . . . 2.25 112.079 168.672 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -62.49 -25.77 68.18 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.298 0.851 . . . . 2.62 113.298 -176.294 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -43.56 -30.27 0.57 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.345 2.658 . . . . 3.01 115.338 172.062 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -96.21 -13.3 23.58 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.999 1.111 . . . . 2.67 113.999 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . 0.256 4.4 m . . . . . 0 CA--C 1.543 0.695 0 CA-C-O 121.893 0.854 . . . . 3.03 111.898 -174.179 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 4.4 tt . . . . . 0 N--CA 1.471 0.583 0 CA-C-O 122.922 1.344 . . . . 2.53 110.12 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 10.5 m -61.79 160.63 11.55 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.188 -0.914 . . . . 2.81 109.406 165.192 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . 0.548 ' HB3' HG23 ' B' ' 166' ' ' ILE . 2.4 mppt? -43.71 -31.83 0.88 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 115.461 1.652 . . . . 2.48 115.461 177.103 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.7 m -55.07 -34.88 63.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.628 1.571 . . . . 1.94 115.067 173.836 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.5 m -78.55 -41.54 31.8 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.726 1.148 . . . . 1.31 111.947 -179.936 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.489 ' CE2' HD11 ' B' ' 145' ' ' LEU . 79.9 t80 -57.74 -45.84 85.28 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 120.997 -1.064 . . . . 2.21 112.401 -177.191 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -63.24 -27.84 69.63 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.929 1.085 . . . . 3.37 113.929 177.675 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -87.19 -49.67 7.13 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 124.445 1.098 . . . . 3.38 109.629 -177.681 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 14.4 tmm? -50.21 -37.65 36.38 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.741 2.017 . . . . 1.38 113.127 171.63 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . 0.489 HD11 ' CE2' ' B' ' 141' ' ' PHE . 17.5 mt -68.7 -0.6 5.48 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 116.799 2.148 . . . . 1.72 116.799 174.037 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -114.94 11.2 16.5 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.087 1.143 . . . . 2.05 114.087 161.221 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.44 -56.8 2.21 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.816 1.246 . . . . 1.84 112.993 166.806 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -75.97 -27.21 57.42 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.009 -1.057 . . . . 2.63 113.704 -173.014 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 2.2 mt -128.3 56.1 1.64 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 127.023 2.129 . . . . 1.85 107.929 -172.307 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -102.58 -15.76 16.29 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.481 1.512 . . . . 1.33 115.022 -166.398 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -94.96 -34.9 12.2 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 120.96 -1.087 . . . . 1.4 110.957 179.394 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 9.6 ptp -68.0 -3.06 8.85 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.533 0.938 . . . . 3.13 113.533 166.129 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 28.5 tp -71.72 105.5 3.75 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.124 -0.985 . . . . 2.85 111.049 -170.116 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 5.4 m -79.78 54.25 1.8 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.157 0.98 . . . . 4.75 111.323 169.556 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . 0.583 ' CG ' ' H ' ' B' ' 156' ' ' THR . 27.4 t70 53.23 -153.75 0.25 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 128.551 2.74 . . . . 4.78 115.018 171.786 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . 0.583 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 41.4 p -54.9 -36.36 65.09 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 128.671 2.789 . . . . 2.83 112.176 175.61 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.8 -46.73 89.65 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 123.811 0.719 . . . . 1.85 111.604 175.75 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -72.26 -34.36 68.18 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.042 0.937 . . . . 3.44 113.188 174.059 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . 0.458 HH22 ' HB3' ' B' ' 145' ' ' LEU . 2.1 mmp_? -58.49 -35.02 71.57 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.252 -1.53 . . . . 5.54 112.596 177.182 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -63.34 -25.65 68.4 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.23 1.567 . . . . 4.27 115.23 171.5 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -76.37 -18.38 58.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.134 1.161 . . . . 1.05 114.134 170.787 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.33 -52.75 7.7 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.179 0.9 . . . . 0.84 110.708 163.043 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -68.39 -25.05 64.86 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.335 0.865 . . . . 2.09 113.335 -174.091 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -57.87 -30.39 65.78 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.327 -1.483 . . . . 2.93 112.615 168.747 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . 0.453 ' HB3' HD22 ' B' ' 185' ' ' LEU . 15.9 mt -80.79 -29.87 36.03 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.314 0.646 . . . . 1.1 112.104 -177.879 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . 0.548 HG23 ' HB3' ' B' ' 138' ' ' LYS . 36.2 mm -61.13 -51.06 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.172 1.389 . . . . 1.0 111.049 174.77 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -66.01 -35.81 81.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.76 0.824 . . . . 2.16 112.604 176.348 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -62.4 -35.91 80.67 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.81 0.844 . . . . 3.24 112.03 173.763 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.6 tp -86.71 -21.39 26.65 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.593 0.96 . . . . 3.17 113.593 178.211 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -63.05 -23.65 67.55 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.894 0.877 . . . . 3.67 112.376 173.458 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.13 -11.24 60.75 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.761 1.393 . . . . 2.33 114.761 169.623 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -125.46 -23.39 4.11 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.274 1.213 . . . . 2.86 114.274 -172.417 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.26 158.16 43.5 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.433 -0.792 . . . . 4.2 112.743 -160.229 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -103.19 -118.13 0.2 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 127.392 2.277 . . . . 6.02 111.737 -172.392 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -87.41 -4.88 80.03 Favored Glycine 0 CA--C 1.534 1.279 0 CA-C-O 118.265 -1.297 . . . . 4.56 113.703 159.869 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.6 mmt-85 -83.17 164.82 19.95 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 119.783 1.791 . . . . 8.47 112.282 162.62 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 1.6 pp -146.67 153.89 12.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 129.628 3.171 . . . . 3.72 107.099 173.02 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 8.4 t -97.98 176.51 5.75 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.974 0.909 . . . . 1.62 111.43 166.246 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -74.35 -52.29 12.63 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.428 0.899 . . . . 2.41 113.428 -176.39 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -58.6 -29.28 66.33 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.453 1.901 . . . . 3.17 111.548 -179.485 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -64.5 -55.93 17.42 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-O 118.027 -0.987 . . . . 4.0 110.811 175.345 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -50.24 -49.01 54.29 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.422 1.464 . . . . 2.41 112.497 178.949 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -62.52 -40.66 97.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.926 0.49 . . . . 0.69 111.708 179.958 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 97.9 m -64.09 -37.6 88.03 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.434 1.494 . . . . 1.9 111.706 173.298 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . 0.453 HD22 ' HB3' ' B' ' 165' ' ' LEU . 87.5 mt -60.13 -51.22 70.52 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.21 0.914 . . . . 0.77 110.523 175.624 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 47.4 mm -46.3 -42.26 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-N 119.631 1.105 . . . . 0.69 113.078 -177.589 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.14 -31.65 79.65 Favored Glycine 0 CA--C 1.533 1.212 0 CA-C-O 119.193 -0.781 . . . . 0.82 113.467 178.732 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.38 -24.75 69.93 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-N 118.826 1.313 . . . . 0.69 114.528 -177.011 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -87.8 -37.51 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 CA-C-N 118.682 1.241 . . . . 1.48 111.471 169.03 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 22.8 m -80.81 -40.0 25.7 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.482 1.113 . . . . 3.31 112.612 -169.325 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -45.08 -48.18 9.92 Favored Glycine 0 CA--C 1.538 1.526 0 CA-C-O 117.416 -1.769 . . . . 0.94 116.249 -172.926 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.52 -32.88 7.4 Favored 'Trans proline' 0 C--N 1.353 0.809 0 CA-C-N 121.05 2.425 . . . . 1.09 113.05 -179.738 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 41.2 pt -85.14 -20.44 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 113.218 0.822 . . . . 1.25 113.218 179.979 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -51.89 -45.78 64.29 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 127.399 2.28 . . . . 0.87 111.967 -178.033 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -55.27 -49.18 72.73 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.11 0.564 . . . . 3.76 111.222 175.399 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.09 -35.49 61.78 Favored 'General case' 0 C--O 1.222 -0.373 0 O-C-N 121.228 -0.92 . . . . 2.1 111.675 -175.469 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 27.2 mt -48.75 -62.43 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.82 1.248 . . . . 1.75 110.421 166.457 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -60.25 -45.04 94.63 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.931 -0.481 . . . . 1.9 111.041 -176.242 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.383 3.1 pt-20 -78.39 -8.06 58.04 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.406 0.521 . . . . 2.78 112.406 -174.401 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.88 -27.8 44.04 Favored 'General case' 0 C--N 1.346 0.452 0 C-N-CA 126.551 1.941 . . . . 2.33 115.324 162.905 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -74.19 5.52 4.36 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 121.055 1.752 . . . . 2.43 111.159 172.57 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -127.94 -67.85 0.8 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.435 2.294 . . . . 2.44 110.144 -176.991 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 . . . . . 0 N--CA 1.478 0.928 0 C-N-CA 129.806 3.242 . . . . 4.42 115.803 167.441 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 . . . . . 0 CA--C 1.556 1.184 0 N-CA-C 113.45 0.908 . . . . 2.43 113.45 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.4 p -70.81 159.37 34.7 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 125.275 1.43 . . . . 1.2 111.928 -174.692 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -61.76 -39.5 91.82 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 120.469 1.486 . . . . 2.37 112.904 -178.425 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.19 -47.25 81.73 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.671 0.748 . . . . 0.77 110.469 175.082 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.66 -52.4 31.6 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.835 0.854 . . . . 2.9 111.726 -177.044 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -56.73 -32.09 65.19 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 119.842 -1.786 . . . . 5.03 113.765 169.731 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.868 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.63 -39.88 91.96 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 120.745 -1.222 . . . . 0.5 111.634 172.693 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 95.4 t -59.0 -33.67 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-N 119.401 1.001 . . . . 0.64 111.074 166.063 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.7 mt -58.54 -59.08 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 CA-C-N 120.469 1.486 . . . . 0.94 111.558 164.139 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 23.1 t -55.02 -38.6 46.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.149 1.38 . . . . 0.64 112.926 -176.945 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -65.7 -27.61 68.46 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.465 -1.397 . . . . 0.92 112.563 174.36 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.0 t -94.87 -19.72 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.137 1.375 . . . . 1.03 111.343 -179.552 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -59.8 -54.24 48.52 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 120.342 1.428 . . . . 4.01 110.083 153.573 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.434 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 25.8 t30 -54.18 -34.29 60.15 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 118.921 0.782 . . . . 2.24 112.948 -178.344 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -80.32 -48.51 12.88 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.243 0.831 . . . . 2.19 113.243 174.144 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -73.5 -22.29 60.18 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 114.23 1.196 . . . . 2.62 114.23 -173.039 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.434 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 9.3 ptmt -48.86 -34.98 13.64 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 120.872 1.669 . . . . 2.77 113.064 176.134 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -74.4 -40.27 62.14 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 114.03 1.122 . . . . 2.52 114.03 178.529 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.476 0.832 0 CA-C-N 118.921 0.782 . . . . 3.03 112.244 177.025 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.7 pt . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 115.123 1.527 . . . . 2.13 115.123 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 97.6 p -101.02 140.75 34.89 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 120.692 -1.255 . . . . 3.53 108.375 152.879 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.413 ' HE2' HD12 ' A' ' 66' ' ' LEU . 14.8 mttt -71.44 -18.95 62.29 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.19 -0.944 . . . . 2.75 112.582 -171.846 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.9 m -48.43 -30.34 4.97 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.264 1.026 . . . . 2.29 113.621 159.323 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 t -65.28 -35.16 80.17 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 117.477 -1.249 . . . . 2.6 111.761 176.443 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -59.3 -48.89 79.94 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 120.929 1.695 . . . . 1.8 111.844 174.881 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.0 ptt85 -62.97 -29.74 71.04 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.346 0.976 . . . . 4.39 111.463 176.606 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -83.96 -39.84 19.25 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 114.008 1.114 . . . . 3.11 114.008 -175.874 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.7 tmm? -51.67 -47.8 63.68 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 126.331 1.853 . . . . 1.7 110.67 162.379 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -55.47 -50.82 68.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.487 0.585 . . . . 1.05 112.393 169.227 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -79.14 -9.17 59.48 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 115.758 1.762 . . . . 3.03 115.758 -175.786 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -98.16 -51.68 3.93 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.256 1.423 . . . . 1.44 114.078 167.724 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -89.67 -43.21 10.89 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.093 0.957 . . . . 2.9 111.966 -168.9 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.58 38.55 2.13 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.049 1.34 . . . . 1.9 110.742 -168.526 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -96.55 -17.78 20.24 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 116.085 1.883 . . . . 2.36 116.085 -149.257 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 -92.17 -38.9 11.87 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.446 1.498 . . . . 1.94 113.142 -162.939 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 68.4 mtm -77.0 -18.9 57.89 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.021 -1.049 . . . . 2.75 113.367 170.479 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.1 tt -56.52 -31.24 63.93 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.128 0.971 . . . . 5.8 112.68 -155.401 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.1 m 83.5 109.66 0.06 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.349 2.26 . . . . 5.15 111.494 169.477 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 t70 66.42 -163.14 0.24 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.904 1.682 . . . . 4.44 113.669 168.169 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.4 m -87.14 -31.56 20.34 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.274 1.429 . . . . 2.24 109.913 157.03 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.2 -42.21 72.22 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.793 1.187 . . . . 1.98 114.154 -174.773 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -76.38 -20.62 56.98 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.902 1.351 . . . . 4.73 112.955 177.983 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.6 mtt85 -69.72 -37.92 76.72 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.0 -1.688 . . . . 7.06 112.43 164.279 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 mmmt -59.07 -40.35 84.94 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.417 1.008 . . . . 4.27 111.373 170.411 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.48 ' HA ' ' HE3' ' A' ' 61' ' ' LYS . . . -59.14 -40.44 85.48 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 117.833 -1.08 . . . . 1.67 113.739 173.143 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.412 ' HB2' HG12 ' A' ' 86' ' ' ILE . . . -58.04 -46.88 84.64 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.663 1.185 . . . . 1.01 112.368 167.32 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -62.79 -34.06 76.49 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.036 0.934 . . . . 2.43 112.891 -175.681 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.48 ' HE3' ' HA ' ' A' ' 58' ' ' ALA . 8.0 mtmp? -47.69 -44.0 27.1 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 122.979 1.371 . . . . 2.99 113.102 169.488 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.1 mt -69.36 -43.05 74.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 113.615 -1.629 . . . . 1.01 110.491 -174.708 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.1 mm -53.8 -54.57 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.669 1.588 . . . . 1.27 110.56 178.806 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -64.13 -37.75 88.58 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 123.699 0.799 . . . . 2.83 112.377 -178.001 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -44.34 82.46 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 121.512 0.672 . . . . 3.77 112.232 168.355 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.413 HD12 ' HE2' ' A' ' 35' ' ' LYS . 0.2 OUTLIER -72.21 -34.06 68.08 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.012 0.925 . . . . 2.39 110.922 -174.429 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -77.78 -30.92 51.64 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.829 1.048 . . . . 3.57 113.829 171.26 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.27 -31.63 58.38 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.852 1.056 . . . . 2.85 113.852 176.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.51 57.94 1.19 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.484 1.113 . . . . 4.31 113.084 -173.49 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.77 5.05 0.06 Allowed 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 116.594 2.072 . . . . 4.41 116.594 167.301 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.0 t70 59.65 -150.36 0.43 Allowed 'General case' 0 CA--C 1.557 1.216 0 CA-C-N 120.004 1.274 . . . . 4.0 110.102 -175.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -93.91 11.63 70.6 Favored Glycine 0 CA--C 1.533 1.183 0 O-C-N 119.962 -1.711 . . . . 2.48 112.603 158.231 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.2 mmt-85 -80.28 70.71 6.98 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.524 1.662 . . . . 4.62 111.452 -176.931 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.8 mt -63.33 139.47 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 124.766 1.226 . . . . 2.17 109.814 174.614 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.5 m -117.23 158.74 23.79 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.321 1.048 . . . . 1.64 109.817 168.351 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -46.23 -47.73 17.91 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 123.151 1.453 . . . . 1.84 112.247 172.689 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.21 -16.99 63.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 129.4 3.08 . . . . 3.15 112.74 -175.303 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -58.47 -59.27 5.63 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.466 1.106 . . . . 4.28 110.812 175.335 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -55.33 -47.67 75.32 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.567 -0.708 . . . . 1.92 111.152 -178.473 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -62.56 -47.01 85.72 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.485 0.55 . . . . 0.55 112.485 -178.365 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.3 t -69.78 -39.61 76.55 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.503 0.721 . . . . 1.56 111.758 -179.538 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 44.2 mt -58.1 -46.13 86.05 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 118.001 -0.999 . . . . 0.83 111.85 175.442 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 20.9 mm -50.56 -37.26 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 CA-C-N 119.549 1.068 . . . . 0.95 112.775 -178.007 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.01 -20.07 47.74 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 119.686 1.13 . . . . 0.94 114.189 176.258 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.99 0.78 82.12 Favored Glycine 0 CA--C 1.532 1.124 0 O-C-N 120.743 -1.445 . . . . 0.97 114.48 175.32 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.412 HG12 ' HB2' ' A' ' 59' ' ' ALA . 0.7 OUTLIER -134.72 -45.44 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 126.193 1.797 . . . . 1.0 110.668 174.752 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 95.5 m -76.18 71.3 2.9 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.677 1.991 . . . . 1.45 107.131 163.024 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -149.77 -77.98 0.02 OUTLIER Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.212 1.387 . . . . 0.96 111.077 -179.711 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -62.23 -34.14 79.21 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 123.227 2.618 . . . . 1.46 113.617 -176.634 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -82.95 0.06 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 114.549 1.314 . . . . 1.37 114.549 179.839 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -35.88 -61.06 0.5 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.329 2.651 . . . . 2.34 115.756 -176.158 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.51 -40.33 65.33 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.024 -1.047 . . . . 4.43 111.719 176.296 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.3 tt -66.73 -42.29 86.52 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.432 0.693 . . . . 2.14 109.898 -176.704 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.7 mt -51.29 -54.5 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.0 0.92 . . . . 2.82 110.2 169.788 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -41.08 96.21 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.614 -0.679 . . . . 2.99 112.733 -179.606 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -93.63 0.66 56.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.951 0.901 . . . . 3.2 112.666 -169.051 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -29.82 70.3 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 125.821 1.649 . . . . 5.72 112.501 163.856 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.475 ' CD ' HG21 ' B' ' 116' ' ' ILE . 3.2 mm-40 -74.09 8.09 2.3 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.415 1.086 . . . . 3.84 111.957 171.529 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.466 0.336 0 C-N-CA 124.947 1.299 . . . . 4.21 109.644 174.754 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 121.386 0.612 . . . . 2.42 110.28 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 20.8 p -71.11 163.38 27.72 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.468 1.507 . . . . 1.24 111.458 -173.892 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.51 -34.73 78.95 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 117.875 -1.059 . . . . 2.98 112.621 178.857 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.09 -50.2 64.89 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.971 1.26 . . . . 0.9 109.119 172.621 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -67.51 -54.02 23.63 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.158 0.799 . . . . 2.54 113.158 -176.194 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -57.42 -30.55 65.07 Favored 'General case' 0 C--O 1.225 -0.187 0 O-C-N 120.759 -1.213 . . . . 4.44 113.215 172.313 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 114' ' ' ALA . . . . . 0.868 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.36 -43.09 78.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 118.211 -0.899 . . . . 0.57 112.326 169.134 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 77.2 t -54.95 -36.12 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 120.353 1.433 . . . . 0.69 110.452 167.267 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 116' ' ' ILE . . . . . 0.475 HG21 ' CD ' ' A' ' 98' ' ' GLU 0.265 34.7 mt -60.9 -60.27 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 117.085 -1.436 . . . . 0.99 112.129 166.972 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 21.9 t -51.74 -38.56 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 121.124 1.784 . . . . 0.58 112.576 -179.685 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 9.8 mp -63.62 -36.74 84.8 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.096 -1.002 . . . . 0.94 111.895 173.424 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 72.3 t -90.22 -29.55 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 117.4 -1.286 . . . . 1.0 112.456 -177.708 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 120' ' ' GLU . . . . . 0.418 ' CD ' ' HZ2' ' B' ' 124' ' ' LYS . 9.3 tm-20 -53.01 -50.44 64.21 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 121.359 1.89 . . . . 3.29 108.724 157.684 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 121' ' ' ASN . . . . . 0.511 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 26.9 t30 -65.22 -25.16 67.57 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.837 1.051 . . . . 2.16 113.837 -173.447 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -77.48 -50.13 13.29 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 120.963 -1.086 . . . . 2.45 112.242 165.369 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -64.87 -27.13 68.66 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 117.134 -1.413 . . . . 2.62 113.788 -170.148 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 124' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 2.6 ptmt -52.63 -32.83 43.8 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 121.841 2.11 . . . . 2.01 112.911 174.792 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -73.32 -23.87 60.31 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.43 1.27 . . . . 2.42 114.43 179.252 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 31.3 m . . . . . 0 N--CA 1.483 1.2 0 CA-C-N 119.067 0.849 . . . . 2.74 112.99 170.46 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 34.8 pt . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 113.731 1.012 . . . . 2.65 113.731 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 90.3 p -108.4 142.57 38.57 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 119.446 -2.034 . . . . 3.11 107.74 153.212 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . 0.469 ' CD ' ' HB3' ' B' ' 169' ' ' LEU . 20.8 mttp -67.53 -21.96 65.45 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.054 -1.029 . . . . 2.79 110.99 179.895 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 2.9 m -50.2 -23.07 1.99 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.324 1.602 . . . . 2.18 115.324 162.1 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 21.7 t -70.35 -34.58 72.81 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 120.309 -1.495 . . . . 2.28 112.761 169.92 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -64.52 -44.52 90.62 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 118.299 -0.858 . . . . 2.17 112.334 178.805 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 16.4 ptt85 -57.88 -34.04 69.35 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.681 1.128 . . . . 4.03 110.821 172.014 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . 0.472 ' HA ' ' HG2' ' B' ' 146' ' ' GLN . 6.2 tt0 -86.75 -38.55 16.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 113.977 1.103 . . . . 2.99 113.977 -169.144 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.6 tmm? -62.31 -37.58 86.1 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.856 -0.528 . . . . 1.19 110.941 165.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 12.6 mt -64.81 -41.67 95.6 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 120.658 -1.276 . . . . 1.08 113.844 169.778 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 146' ' ' GLN . . . . . 0.5 ' HB2' ' HE ' ' B' ' 159' ' ' ARG . 14.3 pt20 -73.71 -19.91 60.68 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 114.05 1.13 . . . . 3.18 114.05 -175.665 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -91.29 -68.54 0.79 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.826 2.05 . . . . 2.37 113.005 168.954 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -65.96 -27.22 68.0 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.655 1.57 . . . . 3.64 113.792 -167.233 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.25 6.1 42.79 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.245 1.018 . . . . 2.34 112.87 -179.817 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -52.09 -36.68 51.57 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.773 1.768 . . . . 2.47 115.773 -160.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -67.25 -53.02 33.83 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.11 0.868 . . . . 1.89 112.699 -168.318 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 38.0 mtm -73.2 -23.81 60.45 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.414 1.264 . . . . 2.95 114.414 173.565 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 8.8 tt -50.76 -38.09 45.92 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-O 118.141 -0.933 . . . . 5.65 112.823 -160.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 50.2 m 81.58 102.81 0.06 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.235 1.814 . . . . 5.15 112.28 172.237 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 14.1 t70 69.8 -173.43 0.18 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.541 1.536 . . . . 4.62 114.5 165.32 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 62.2 m -73.23 -38.61 65.97 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.939 1.696 . . . . 2.61 110.0 162.579 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.49 -45.71 89.12 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.407 1.003 . . . . 1.97 113.742 -172.692 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -72.66 -20.01 61.33 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 118.813 1.306 . . . . 4.64 112.71 178.909 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 159' ' ' ARG . . . . . 0.5 ' HE ' ' HB2' ' B' ' 146' ' ' GLN . 38.7 mtt85 -70.4 -38.06 74.58 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 120.057 -1.652 . . . . 7.37 112.83 167.652 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -61.97 -37.64 85.56 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.174 -0.954 . . . . 4.43 111.26 169.596 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 161' ' ' ALA . . . . . 0.47 ' HA ' ' HE3' ' B' ' 164' ' ' LYS . . . -60.5 -38.49 84.48 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 117.668 -1.158 . . . . 1.31 113.602 170.428 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -58.12 -48.05 81.41 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.454 1.025 . . . . 0.82 111.84 168.6 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -61.67 -32.87 73.07 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.062 1.134 . . . . 2.3 114.062 -177.681 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 164' ' ' LYS . . . . . 0.47 ' HE3' ' HA ' ' B' ' 161' ' ' ALA . 8.2 mtmp? -46.64 -44.63 18.57 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-O 123.131 1.443 . . . . 3.18 113.206 171.777 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 5.6 mt -72.8 -39.7 66.47 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.199 -1.819 . . . . 1.15 111.274 -170.386 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 26.1 mm -53.66 -55.16 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 126.096 1.758 . . . . 1.42 109.651 178.437 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -66.48 -38.4 87.22 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.254 1.022 . . . . 2.76 112.832 -179.262 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -57.57 -15.05 6.23 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.625 1.17 . . . . 3.54 113.939 169.19 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 169' ' ' LEU . . . . . 0.469 ' HB3' ' CD ' ' B' ' 138' ' ' LYS . 3.4 mm? -108.63 -38.93 5.53 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.686 1.194 . . . . 2.08 113.346 170.046 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -77.82 -25.57 48.92 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 119.443 -2.036 . . . . 3.93 113.787 -177.674 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.32 -20.13 44.99 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.723 1.147 . . . . 3.75 113.782 176.09 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -159.82 20.79 0.17 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.083 1.512 . . . . 4.94 115.083 -161.407 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.44 15.35 4.51 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 120.597 -1.314 . . . . 5.2 113.915 171.922 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 14.3 t70 60.56 -155.05 0.36 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.701 1.6 . . . . 3.9 110.649 177.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -94.09 15.95 62.03 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 120.278 -1.513 . . . . 2.39 112.857 165.609 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 53.6 mmt-85 -78.02 51.41 0.97 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.099 1.45 . . . . 4.8 112.39 -177.696 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 177' ' ' ILE . . . . . 0.402 HG12 ' HE3' ' B' ' 138' ' ' LYS . 39.7 mt -58.04 127.71 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.212 1.005 . . . . 2.82 110.316 -175.394 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.3 m -113.23 168.57 9.61 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.141 1.163 . . . . 2.11 114.141 -173.21 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -63.38 -58.49 6.93 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.01 1.324 . . . . 1.87 111.13 170.695 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -67.92 -22.45 65.06 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.246 2.219 . . . . 3.53 111.482 -172.134 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -57.6 -58.72 7.09 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 125.56 1.544 . . . . 3.27 110.882 169.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -50.46 -50.44 52.35 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.971 -0.456 . . . . 2.24 110.824 179.418 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.3 t-105 -62.82 -46.39 88.15 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.396 0.679 . . . . 0.56 112.762 -179.672 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.1 t -68.77 -33.89 74.64 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 118.638 0.654 . . . . 1.44 111.387 -178.68 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 75.9 mt -61.69 -43.07 99.57 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 117.449 -1.262 . . . . 0.69 112.143 172.065 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 46.8 mm -48.39 -43.19 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 CA-C-N 121.077 1.762 . . . . 0.71 112.122 -179.253 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.89 -19.06 58.3 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.179 0.895 . . . . 0.66 114.311 -179.981 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -76.78 -4.85 82.9 Favored Glycine 0 CA--C 1.534 1.241 0 O-C-N 120.776 -1.426 . . . . 0.94 114.274 174.775 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -123.17 -45.28 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.851 1.66 . . . . 0.86 110.188 170.686 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 92.6 m -74.64 71.91 1.93 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.983 1.713 . . . . 1.52 107.739 165.574 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -144.43 -78.35 0.04 OUTLIER Glycine 0 CA--C 1.529 0.926 0 C-N-CA 125.535 1.54 . . . . 0.87 111.14 178.668 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -63.77 -32.29 67.71 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.344 2.696 . . . . 1.02 113.684 -176.894 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.4 pt -78.38 -3.13 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 114.306 1.224 . . . . 1.11 114.306 178.846 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -35.61 -64.83 0.27 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 127.704 2.402 . . . . 2.22 115.516 -176.889 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -57.64 -33.41 68.25 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.616 -1.303 . . . . 4.87 113.202 177.101 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 10.4 tt -70.15 -41.36 73.94 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 117.991 -1.004 . . . . 2.83 110.468 177.487 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 83.9 mt -52.58 -50.27 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 119.15 0.887 . . . . 2.79 110.71 172.181 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -61.28 -47.1 87.55 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.964 0.906 . . . . 2.96 113.301 175.019 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -92.44 2.44 56.66 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 120.713 -1.242 . . . . 3.36 113.257 -169.074 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -22.37 61.06 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.636 1.574 . . . . 5.12 113.301 161.571 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -87.88 15.31 7.29 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 123.784 1.754 . . . . 3.28 111.152 172.891 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -121.75 -67.99 0.93 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.04 1.336 . . . . 4.05 109.062 168.118 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.18 0 C-N-CA 129.243 3.017 . . . . 8.03 116.873 165.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 CA--C 1.502 -0.879 0 N-CA-C 108.776 -0.824 . . . . 10.72 108.776 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -132.37 -21.77 2.27 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.762 1.289 . . . . 7.56 112.096 -133.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 67.7 m 69.05 -23.38 0.14 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 129.323 3.049 . . . . 3.96 115.464 170.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.496 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 0.2 OUTLIER 65.17 102.07 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 127.431 2.293 . . . . 2.26 110.489 -167.681 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -52.17 150.27 4.66 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 118.914 0.779 . . . . 1.1 111.165 -173.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -59.26 -48.59 81.06 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 118.914 0.779 . . . . 2.58 110.301 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.67 -47.69 14.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.594 1.558 . . . . 1.04 110.941 172.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -74.26 -50.59 18.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 118.005 -0.997 . . . . 2.79 113.235 -173.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 mtmm -50.4 -37.89 39.96 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-N 120.931 1.696 . . . . 6.02 113.48 164.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.866 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.39 -44.95 85.89 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.206 -1.378 . . . . 0.56 111.928 175.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.483 ' O ' HG23 ' A' ' 16' ' ' VAL . 69.1 t -60.14 -36.14 66.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 CA-C-N 121.339 1.882 . . . . 0.63 110.59 172.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 52.6 mt -58.49 -51.99 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 O-C-N 121.179 -0.95 . . . . 0.83 111.766 167.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.2 t -61.97 -39.58 84.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.486 1.515 . . . . 0.6 112.019 -177.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.3 mp -63.59 -43.12 97.87 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.798 0.839 . . . . 1.01 111.187 172.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 12' ' ' VAL . 89.0 t -62.34 -41.94 93.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 118.126 -0.94 . . . . 0.69 109.864 177.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -65.88 -41.68 91.28 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.111 1.323 . . . . 4.49 114.111 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -16.52 20.28 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 120.336 -1.478 . . . . 3.58 113.48 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -98.8 -61.59 1.35 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.767 1.627 . . . . 1.9 113.189 166.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -60.46 -24.4 65.21 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.462 1.483 . . . . 1.85 114.365 -171.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -46.32 -26.63 0.85 Allowed 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.094 1.316 . . . . 2.66 113.815 167.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -91.18 7.12 42.24 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.808 2.043 . . . . 2.37 115.99 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.1 m -136.09 164.33 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 119.711 1.141 . . . . 2.37 109.587 170.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.9 m -93.52 70.82 4.28 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 120.945 -1.097 . . . . 3.99 111.222 169.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 ttpp 71.91 -52.1 0.69 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.242 1.817 . . . . 6.56 115.086 159.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -110.4 -13.58 14.26 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.763 1.625 . . . . 6.82 112.929 174.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 99.9 p -84.12 18.17 2.21 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 117.419 2.377 . . . . 4.7 117.419 -143.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 61.7 mt -39.65 -7.43 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 131.627 3.971 . . . . 7.35 119.776 -170.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.3 p -130.37 -44.96 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.845 2.058 . . . . 4.11 112.572 172.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.42 -22.86 43.7 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.311 1.597 . . . . 8.16 115.311 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -147.47 119.23 8.06 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.435 1.094 . . . . 7.47 108.688 167.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 10.0 pttm -160.65 160.77 32.01 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.569 1.548 . . . . 7.24 111.741 -166.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 22.9 pt -83.7 172.66 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 121.812 0.815 . . . . 2.96 111.441 178.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.6 t -78.74 134.7 37.04 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.571 -0.9 . . . . 2.75 108.571 159.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -55.25 -25.11 31.45 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.154 -0.966 . . . . 2.38 112.346 172.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.6 m -61.97 -12.98 21.17 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.013 1.486 . . . . 2.92 115.013 169.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.6 m -82.96 -23.95 33.2 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.59 1.541 . . . . 1.69 114.273 168.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -52.76 -53.96 40.63 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.298 1.863 . . . . 2.13 111.9 176.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 27.0 ptt180 -61.66 -17.17 54.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.767 2.027 . . . . 2.63 114.874 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -101.64 -52.42 3.22 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 126.969 2.108 . . . . 3.18 109.179 -175.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 17.1 tmm? -53.75 -36.4 62.28 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.174 1.39 . . . . 1.89 112.535 170.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 mt -54.12 -30.06 47.36 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.027 1.331 . . . . 1.02 113.983 169.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.79 -3.69 58.05 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.416 1.007 . . . . 3.09 112.869 176.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -56.5 2.19 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.691 1.596 . . . . 1.6 112.346 170.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -90.46 -14.8 32.08 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.215 1.191 . . . . 3.09 114.215 -167.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 mt -123.22 45.27 2.46 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.008 2.123 . . . . 1.61 109.852 174.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -78.8 -21.01 48.4 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 115.343 1.608 . . . . 1.42 115.343 -170.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.506 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 59.9 m-70 -83.43 -22.54 32.63 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 121.211 1.823 . . . . 1.66 114.364 -168.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 73.6 mtm -91.6 -12.92 32.93 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.88 1.672 . . . . 1.9 113.028 171.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.2 tp -99.06 117.87 34.54 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.768 1.227 . . . . 3.3 111.016 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.7 m -159.19 -47.21 0.06 Allowed 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.569 -1.332 . . . . 5.37 110.337 171.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -37.72 -26.78 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.631 2.772 . . . . 5.94 115.471 160.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.7 m 71.79 -25.01 0.18 Allowed 'General case' 0 C--N 1.342 0.257 0 C-N-CA 128.758 2.823 . . . . 2.63 112.73 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.26 -44.16 75.24 Favored Glycine 0 N--CA 1.473 1.103 0 C-N-CA 127.043 2.259 . . . . 1.89 113.604 172.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -55.03 -42.74 73.0 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.498 1.119 . . . . 3.42 111.774 171.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.7 ttt-85 -68.29 -40.07 81.91 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 120.534 -1.354 . . . . 5.22 113.249 170.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.1 mtmt -55.32 -29.94 59.26 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 122.16 2.255 . . . . 4.81 112.58 173.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.42 -10.22 59.26 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.984 1.476 . . . . 1.39 114.984 173.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -82.43 -52.89 6.45 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.796 1.238 . . . . 0.89 111.233 162.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.89 -33.47 74.27 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.316 0.647 . . . . 2.24 112.655 -173.271 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -54.66 -32.0 58.5 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.719 1.007 . . . . 3.06 113.719 169.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.0 mt -81.16 -40.19 24.34 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.618 1.167 . . . . 1.08 110.735 -177.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.1 mm -48.7 -55.42 3.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.644 1.177 . . . . 1.36 110.66 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -66.01 -38.81 89.38 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.417 1.087 . . . . 1.87 113.174 -177.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -32.82 70.61 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.873 1.269 . . . . 3.19 112.699 170.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.77 -41.57 14.0 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.142 0.977 . . . . 2.53 110.593 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -47.95 -48.4 32.14 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.263 1.425 . . . . 2.73 112.111 172.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -53.51 -22.19 7.69 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.873 1.434 . . . . 2.06 114.873 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.1 m-80 -113.81 5.62 16.39 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.066 1.346 . . . . 2.68 113.539 -175.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 20.0 t60 -149.16 101.68 3.17 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 117.216 2.302 . . . . 3.69 117.216 -153.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -20.75 3.24 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 128.239 2.616 . . . . 4.62 115.341 170.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 95.87 22.9 19.39 Favored Glycine 0 CA--C 1.528 0.889 0 CA-C-O 118.84 -0.978 . . . . 2.86 113.015 -166.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 58.9 mmt-85 -75.45 88.18 2.63 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.608 1.704 . . . . 4.45 106.61 153.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 8.3 mt -61.94 143.41 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 108.875 -0.787 . . . . 2.75 108.875 -177.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.87 149.2 39.04 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.526 1.131 . . . . 1.83 108.538 174.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.36 -38.18 88.56 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 120.1 1.318 . . . . 2.0 110.896 176.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.31 -22.83 63.64 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.924 2.09 . . . . 2.94 113.905 175.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -60.96 -61.2 2.75 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.795 1.238 . . . . 3.61 110.969 -178.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -56.0 -44.87 79.04 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.392 -0.818 . . . . 2.38 112.789 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -61.72 -44.39 97.0 Favored 'General case' 0 C--O 1.239 0.552 0 O-C-N 121.844 -0.535 . . . . 0.6 111.247 -178.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.59 -21.35 59.53 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 117.421 -1.276 . . . . 1.61 112.804 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.8 mt -70.59 -44.22 67.78 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 120.176 1.353 . . . . 0.9 112.662 165.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.8 mm -56.21 -37.3 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 CA-C-N 120.869 1.668 . . . . 0.7 112.452 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.28 -14.33 63.93 Favored Glycine 0 CA--C 1.533 1.208 0 CA-C-O 118.935 -0.925 . . . . 0.84 114.502 178.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -85.02 -19.7 58.83 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-N 119.085 1.442 . . . . 0.81 113.901 175.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.4 mp -90.76 -44.97 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 118.524 1.162 . . . . 1.11 109.509 167.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.2 m -76.4 85.78 3.15 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 107.595 -1.261 . . . . 1.25 107.595 -178.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -167.79 -75.82 0.04 OUTLIER Glycine 0 CA--C 1.532 1.098 0 CA-C-O 117.918 -1.49 . . . . 0.89 113.993 -170.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -59.91 -44.48 30.05 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 123.134 2.556 . . . . 1.0 111.496 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.8 pt -76.27 -12.73 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 114.487 1.292 . . . . 1.51 114.487 169.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.84 -49.09 77.86 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 120.788 1.631 . . . . 1.13 112.599 -175.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.03 -50.49 68.95 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.078 0.854 . . . . 3.41 112.051 170.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.9 tt -53.75 -39.05 65.02 Favored 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 125.273 1.429 . . . . 1.45 112.399 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 80.4 mt -55.82 -63.22 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 CA-C-N 119.623 1.101 . . . . 1.03 111.068 171.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -53.49 -30.48 41.34 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 118.596 0.635 . . . . 1.8 112.63 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -83.8 -21.03 32.26 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.45 1.1 . . . . 3.24 112.54 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 -73.03 -38.15 66.63 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 120.938 -1.101 . . . . 2.29 112.13 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -69.34 0.85 4.44 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.303 1.441 . . . . 2.45 112.798 175.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -120.93 -60.84 1.62 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 126.229 1.811 . . . . 2.26 111.32 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . 0.276 6.8 pt20 54.99 1.06 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 130.664 3.586 . . . . 5.44 115.23 175.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.9 m -111.73 10.25 20.93 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.173 1.789 . . . . 7.09 112.971 -168.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 58.3 m -158.8 38.4 0.22 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.99 1.716 . . . . 8.82 110.578 -177.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 53.9 p . . . . . 0 C--O 1.25 1.11 0 C-N-CA 128.841 2.856 . . . . 10.37 113.976 -175.054 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 CA--C 1.502 -0.873 0 N-CA-C 108.875 -0.787 . . . . 10.75 108.875 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -132.26 -21.25 2.34 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.757 1.285 . . . . 7.38 112.158 -134.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 67.6 m 69.91 -23.43 0.16 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 129.478 3.111 . . . . 3.78 115.263 169.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.506 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 0.2 OUTLIER 65.35 102.03 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.292 2.237 . . . . 2.36 110.522 -166.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.53 150.18 7.13 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-N 118.958 0.799 . . . . 1.08 111.371 -173.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -58.56 -49.21 78.27 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-N 119.458 1.026 . . . . 2.76 110.238 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.38 -47.23 13.51 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.383 1.473 . . . . 1.02 111.129 172.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -74.71 -50.83 16.07 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 117.928 -1.034 . . . . 2.7 113.071 -172.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -50.11 -37.0 31.91 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 120.965 1.712 . . . . 5.54 113.245 164.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.866 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.91 -41.63 82.36 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 117.438 -1.268 . . . . 0.58 112.777 176.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . 0.477 ' O ' HG23 ' B' ' 119' ' ' VAL . 75.2 t -62.36 -37.63 79.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-N 121.122 1.783 . . . . 0.64 110.396 170.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 55.8 mt -56.29 -53.42 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 119.398 0.999 . . . . 0.79 111.197 167.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 7.5 t -61.19 -39.66 83.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 125.206 1.402 . . . . 0.54 112.1 -176.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.5 mp -63.32 -44.49 94.81 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.128 0.876 . . . . 0.99 111.431 172.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . 0.477 HG23 ' O ' ' B' ' 115' ' ' VAL . 91.0 t -62.85 -40.54 89.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 118.056 -0.974 . . . . 0.67 109.852 178.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -67.52 -42.95 81.93 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.676 1.125 . . . . 4.1 113.286 172.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.61 -18.99 23.02 Favored 'General case' 0 CA--C 1.552 1.027 0 O-C-N 120.447 -1.408 . . . . 3.61 113.561 176.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -95.17 -63.75 1.13 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.629 1.172 . . . . 2.0 113.083 166.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -59.06 -23.82 62.35 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.656 1.571 . . . . 1.83 114.833 -170.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -46.89 -25.04 0.69 Allowed 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 120.259 1.391 . . . . 2.46 113.884 167.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -93.23 8.78 38.85 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.298 2.239 . . . . 2.29 116.153 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.1 m -137.02 154.19 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 120.141 1.337 . . . . 2.43 110.146 168.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 10.5 m -79.7 60.13 3.27 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.307 -0.87 . . . . 3.97 111.998 169.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp 77.19 -52.6 0.55 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.332 1.453 . . . . 6.19 114.132 156.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -107.58 -11.82 15.39 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.029 1.732 . . . . 6.71 113.211 172.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 85.6 p -87.92 7.66 29.9 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 117.928 2.566 . . . . 4.76 117.928 -142.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 68.1 mt -20.99 -13.39 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 1 C-N-CA 134.356 5.062 . . . . 7.36 121.667 -175.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 4.3 p -132.59 -47.32 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 127.25 2.22 . . . . 4.06 112.437 176.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -21.25 46.48 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 114.532 1.308 . . . . 8.07 114.532 -177.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -146.54 120.64 9.45 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.176 0.991 . . . . 7.51 108.776 161.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 11.0 pttm -159.86 162.34 34.61 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.549 1.54 . . . . 7.18 111.829 -167.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 9.0 pt -80.95 175.68 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 CA-C-O 121.816 0.817 . . . . 2.98 111.475 175.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 32.5 t -84.99 138.35 32.52 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.7 -0.852 . . . . 2.54 108.7 163.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -58.78 -20.01 45.88 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 120.56 -1.337 . . . . 2.21 112.522 172.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 50.8 m -66.01 -16.76 64.18 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.237 1.415 . . . . 2.58 114.586 167.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 61.6 m -80.41 -29.97 37.7 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.887 1.221 . . . . 1.2 113.098 176.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.411 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 70.1 t80 -50.91 -57.37 8.68 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 119.651 1.114 . . . . 1.9 112.146 176.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -61.86 -17.79 57.74 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.57 1.948 . . . . 2.86 114.606 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -97.52 -54.76 3.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.962 2.105 . . . . 3.33 109.07 -177.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -53.31 -35.67 60.4 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.803 1.641 . . . . 1.81 112.701 172.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.0 mt -54.31 -30.0 49.56 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.004 1.322 . . . . 1.06 113.898 169.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.84 -3.43 56.78 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.611 1.096 . . . . 3.29 112.891 176.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.64 -57.27 2.05 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.874 1.67 . . . . 1.47 112.341 171.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -89.67 -15.78 31.89 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.682 0.993 . . . . 3.06 113.682 -167.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.3 mt -121.97 44.98 2.44 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.334 1.854 . . . . 1.62 110.088 174.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -79.04 -23.67 44.13 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.344 1.609 . . . . 1.38 115.344 -169.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . 0.496 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 64.6 m-70 -81.3 -22.36 38.63 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 121.115 1.78 . . . . 1.63 114.343 -167.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 73.2 mtm -91.19 -11.44 38.32 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.677 1.591 . . . . 1.97 113.102 171.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 40.0 tp -100.74 120.15 39.66 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.15 1.38 . . . . 3.24 111.091 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 23.0 m -160.94 -47.29 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 O-C-N 120.524 -1.36 . . . . 5.14 110.019 170.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -37.72 -27.69 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 128.995 2.918 . . . . 5.91 115.527 161.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 100.0 m 71.71 -22.17 0.2 Allowed 'General case' 0 C--N 1.342 0.245 0 C-N-CA 128.471 2.708 . . . . 2.8 112.969 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.84 -44.89 92.01 Favored Glycine 0 N--CA 1.471 1.008 0 C-N-CA 126.181 1.848 . . . . 1.93 113.038 171.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -54.97 -41.34 71.05 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.823 1.249 . . . . 3.43 111.731 172.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.6 ttt-85 -68.9 -41.36 78.36 Favored 'General case' 0 C--N 1.345 0.374 0 O-C-N 120.482 -1.387 . . . . 4.87 113.121 170.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 19.5 mtmt -57.37 -26.49 61.1 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 121.65 2.023 . . . . 3.99 112.885 173.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -74.54 -11.0 60.09 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.853 1.427 . . . . 1.41 114.853 172.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.13 -56.89 3.52 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.307 1.443 . . . . 0.89 111.145 163.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -34.18 69.0 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 113.255 0.835 . . . . 2.23 113.255 -176.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -55.14 -32.2 61.91 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 121.047 -1.033 . . . . 3.12 113.765 170.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . 0.45 HD11 ' HA3' ' B' ' 188' ' ' GLY . 17.3 mt -79.97 -40.09 28.73 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.254 1.022 . . . . 1.07 110.416 -176.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 39.6 mm -49.74 -54.42 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.101 1.36 . . . . 1.31 110.733 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -65.4 -37.85 88.2 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.517 1.127 . . . . 1.89 113.369 -178.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -34.18 74.36 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.1 1.36 . . . . 3.14 112.988 170.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.81 -41.0 18.01 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.738 1.215 . . . . 2.65 110.282 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -51.39 -46.61 62.88 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.676 1.59 . . . . 2.65 112.817 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -55.22 -20.71 11.53 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.72 1.378 . . . . 2.14 114.72 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -112.64 4.57 17.29 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.021 1.328 . . . . 2.71 113.459 -176.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -151.51 100.71 2.74 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 117.52 2.415 . . . . 3.48 117.52 -153.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -19.08 4.1 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.49 2.716 . . . . 4.64 115.793 171.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 96.15 26.46 11.25 Favored Glycine 0 CA--C 1.53 0.987 0 CA-C-O 118.915 -0.936 . . . . 2.95 113.087 -167.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 54.3 mmt-85 -78.63 84.16 4.76 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.35 1.575 . . . . 4.5 107.154 154.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 11.3 mt -62.05 132.59 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 CA-C-N 118.795 0.725 . . . . 2.86 109.324 -173.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 21.2 m -94.39 158.45 15.56 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 122.012 -0.43 . . . . 1.56 110.33 166.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -63.63 -37.86 88.95 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 119.521 -0.872 . . . . 2.0 111.474 166.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.41 -21.63 65.53 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.652 1.581 . . . . 2.94 114.266 177.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -62.43 -59.21 5.3 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.94 0.896 . . . . 3.49 110.933 -177.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -54.51 -46.81 73.57 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.437 -0.789 . . . . 2.5 112.856 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 40.7 t-105 -61.96 -45.72 92.43 Favored 'General case' 0 C--O 1.239 0.542 0 O-C-N 121.998 -0.439 . . . . 0.62 111.078 -176.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -72.27 -23.19 61.16 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-O 117.317 -1.325 . . . . 1.61 112.436 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.411 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 30.9 mt -69.91 -42.61 73.14 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 120.081 1.31 . . . . 0.85 112.844 167.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 32.2 mm -56.81 -36.08 48.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 CA-C-N 120.928 1.694 . . . . 0.66 112.497 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.21 -19.16 67.99 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.043 -0.865 . . . . 0.7 114.077 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . 0.45 ' HA3' HD11 ' B' ' 165' ' ' LEU . . . -80.84 -20.55 65.35 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-N 119.356 1.578 . . . . 0.85 113.751 176.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.2 mp -90.86 -43.21 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 CA-C-N 118.497 1.149 . . . . 1.11 110.25 168.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 4.1 m -78.13 83.89 4.38 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 107.86 -1.163 . . . . 1.31 107.86 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -165.31 -74.55 0.03 OUTLIER Glycine 0 CA--C 1.533 1.16 0 CA-C-O 118.128 -1.373 . . . . 0.88 114.109 -172.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.68 -42.55 38.34 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.158 2.572 . . . . 1.02 111.617 176.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.9 pt -77.11 -12.4 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 114.93 1.456 . . . . 1.57 114.93 169.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -57.45 -52.17 66.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.75 1.614 . . . . 1.09 112.605 -175.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.66 -48.8 69.09 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.523 -0.736 . . . . 3.51 112.284 170.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 10.2 tt -56.52 -37.64 70.73 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 125.318 1.447 . . . . 1.7 111.979 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 75.4 mt -56.56 -61.94 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 119.648 1.113 . . . . 1.0 111.069 169.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -55.71 -28.42 55.6 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.726 -0.609 . . . . 1.88 112.585 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -83.66 -23.76 31.63 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.33 1.052 . . . . 3.12 112.35 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -76.55 -42.31 43.45 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 124.961 1.305 . . . . 2.25 112.838 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.58 3.01 6.79 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 122.659 1.219 . . . . 2.57 112.548 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -120.23 -57.8 1.91 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 126.959 2.103 . . . . 2.68 110.572 178.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.28 6.5 pt20 56.11 1.18 0.06 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 130.678 3.591 . . . . 5.19 115.506 171.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 39.6 m -103.12 9.14 38.53 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.458 1.503 . . . . 7.17 113.122 -168.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 46.9 m -159.68 43.71 0.22 Allowed 'General case' 0 N--CA 1.481 1.093 0 O-C-N 120.268 -1.52 . . . . 8.93 111.556 -178.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 39.1 p . . . . . 0 C--O 1.25 1.08 0 C-N-CA 128.916 2.887 . . . . 10.4 115.072 -179.122 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.3 m . . . . . 0 N--CA 1.47 0.547 0 N-CA-C 107.0 -1.482 . . . . 8.52 107.0 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -55.39 -117.53 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 120.129 -0.628 . . . . 6.22 109.434 112.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 50.6 t -96.77 -95.7 0.2 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.557 2.343 . . . . 4.38 108.237 171.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.1 m-30 140.95 153.42 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.079 1 C-N-CA 132.65 4.38 . . . . 2.3 111.809 176.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.2 t -76.26 134.83 39.69 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 108.184 -1.043 . . . . 2.08 108.184 153.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -61.7 -28.66 69.57 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 122.683 0.393 . . . . 2.93 110.638 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.03 -40.82 67.41 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.541 -0.725 . . . . 1.01 110.991 175.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -67.16 -61.3 1.99 Allowed 'General case' 0 C--N 1.337 0.058 0 O-C-N 121.909 -0.494 . . . . 2.53 109.971 176.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.4 tptt -54.56 -26.94 35.33 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.416 1.265 . . . . 5.71 114.416 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.794 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -73.7 -44.5 56.36 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.258 1.423 . . . . 0.72 112.254 170.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 77.6 t -59.46 -39.53 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 120.547 1.521 . . . . 0.85 110.025 168.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 11.5 mt -55.57 -50.42 66.83 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-O 117.689 -1.148 . . . . 0.8 110.516 170.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.7 t -58.43 -40.68 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-N 120.42 1.464 . . . . 0.55 111.685 178.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.23 -51.53 65.86 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.071 0.85 . . . . 0.94 111.914 173.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.1 t -60.63 -46.8 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.5 1.52 . . . . 0.83 112.883 178.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -66.6 -44.34 82.41 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 3.33 110.111 -176.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.5 t30 -65.59 -34.66 78.76 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.085 0.772 . . . . 3.0 113.085 177.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -63.63 -50.65 68.51 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 120.556 -1.34 . . . . 2.26 112.459 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -63.34 -42.91 98.98 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 117.491 -1.242 . . . . 2.44 113.037 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.8 ptmt -63.0 -29.58 70.94 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.251 1.841 . . . . 4.7 112.932 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -74.5 -49.23 22.96 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.043 -1.036 . . . . 2.63 112.719 172.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.4 t -66.54 -50.85 63.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 CA-C-N 119.371 0.987 . . . . 3.66 112.903 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.405 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 39.3 p -175.1 -81.44 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.343 1.857 . . . . 4.45 109.392 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.413 ' HG3' ' HE2' ' B' ' 198' ' ' HIS . 42.6 tttp 179.85 -60.43 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 129.179 2.992 . . . . 5.74 108.934 -177.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -131.22 3.06 4.29 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.545 1.138 . . . . 7.03 113.993 -175.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.6 p -142.06 96.92 3.04 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.421 -1.424 . . . . 4.27 112.886 -164.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 mp -87.26 -28.26 22.43 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.378 1.251 . . . . 8.81 114.378 -173.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.1 m -65.11 -20.14 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 125.628 1.571 . . . . 5.08 112.741 -175.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.55 111.94 23.88 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.17 1.388 . . . . 7.96 112.525 179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -42.33 131.56 3.63 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 125.672 1.589 . . . . 8.39 112.527 170.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.405 ' HE3' ' HA ' ' A' ' 24' ' ' SER . 3.1 tmtt? -173.23 -52.91 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 126.883 2.073 . . . . 10.25 109.718 -170.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.4 tt -77.38 164.78 3.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 N-CA-C 108.236 -1.024 . . . . 2.52 108.236 157.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.4 m -118.05 156.3 28.84 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.402 -0.811 . . . . 2.55 110.825 164.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -64.96 -19.27 65.88 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.237 -1.539 . . . . 2.01 113.145 -177.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.1 p -65.34 -28.96 69.66 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.112 1.365 . . . . 1.89 114.079 164.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.9 m -68.3 -30.78 69.86 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.383 -1.448 . . . . 1.16 112.815 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.443 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 14.4 t80 -59.24 -57.86 11.16 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 120.579 1.536 . . . . 2.16 111.819 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -55.27 -25.06 31.51 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.589 1.155 . . . . 2.3 112.152 178.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.405 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 26.2 mt-10 -90.34 -50.13 6.14 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 125.774 1.629 . . . . 3.79 112.662 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 59.7 ttp -45.37 -45.57 12.64 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 124.12 0.968 . . . . 2.41 110.243 162.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.1 mt -58.16 -50.49 73.33 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 125.264 1.426 . . . . 1.21 112.732 171.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -20.86 59.78 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 120.427 1.467 . . . . 3.0 113.972 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 1.4 mppt? -87.41 -48.55 7.87 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.778 1.231 . . . . 2.85 110.237 -179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -74.64 -74.35 0.2 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.267 1.027 . . . . 3.82 111.615 171.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 11.0 mt -74.77 32.68 0.09 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.69 1.596 . . . . 2.48 113.422 -173.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -59.25 -22.79 61.66 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.675 1.59 . . . . 1.63 113.47 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -77.5 -62.55 1.62 Allowed 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.181 0.901 . . . . 1.67 110.279 -178.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 6.8 ptp -62.23 -29.87 70.7 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.583 1.083 . . . . 3.2 113.362 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.83 -61.62 1.79 Allowed 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.88 -0.785 . . . . 3.22 108.88 170.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.9 m 54.86 -82.52 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.09 1.756 . . . . 4.74 111.45 -169.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.2 161.12 24.13 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.7 2.0 . . . . 3.8 113.97 -174.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.5 m -69.61 -23.81 63.57 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.864 1.666 . . . . 2.61 112.377 176.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.86 -52.17 54.56 Favored Glycine 0 N--CA 1.471 1.018 0 C-N-CA 126.188 1.851 . . . . 1.53 112.784 173.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -61.5 -27.0 68.28 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.052 0.541 . . . . 3.48 112.15 172.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 94.0 mtm-85 -80.74 -17.06 52.23 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 114.055 1.132 . . . . 6.12 114.055 170.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt -66.45 -36.05 81.82 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 119.055 -2.278 . . . . 3.68 110.918 169.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.8 -18.74 34.84 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 114.859 1.429 . . . . 1.03 114.859 163.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -80.72 -53.26 6.67 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 119.913 1.233 . . . . 0.86 110.896 166.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -57.44 -40.55 78.69 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.889 1.275 . . . . 2.8 113.873 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 17.0 ptmt -53.3 -30.96 41.62 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.905 0.882 . . . . 3.16 112.542 178.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 30.1 mt -80.21 -44.69 19.31 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 118.503 -0.761 . . . . 0.74 111.067 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 6.2 mm -54.47 -48.14 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 CA-C-O 118.624 -0.703 . . . . 0.79 109.783 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -67.36 -28.76 68.22 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 114.162 1.171 . . . . 1.76 114.162 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -73.89 -35.52 64.7 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.307 0.643 . . . . 3.63 112.244 171.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -72.43 -29.08 63.38 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.607 1.163 . . . . 2.36 111.515 172.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -62.52 -21.6 65.66 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.83 1.652 . . . . 3.42 113.355 175.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.15 -10.91 59.78 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.748 1.388 . . . . 1.93 114.748 169.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -135.99 -34.28 0.81 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 116.206 1.928 . . . . 2.35 116.206 -166.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.6 m170 -115.64 115.89 27.16 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.421 -1.425 . . . . 4.02 112.105 -170.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -140.95 152.88 45.33 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.187 1.395 . . . . 5.82 110.342 162.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.32 -41.6 0.78 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 127.309 2.385 . . . . 2.91 114.353 -177.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 22.3 mmt85 -98.41 139.92 33.44 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 127.949 2.5 . . . . 5.38 111.414 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 45.3 mm -101.41 145.67 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 N-CA-C 107.803 -1.184 . . . . 2.1 107.803 148.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 t -101.62 152.93 20.22 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.518 -0.739 . . . . 1.5 111.759 169.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -58.23 -51.66 68.84 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.021 0.828 . . . . 2.43 110.96 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -61.06 -15.14 29.16 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.119 1.368 . . . . 3.21 112.565 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -64.51 -57.85 8.03 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.468 1.107 . . . . 3.05 111.963 -174.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.56 -42.32 78.39 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.012 -1.68 . . . . 2.02 111.768 176.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 30.0 t-105 -63.96 -48.54 76.06 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 119.247 -0.406 . . . . 0.69 111.907 -177.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 36.5 p -62.59 -44.71 95.62 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.777 1.231 . . . . 2.72 111.064 175.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.443 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 93.3 mt -62.28 -38.69 90.31 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 118.389 -0.815 . . . . 0.8 112.852 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 23.3 mm -55.22 -46.67 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 CA-C-N 120.397 1.453 . . . . 0.93 111.585 175.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.55 -29.23 72.93 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 119.458 -0.634 . . . . 0.83 113.186 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.42 -22.82 77.79 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-O 118.676 -1.069 . . . . 0.59 114.163 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.7 mp -88.24 -47.62 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 118.959 1.38 . . . . 0.9 110.323 162.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.6 m -75.97 31.89 0.12 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 127.017 2.127 . . . . 1.77 112.355 -169.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.61 -85.39 1.16 Allowed Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.3 0.952 . . . . 0.99 111.095 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -64.23 -36.16 47.93 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.743 2.295 . . . . 1.51 111.974 -176.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.62 -17.63 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 113.579 0.955 . . . . 1.18 113.579 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.54 -44.31 94.55 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 120.037 1.289 . . . . 1.07 112.846 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.25 -36.83 84.96 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 120.753 -1.217 . . . . 3.32 110.643 176.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.32 -46.87 88.38 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.579 1.152 . . . . 1.13 111.355 173.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 83.4 mt -50.69 -58.87 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.732 0.813 . . . . 1.15 110.636 172.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -63.92 -37.13 86.29 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.859 -0.526 . . . . 1.91 112.251 -176.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.291 3.9 pt-20 -76.83 -13.99 59.95 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.041 -1.037 . . . . 3.05 112.239 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.61 -29.18 30.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.44 1.896 . . . . 2.46 114.643 167.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -76.23 3.94 9.74 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 123.104 1.43 . . . . 2.44 111.995 173.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -132.41 -61.2 0.87 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 126.119 1.768 . . . . 2.6 111.06 -175.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.32 14.12 2.02 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 129.113 2.965 . . . . 4.52 115.879 164.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.6 t -158.89 32.7 0.22 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.298 1.439 . . . . 6.71 110.968 -174.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 49.2 m -78.37 -13.42 59.85 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.472 -1.393 . . . . 8.77 114.332 176.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.255 1.365 0 C-N-CA 130.905 3.682 . . . . 10.82 109.032 -172.351 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 107.005 -1.479 . . . . 8.33 107.005 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -50.5 -117.88 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.441 0 CA-C-N 118.387 0.54 . . . . 6.12 110.389 109.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 50.2 t -98.6 -96.68 0.22 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.202 2.201 . . . . 3.92 108.746 172.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 135.44 150.26 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.199 1 C-N-CA 132.793 4.437 . . . . 2.27 111.783 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 7.2 t -75.4 137.64 41.17 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.093 -1.077 . . . . 2.06 108.093 153.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -60.77 -28.67 68.9 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 122.568 0.347 . . . . 2.86 110.573 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -39.25 69.42 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.131 -0.981 . . . . 1.14 111.006 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -68.43 -60.67 2.27 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-O 119.319 -0.372 . . . . 2.55 110.359 176.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -55.87 -27.24 50.83 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.341 1.237 . . . . 6.51 114.341 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.794 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -72.14 -45.61 59.84 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.193 1.397 . . . . 0.81 111.821 169.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 63.2 t -59.63 -39.62 80.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-N 120.892 1.678 . . . . 0.86 110.442 170.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 10.6 mt -53.9 -50.21 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-O 117.605 -1.188 . . . . 0.79 110.962 169.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 3.7 t -59.07 -43.23 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.072 1.306 . . . . 0.55 111.671 178.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.3 mp -61.25 -45.76 93.2 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.06 0.845 . . . . 1.03 111.615 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 38.6 t -66.89 -44.38 88.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.262 1.425 . . . . 0.72 113.141 178.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -66.43 -42.17 88.12 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.346 1.058 . . . . 3.13 110.359 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -62.76 -31.02 71.89 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.625 0.972 . . . . 2.63 113.625 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -71.32 -55.32 8.26 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.478 -1.389 . . . . 2.36 111.949 176.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -61.13 -39.6 90.63 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.86 -1.15 . . . . 2.41 113.191 -178.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.65 -32.43 72.59 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.179 1.354 . . . . 4.59 112.798 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -76.32 -43.62 40.41 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.76 -1.213 . . . . 2.52 112.128 172.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 54.0 t -64.67 -51.03 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.462 1.105 . . . . 3.58 113.173 -177.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 36.3 p 176.83 -80.47 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 127.624 2.37 . . . . 4.3 108.379 -174.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 37.6 tttp 178.25 -60.24 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 129.97 3.308 . . . . 5.74 108.72 -177.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -131.27 4.35 4.36 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 114.257 1.206 . . . . 7.02 114.257 -173.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 5.6 p -141.77 106.53 4.89 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.371 -1.455 . . . . 4.25 113.503 -170.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 1.1 mt -85.84 -37.98 18.61 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.535 1.134 . . . . 8.94 113.285 -176.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 6.4 m -62.08 -28.57 44.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.404 1.082 . . . . 5.06 112.035 -176.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.12 93.06 5.74 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.342 1.057 . . . . 7.82 111.587 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 64.1 t-20 -39.58 126.6 1.88 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 125.89 1.676 . . . . 8.55 112.72 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -171.27 -55.87 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 126.23 1.812 . . . . 10.06 110.705 -164.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.5 tt -71.52 176.65 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 107.476 -1.305 . . . . 2.59 107.476 156.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 66.8 m -142.96 161.36 38.32 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 119.769 -1.832 . . . . 2.59 110.198 173.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -68.4 -20.7 64.69 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 120.907 -1.12 . . . . 2.08 112.806 -175.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 7.8 p -66.77 -31.25 71.77 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.262 1.425 . . . . 1.95 113.371 164.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 6.1 m -67.51 -35.56 79.34 Favored 'General case' 0 C--O 1.225 -0.229 0 O-C-N 120.574 -1.329 . . . . 1.29 112.344 -177.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.455 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 12.9 t80 -57.72 -58.8 6.74 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 119.606 1.094 . . . . 1.95 111.434 -177.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.5 ptt180 -54.81 -26.07 32.44 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.618 1.167 . . . . 2.16 112.373 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . 0.405 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 24.6 mt-10 -90.38 -50.88 5.71 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 125.739 1.616 . . . . 3.54 112.703 -174.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 63.5 ttp -45.53 -45.14 13.19 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 124.247 1.019 . . . . 2.62 110.176 162.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 5.3 mt -57.85 -50.48 73.16 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 125.281 1.432 . . . . 1.27 112.759 170.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -75.12 -21.96 58.51 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 120.411 1.46 . . . . 3.13 114.139 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 1.5 mppt? -85.02 -49.43 8.3 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.895 1.278 . . . . 2.6 110.068 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -74.27 -74.23 0.2 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.092 0.957 . . . . 3.85 111.442 172.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 10.7 mt -75.11 33.61 0.1 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.946 1.699 . . . . 2.56 113.214 -173.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -59.01 -23.03 61.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.641 1.576 . . . . 1.51 113.286 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -79.34 -61.42 2.01 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.226 0.921 . . . . 1.63 110.687 -177.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 ptp -63.14 -26.73 68.95 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.564 1.075 . . . . 3.22 113.848 177.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.08 -62.25 1.46 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.433 0.561 . . . . 3.24 109.696 167.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 32.3 m 56.75 -82.13 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.894 1.678 . . . . 4.64 111.995 -169.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -85.22 161.65 19.5 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.368 1.867 . . . . 3.9 113.779 -170.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 44.0 m -70.8 -25.58 62.93 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 125.684 1.594 . . . . 2.92 112.164 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -59.01 -52.62 52.31 Favored Glycine 0 N--CA 1.469 0.889 0 C-N-CA 126.204 1.859 . . . . 1.71 112.345 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -60.34 -30.75 69.73 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.208 -0.584 . . . . 3.63 112.101 172.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -77.61 -15.85 58.96 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 120.915 -1.116 . . . . 6.14 113.878 171.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -65.54 -35.55 81.19 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 119.165 -2.209 . . . . 3.9 111.192 169.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.61 -19.23 36.87 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 114.901 1.445 . . . . 1.01 114.901 164.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.69 -54.0 6.28 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.632 1.106 . . . . 0.9 111.151 166.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -57.57 -40.41 78.91 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.487 1.115 . . . . 2.71 113.468 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt -52.9 -32.71 46.68 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.897 0.879 . . . . 3.22 112.456 178.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 39.7 mt -77.98 -45.14 24.65 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 118.708 -0.663 . . . . 0.74 110.543 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.81 -47.83 79.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.36 -0.829 . . . . 0.8 109.575 -177.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -66.84 -32.38 73.62 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.961 1.097 . . . . 1.76 113.961 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -69.22 -35.71 76.47 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.555 -0.716 . . . . 3.75 112.003 171.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -74.28 -28.54 61.24 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.829 1.252 . . . . 2.65 111.943 173.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -63.73 -21.48 66.42 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.095 1.758 . . . . 3.48 113.266 175.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.57 -9.42 59.78 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.701 1.371 . . . . 1.95 114.701 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -136.34 -35.02 0.76 Allowed 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 116.104 1.89 . . . . 2.37 116.104 -166.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -109.54 108.1 18.44 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.47 -1.394 . . . . 3.91 111.469 -174.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -121.04 156.32 32.45 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.32 1.448 . . . . 5.14 110.309 161.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 64.91 -5.13 1.33 Allowed Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.647 1.594 . . . . 3.16 116.615 169.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 21.8 mmt85 -144.88 152.73 40.69 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 126.902 2.081 . . . . 5.11 111.214 -165.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 32.7 mm -122.01 150.18 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.528 1.531 . . . . 2.32 107.44 156.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.3 t -108.03 157.97 17.79 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.632 0.773 . . . . 1.58 112.226 169.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -60.01 -50.86 72.06 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 121.109 -0.995 . . . . 2.31 111.353 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -61.7 -16.24 47.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.796 1.238 . . . . 3.39 112.637 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -64.2 -55.25 22.98 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.115 0.966 . . . . 2.97 112.188 -175.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -57.22 -44.17 83.48 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.185 -1.572 . . . . 2.06 111.848 175.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -64.01 -48.04 77.92 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 119.258 -0.401 . . . . 0.7 112.031 -177.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 40.3 p -62.42 -44.52 96.22 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.659 1.184 . . . . 2.68 111.286 175.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.455 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 93.8 mt -62.91 -38.8 92.42 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 118.164 -0.922 . . . . 0.7 112.599 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 23.2 mm -54.36 -46.18 69.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 CA-C-N 120.514 1.506 . . . . 0.89 111.389 174.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.46 -29.1 72.4 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 118.569 0.622 . . . . 0.77 113.035 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.69 -22.49 78.68 Favored Glycine 0 CA--C 1.535 1.304 0 CA-C-O 118.651 -1.083 . . . . 0.6 114.264 178.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.6 mp -87.29 -48.67 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 CA-C-N 119.132 1.466 . . . . 0.94 109.879 162.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 2.6 m -75.38 33.62 0.11 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 127.209 2.204 . . . . 1.68 111.913 -169.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -88.95 -87.17 1.24 Allowed Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.54 1.067 . . . . 0.98 110.758 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.78 -34.29 62.08 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.799 2.333 . . . . 1.45 111.954 -175.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.29 -20.98 23.12 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 118.703 -0.665 . . . . 1.17 112.764 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.01 87.71 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 120.159 1.345 . . . . 1.0 112.911 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.37 -36.83 83.5 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 120.825 -1.172 . . . . 3.32 110.231 177.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -46.68 88.54 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.751 1.221 . . . . 1.49 111.886 173.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 77.8 mt -50.61 -59.35 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.9 0.88 . . . . 1.18 110.515 171.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . 0.413 ' HE2' ' HG3' ' A' ' 25' ' ' LYS . 81.2 t60 -65.02 -35.95 82.83 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.935 -0.478 . . . . 1.85 112.269 -175.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.264 4.3 pt-20 -77.08 -15.89 59.41 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 117.951 -1.024 . . . . 3.28 112.139 177.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -81.12 -32.04 33.98 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.944 1.697 . . . . 2.4 114.392 168.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -73.47 5.04 4.07 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 123.212 1.482 . . . . 2.31 112.177 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -134.29 -61.46 0.78 Allowed 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 126.644 1.977 . . . . 2.6 111.24 -174.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.68 16.5 1.98 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 129.202 3.001 . . . . 4.32 115.729 163.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 47.6 t -159.41 32.12 0.2 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.619 1.568 . . . . 6.86 110.915 -175.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 46.4 m -78.38 -13.03 60.02 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 120.596 -1.315 . . . . 8.96 114.467 176.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.257 1.468 0 C-N-CA 131.653 3.981 . . . . 10.95 107.723 -172.152 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 m . . . . . 0 N--CA 1.473 0.705 0 CA-C-O 118.871 -0.585 . . . . 10.29 110.645 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -71.54 -116.5 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 107.376 -1.342 . . . . 7.14 107.376 140.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 53.2 t -79.06 -74.19 0.3 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.627 1.171 . . . . 4.31 109.345 154.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 86.11 146.22 0.06 Allowed 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 129.58 3.152 . . . . 2.57 112.029 -176.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 47.3 p -81.23 155.41 26.13 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 121.323 -0.861 . . . . 1.3 109.792 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -61.21 -35.44 77.2 Favored 'General case' 0 C--O 1.223 -0.307 0 O-C-N 120.556 -1.34 . . . . 2.13 111.641 -177.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -49.56 76.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.507 1.523 . . . . 0.91 110.9 174.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -69.0 -53.06 22.55 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.217 1.807 . . . . 2.74 111.27 -177.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.07 -34.82 45.42 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.256 1.022 . . . . 5.48 110.356 169.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.832 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -77.04 -39.28 50.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 117.343 -1.313 . . . . 0.46 112.992 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.7 t -52.72 -45.28 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 121.111 1.778 . . . . 0.61 110.719 164.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.5 mt -58.06 -50.55 77.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.124 0.874 . . . . 0.79 111.148 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.9 t -60.07 -34.95 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.63 1.172 . . . . 0.53 112.702 176.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 mp -72.09 -43.03 65.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.8 1.182 . . . . 0.94 110.967 174.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.3 t -58.6 -45.7 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 125.456 1.503 . . . . 0.57 110.99 173.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 16.3 tm-20 -67.01 -45.76 76.57 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.867 1.267 . . . . 2.9 111.12 174.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.429 ' HA ' ' HD2' ' A' ' 21' ' ' LYS 0.285 1.5 t30 -71.1 -7.32 45.69 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 115.143 1.534 . . . . 2.83 115.143 179.244 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -82.82 -66.79 0.85 Allowed 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.547 0.739 . . . . 2.24 111.892 153.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -59.73 -32.8 70.88 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.266 1.21 . . . . 2.11 114.266 -167.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.429 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 10.0 ptmt -54.76 -25.88 30.68 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 119.723 -1.861 . . . . 2.5 113.756 175.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -82.66 -1.36 50.88 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.719 1.377 . . . . 2.79 114.719 178.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.1 m -69.91 156.16 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.84 1.2 . . . . 3.85 109.808 170.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.6 t -69.25 -13.3 62.33 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 115.777 1.769 . . . . 7.24 115.777 -166.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -179.68 -51.26 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.025 2.13 . . . . 11.72 111.952 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -164.13 155.74 16.28 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 129.305 3.042 . . . . 9.21 109.426 175.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.2 p -179.25 114.57 0.06 Allowed 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.391 0.996 . . . . 5.32 113.219 176.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.0 mt -86.51 -11.21 52.34 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.533 1.679 . . . . 8.99 115.533 -175.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.504 HG13 ' H ' ' A' ' 30' ' ' LYS . 11.3 p -140.54 -78.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.318 0 C-N-CA 124.839 1.255 . . . . 6.86 108.809 157.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.504 ' H ' HG13 ' A' ' 29' ' ' VAL . 11.4 ttpp -69.36 109.77 4.34 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 112.809 0.67 . . . . 9.92 112.809 -171.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -76.76 -179.91 5.67 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 122.321 1.058 . . . . 9.55 112.911 178.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.3 tmtt? -143.37 44.55 1.53 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 126.014 1.726 . . . . 8.44 109.404 172.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 14.4 tt -72.64 169.26 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.825 1.65 . . . . 2.8 109.374 161.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.1 t -102.43 141.98 34.37 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.916 -1.115 . . . . 3.24 109.526 164.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 73.4 mttt -61.24 -17.8 55.18 Favored 'General case' 0 CA--C 1.548 0.885 0 O-C-N 120.054 -1.654 . . . . 2.22 113.026 174.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.3 t -61.4 -33.2 73.28 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.466 -0.771 . . . . 3.86 112.578 166.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -65.02 -37.5 87.83 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 120.878 -1.138 . . . . 1.64 113.185 -173.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.497 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 67.8 t80 -62.15 -54.75 36.61 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.887 1.221 . . . . 2.04 111.899 176.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 24.7 ptt180 -65.64 -5.91 9.71 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.203 1.001 . . . . 2.22 113.187 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.414 ' HB3' ' HE2' ' A' ' 44' ' ' LYS . 6.5 mt-10 -102.27 -43.1 5.8 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 126.657 1.983 . . . . 2.82 111.851 176.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 4.9 ttm -52.65 -43.29 65.4 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.766 1.27 . . . . 1.89 109.968 168.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.497 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 72.1 mt -74.72 11.92 0.94 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 127.889 2.476 . . . . 2.22 115.402 169.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -125.74 -11.38 6.67 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 125.7 1.6 . . . . 2.95 113.023 166.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.414 ' HE2' ' HB3' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -109.0 -76.48 0.61 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.278 1.431 . . . . 1.82 110.983 176.51 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.47 -19.67 66.03 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 120.624 1.557 . . . . 3.1 115.026 -175.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -110.34 7.02 22.82 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.427 1.269 . . . . 1.82 114.427 177.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -50.32 -33.9 21.82 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 117.615 2.45 . . . . 2.07 117.615 -165.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -68.47 -25.12 64.82 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 121.102 1.773 . . . . 3.38 112.214 -177.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.2 tpp -73.12 -7.44 51.37 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.673 1.989 . . . . 1.75 113.144 175.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.28 21.98 4.81 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.91 1.684 . . . . 3.69 114.317 -162.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.5 t -35.31 -63.45 0.34 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 126.132 1.773 . . . . 4.47 112.426 164.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -81.53 95.97 7.29 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 124.335 1.054 . . . . 6.14 108.167 -177.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.2 p -51.42 -18.12 0.95 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.563 1.945 . . . . 3.44 115.831 -168.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -58.02 -35.07 74.71 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.39 0.995 . . . . 1.72 112.63 171.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 74.1 m-80 -59.22 -38.41 79.87 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 117.83 0.815 . . . . 3.85 111.535 172.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.94 -27.15 49.27 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 114.498 1.296 . . . . 4.9 114.498 172.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -59.56 -37.01 77.32 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 119.546 -1.971 . . . . 3.18 110.971 167.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.3 -11.5 42.33 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 114.952 1.464 . . . . 1.12 114.952 169.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.69 -52.03 6.38 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 120.502 1.501 . . . . 0.66 112.173 164.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.94 -35.32 76.42 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 118.951 0.796 . . . . 2.31 112.268 -176.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -24.67 67.73 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.892 1.071 . . . . 4.61 113.892 177.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.6 mt -73.98 -34.66 64.3 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 122.662 0.385 . . . . 0.77 111.067 176.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 37.8 mm -58.27 -50.36 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.064 0.946 . . . . 1.01 110.982 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.36 -38.18 89.29 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.016 0.926 . . . . 2.22 112.645 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.38 -41.51 76.34 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.845 0.858 . . . . 3.02 112.12 166.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -73.16 -40.97 64.41 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 123.437 0.695 . . . . 3.1 111.449 -178.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -49.57 -41.99 43.11 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.893 1.277 . . . . 2.56 112.723 175.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.82 -16.93 62.5 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.322 1.601 . . . . 2.16 115.322 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -133.68 16.04 3.97 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.505 1.298 . . . . 3.8 114.505 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -119.48 107.05 12.84 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.897 1.279 . . . . 5.07 110.97 -174.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -73.63 0.23 13.38 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.467 1.907 . . . . 5.54 114.223 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 99.59 -2.43 57.31 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 117.785 -1.564 . . . . 2.82 113.54 -167.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.532 ' HG2' HH11 ' A' ' 73' ' ' ARG . 0.0 OUTLIER -70.89 77.03 0.64 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.134 1.967 . . . . 5.25 109.804 164.306 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -55.46 125.79 11.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 107.763 -1.199 . . . . 3.17 107.763 164.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 36.9 t -137.31 146.19 44.34 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 124.792 1.237 . . . . 1.82 111.594 -170.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -53.09 -41.6 65.09 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.95 1.093 . . . . 2.18 113.95 -171.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -76.62 -14.46 59.98 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.837 0.681 . . . . 4.29 112.837 -174.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -64.84 -49.31 71.1 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.146 -0.971 . . . . 2.98 109.453 172.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -53.68 -48.18 69.73 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.261 -1.524 . . . . 2.05 111.929 171.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 30.5 t-105 -68.97 -46.15 68.85 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.843 0.683 . . . . 0.56 112.843 -171.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 57.5 p -59.73 -45.91 90.73 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.994 0.918 . . . . 2.5 111.027 171.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 91.6 mt -62.19 -38.46 89.21 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 117.31 -1.329 . . . . 0.6 112.323 -179.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.4 mm -50.61 -44.02 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 121.294 1.861 . . . . 0.66 111.261 174.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.11 -22.25 72.37 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 125.194 1.378 . . . . 0.57 114.308 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.14 -20.0 70.66 Favored Glycine 0 CA--C 1.532 1.123 0 CA-C-N 118.362 1.081 . . . . 0.6 113.193 173.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.5 mp -102.84 -45.49 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.768 1.227 . . . . 1.05 110.947 163.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.0 m -80.88 72.45 7.88 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 127.108 2.163 . . . . 1.48 108.635 -176.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -158.92 -71.23 0.02 OUTLIER Glycine 0 CA--C 1.525 0.664 0 C-N-CA 127.467 2.461 . . . . 0.9 109.052 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -55.77 -55.63 2.84 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.187 2.591 . . . . 1.11 111.64 170.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.8 pt -74.27 -17.33 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 N-CA-C 114.361 1.245 . . . . 1.01 114.361 179.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.74 -48.06 82.43 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.91 0.777 . . . . 1.08 112.435 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.69 -47.65 76.43 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.217 -0.927 . . . . 2.95 111.804 169.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.4 tt -57.01 -45.35 83.13 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-O 117.722 -1.132 . . . . 1.69 111.403 -178.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.9 mt -46.32 -55.28 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 120.009 1.277 . . . . 0.88 111.005 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -61.73 -49.98 74.25 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.296 0.638 . . . . 1.81 111.305 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -61.9 -36.58 81.73 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.891 0.876 . . . . 3.68 111.434 -178.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -68.13 -44.6 75.73 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 127.896 2.478 . . . . 2.19 111.314 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -68.2 -21.86 64.84 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.31 1.414 . . . . 3.33 111.714 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.93 -51.49 8.5 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.535 0.734 . . . . 2.24 111.191 172.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -64.6 -26.87 68.59 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.26 1.824 . . . . 6.46 113.324 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.6 m 53.91 20.26 2.3 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.608 2.363 . . . . 8.21 114.021 -170.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 74.89 21.85 1.98 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 128.541 2.737 . . . . 12.76 114.242 -178.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 24.9 t . . . . . 0 C--O 1.253 1.247 0 CA-C-O 115.569 -2.158 . . . . 10.76 114.515 168.782 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 52.6 m . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 119.145 -0.455 . . . . 11.48 109.847 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.56 -117.47 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.123 0 N-CA-C 108.348 -0.982 . . . . 8.08 108.348 138.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 42.0 t -80.81 -83.26 0.11 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.581 1.952 . . . . 4.73 110.868 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 94.73 157.54 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 129.048 2.939 . . . . 2.35 114.039 163.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.1 p -81.83 155.23 25.49 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 120.866 -1.146 . . . . 1.34 109.754 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -61.05 -36.51 79.79 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 120.728 1.604 . . . . 2.36 111.752 -178.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.04 -47.86 84.43 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.615 1.166 . . . . 0.91 110.34 176.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -68.15 -54.1 20.41 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 125.314 1.446 . . . . 2.98 111.645 -177.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -33.91 66.6 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.517 1.127 . . . . 4.54 109.96 172.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.832 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.96 -45.33 67.63 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 117.199 -1.381 . . . . 0.54 112.201 173.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 22.5 t -53.78 -41.27 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-N 121.154 1.797 . . . . 0.68 110.625 170.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 70.3 mt -58.48 -54.47 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.405 -0.807 . . . . 0.98 112.172 169.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.4 t -58.34 -42.88 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 119.405 1.002 . . . . 0.69 112.103 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.5 mp -64.87 -47.1 79.1 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.796 1.238 . . . . 1.2 111.469 176.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.9 t -57.65 -48.22 83.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 123.292 0.637 . . . . 0.7 110.514 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 8.8 tm-20 -62.89 -34.18 76.86 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.532 1.133 . . . . 2.87 111.738 175.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.0 -25.24 64.41 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.596 1.544 . . . . 2.65 113.465 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -72.63 -52.86 13.62 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.566 -0.708 . . . . 2.0 111.0 165.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -65.9 -43.59 87.74 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.545 -0.722 . . . . 2.14 112.923 -173.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 7.9 ptmt -58.01 -16.58 13.08 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 120.274 -1.516 . . . . 3.43 114.941 177.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -89.61 -4.25 57.9 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.737 1.384 . . . . 3.25 114.737 173.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 3.4 m -77.96 158.72 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 120.593 1.542 . . . . 3.9 111.188 173.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 2.1 t -60.27 -11.78 7.3 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 118.469 2.766 . . . . 7.22 118.469 -168.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -176.2 -50.91 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.465 1.906 . . . . 10.91 111.973 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -172.84 148.72 1.86 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 130.313 3.445 . . . . 9.7 107.313 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 100.0 p -162.74 121.68 2.18 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 121.106 1.775 . . . . 5.84 114.127 174.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 32.5 mt -82.7 -20.26 36.43 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 115.61 1.707 . . . . 9.0 115.61 -168.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 11.9 p -149.05 -65.64 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 C-N-CA 126.996 2.118 . . . . 7.28 108.874 168.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 12.4 ttpp -80.58 110.5 16.12 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.142 0.496 . . . . 9.7 111.551 -177.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -77.47 179.36 6.54 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.989 1.376 . . . . 10.16 113.152 -178.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.45 56.18 0.98 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.479 1.911 . . . . 8.18 107.936 168.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 16.6 tt -82.11 169.78 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 N-CA-C 106.991 -1.485 . . . . 2.95 106.991 157.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 29.6 t -100.18 144.56 29.06 Favored 'General case' 0 N--CA 1.47 0.553 0 O-C-N 120.735 -1.228 . . . . 3.06 109.559 161.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -58.16 -21.64 47.91 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.572 -1.33 . . . . 2.09 112.766 171.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 5.1 t -63.43 -34.46 77.8 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.756 0.65 . . . . 3.68 112.756 170.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 14.7 m -63.17 -42.66 99.44 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 120.942 -1.099 . . . . 1.78 112.05 -175.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.463 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 65.4 t80 -51.33 -60.28 3.3 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.174 0.99 . . . . 2.09 112.061 171.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.1 ptt180 -65.18 -14.7 61.24 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.604 0.964 . . . . 2.3 113.604 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . 0.445 ' HB3' ' HE2' ' B' ' 147' ' ' LYS . 7.6 mt-10 -94.21 -40.91 9.76 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 126.467 1.907 . . . . 2.84 113.398 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.3 tmm? -59.77 -39.44 84.86 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.342 -0.614 . . . . 2.31 109.342 167.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . 0.436 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 94.5 mt -66.76 9.15 0.2 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.275 2.23 . . . . 2.83 115.352 164.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -128.6 -21.84 3.39 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 114.465 1.283 . . . . 3.08 114.465 168.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' B' ' 143' ' ' GLU . 0.0 OUTLIER -108.19 -42.44 4.63 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.758 1.223 . . . . 1.81 113.56 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -106.77 -26.07 11.45 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.723 2.009 . . . . 2.77 112.67 -163.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.93 18.8 20.84 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 125.881 1.672 . . . . 1.85 111.996 167.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -59.5 -35.46 74.18 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 116.04 1.867 . . . . 2.36 116.04 -159.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -60.95 -45.48 94.55 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 120.002 1.273 . . . . 3.2 111.159 -178.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 8.2 tpp -59.8 -17.03 32.6 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.042 1.737 . . . . 1.79 113.174 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.07 26.25 9.78 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.836 2.055 . . . . 3.98 112.686 -174.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 43.4 t -64.85 -16.69 63.48 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.161 1.541 . . . . 4.65 115.161 177.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -100.98 125.41 47.58 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 120.019 1.281 . . . . 5.09 108.354 161.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 58.0 p -64.43 -21.51 66.67 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.802 1.038 . . . . 3.28 113.802 -173.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -61.64 -37.1 93.66 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-N 119.646 1.112 . . . . 1.91 111.89 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -62.66 -38.71 91.41 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 119.01 -0.519 . . . . 4.03 111.688 174.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -77.19 -27.45 53.6 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 119.739 1.154 . . . . 4.69 114.018 173.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -57.68 -40.29 79.07 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 119.601 -1.937 . . . . 3.37 111.473 166.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.06 -12.9 43.06 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.31 1.596 . . . . 1.31 115.31 170.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.53 -50.04 8.65 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 120.368 1.44 . . . . 0.81 112.337 165.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.55 -35.1 76.81 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.617 0.644 . . . . 2.16 112.173 -177.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.8 -23.11 67.08 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 114.13 1.159 . . . . 4.64 114.13 176.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 22.1 mt -74.13 -33.85 63.69 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 122.579 0.352 . . . . 0.81 111.46 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 29.1 mm -59.71 -50.08 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 124.349 1.06 . . . . 0.9 110.527 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -65.52 -36.04 82.65 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.471 0.653 . . . . 2.1 112.671 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -57.14 -43.46 82.47 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.672 0.789 . . . . 3.15 112.232 165.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 4.9 tp -69.79 -42.23 74.02 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 118.485 0.584 . . . . 3.16 111.287 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -51.5 -40.83 60.33 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.196 1.398 . . . . 2.67 112.173 174.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.46 -15.25 62.44 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 115.914 1.82 . . . . 2.1 115.914 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -135.08 14.71 3.55 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 115.199 1.555 . . . . 3.81 115.199 -175.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -122.68 110.0 14.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.934 1.294 . . . . 5.07 110.908 -171.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -73.47 -27.04 61.19 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.876 2.07 . . . . 5.46 113.634 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 125.36 -8.33 7.91 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-O 117.953 -1.471 . . . . 2.88 113.728 -169.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -68.51 76.7 0.28 Allowed 'General case' 0 C--N 1.346 0.421 0 CA-C-N 120.411 2.106 . . . . 7.53 109.522 157.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.73 137.4 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 107.922 -1.14 . . . . 3.48 107.922 164.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 16.9 t -142.24 147.25 36.18 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.623 0.601 . . . . 1.92 112.623 -173.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -48.9 -48.53 42.38 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.793 1.237 . . . . 2.12 113.751 -172.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -74.36 -12.71 60.6 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 113.636 0.976 . . . . 4.39 113.636 -174.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -60.96 -51.45 69.21 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.135 -0.978 . . . . 3.06 109.399 171.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -52.29 -49.13 64.75 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.746 -1.221 . . . . 1.98 112.494 172.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 26.7 t-105 -69.1 -45.13 71.02 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 118.576 -0.726 . . . . 0.66 112.457 -172.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 46.3 p -59.34 -45.36 91.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.458 1.103 . . . . 2.56 110.808 170.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.463 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 58.7 mt -59.06 -40.91 86.61 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 117.36 -1.305 . . . . 0.53 112.584 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 22.5 mm -53.69 -40.8 44.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 CA-C-N 121.382 1.901 . . . . 0.61 112.074 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -65.18 -25.84 71.25 Favored Glycine 0 N--CA 1.473 1.107 0 C-N-CA 124.407 1.004 . . . . 0.56 113.545 177.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -62.25 -19.68 59.86 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 118.391 1.095 . . . . 0.72 113.986 173.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.2 mp -110.27 -36.78 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 CA-C-N 118.449 1.125 . . . . 1.18 111.733 166.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 22.7 m -82.32 73.79 9.33 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 125.948 1.699 . . . . 1.52 108.04 -178.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -161.85 -67.78 0.02 OUTLIER Glycine 0 CA--C 1.529 0.947 0 C-N-CA 127.283 2.373 . . . . 0.79 110.026 -175.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -58.27 -61.28 0.28 Allowed 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.307 2.671 . . . . 0.96 111.178 168.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.9 pt -66.48 -28.09 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 CA-C-N 119.242 0.928 . . . . 1.18 112.975 177.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . 0.445 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -56.57 -46.01 80.98 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.889 0.768 . . . . 1.05 112.826 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -65.98 -30.17 70.69 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.171 -0.955 . . . . 4.77 113.488 172.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 35.4 mt -68.14 -41.02 82.26 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.589 1.086 . . . . 4.86 111.943 176.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . 0.445 HD12 ' HA ' ' B' ' 194' ' ' ALA . 70.5 mt -53.53 -42.88 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 119.278 0.944 . . . . 1.12 110.805 171.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -61.98 -47.77 83.33 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 117.835 -1.078 . . . . 2.11 111.93 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -52.57 -49.32 65.2 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.368 1.067 . . . . 3.47 110.666 171.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -46.52 66.55 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.036 1.334 . . . . 4.52 112.761 -177.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -77.8 -4.7 47.78 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.614 0.643 . . . . 2.7 112.527 -177.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -98.82 -49.04 4.7 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.061 0.945 . . . . 3.32 111.261 170.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -64.43 -28.7 69.85 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 128.019 2.527 . . . . 5.64 112.967 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 59.46 16.72 5.41 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.373 1.869 . . . . 7.38 113.314 -166.136 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 8.0 t 82.43 12.65 0.54 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 128.397 2.679 . . . . 12.23 116.229 174.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 C--O 1.255 1.365 0 CA-C-O 115.184 -2.341 . . . . 11.15 115.757 175.306 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 CA--C 1.503 -0.827 0 N-CA-C 108.736 -0.839 . . . . 9.96 108.736 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -133.74 -17.7 2.2 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 124.813 1.321 . . . . 6.83 113.223 -134.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 74.8 m 64.65 20.66 12.21 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.677 1.991 . . . . 3.27 115.828 162.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.408 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 5.3 m-30 -44.72 120.75 2.4 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.978 1.311 . . . . 2.44 111.916 -177.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.9 p -61.84 156.58 20.27 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 118.967 0.803 . . . . 1.15 110.403 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -63.19 -27.78 69.6 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.047 0.758 . . . . 2.16 113.047 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.3 tt -69.36 -47.87 63.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.728 1.211 . . . . 1.32 109.984 172.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -49.74 62.8 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 122.837 0.455 . . . . 2.55 111.367 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.94 -36.49 17.48 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 125.729 1.612 . . . . 5.53 111.124 172.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.19 -21.33 56.6 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.184 -1.572 . . . . 0.68 113.716 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.1 t -60.89 -38.03 78.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 CA-C-N 121.143 1.792 . . . . 1.22 110.066 169.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.5 mt -56.7 -56.95 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-O 118.825 -0.607 . . . . 1.12 109.967 168.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 99.5 t -54.34 -40.28 47.66 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 124.642 1.177 . . . . 0.72 112.933 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -72.62 -39.02 67.6 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.268 -0.895 . . . . 1.09 112.432 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.1 t -64.55 -40.41 88.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.067 0.947 . . . . 0.81 111.53 172.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -55.15 -54.21 46.16 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.38 1.072 . . . . 2.69 110.094 174.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -56.48 -30.16 62.6 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 115.479 1.659 . . . . 3.25 115.479 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -73.59 -57.85 3.71 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.532 0.606 . . . . 2.35 112.171 173.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -68.38 -17.33 64.21 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.311 1.226 . . . . 1.82 114.311 -171.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -44.27 -32.64 1.34 Allowed 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 120.546 1.521 . . . . 2.92 113.215 171.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -93.4 8.02 42.17 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.07 1.748 . . . . 2.34 114.033 -174.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.4 m -139.66 165.49 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 125.398 1.479 . . . . 2.3 110.27 172.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.21 -42.68 62.39 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.39 0.885 . . . . 3.43 113.39 -172.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.423 ' HE2' ' HA ' ' A' ' 25' ' ' LYS . 0.9 OUTLIER -169.5 -51.19 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.951 1.3 . . . . 5.39 110.246 173.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 13.9 m-30 -125.85 13.52 7.95 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.426 1.49 . . . . 7.46 111.925 -175.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -80.36 36.94 0.38 Allowed 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 115.665 1.728 . . . . 4.27 115.665 -156.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -59.02 14.09 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 130.199 3.4 . . . . 8.5 115.331 176.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.5 t -152.71 141.47 14.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 128.941 2.897 . . . . 4.16 107.059 -178.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt 72.96 -47.08 0.67 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 127.063 2.145 . . . . 8.71 114.294 177.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -65.38 -65.21 0.7 Allowed 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.021 0.828 . . . . 6.57 109.876 -178.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.15 111.55 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.855 1.662 . . . . 6.81 112.207 167.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 12.0 pt -64.61 151.87 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 O-C-N 120.681 -1.262 . . . . 2.94 111.085 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.4 t -76.41 138.63 40.5 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 120.504 -1.372 . . . . 3.44 111.954 177.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.9 mtpt -72.51 -6.74 45.96 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.098 -0.955 . . . . 3.28 113.309 169.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.1 p -80.3 -48.31 13.2 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.294 0.952 . . . . 3.09 111.056 156.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.6 m -59.06 -35.6 73.61 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 117.234 -1.365 . . . . 1.28 113.751 -167.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -60.16 -60.38 3.91 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 121.058 1.754 . . . . 2.38 112.07 172.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -63.78 -23.87 67.54 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.872 0.693 . . . . 2.79 112.872 -178.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -71.45 -49.0 45.77 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.121 1.368 . . . . 3.23 112.774 169.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 8.4 tmm? -59.37 -35.88 74.73 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 126.125 1.77 . . . . 1.37 111.804 -174.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.2 mt -59.07 -20.24 51.58 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.679 1.592 . . . . 1.24 114.695 168.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.47 -1.15 18.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.789 1.177 . . . . 2.79 113.228 175.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.62 -37.14 7.23 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.144 1.378 . . . . 1.86 112.839 172.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -96.79 -72.2 0.65 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.93 1.692 . . . . 4.5 109.637 169.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.95 20.7 0.06 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 125.944 1.698 . . . . 1.5 114.769 -171.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -66.63 -23.01 66.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 128.964 2.906 . . . . 1.45 116.2 -164.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.494 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 0.3 OUTLIER -76.42 -54.84 6.16 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.417 1.008 . . . . 1.49 109.608 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.4 tpp -47.7 -42.91 26.07 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 127.485 2.314 . . . . 1.79 113.797 162.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -109.22 34.72 3.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.729 1.212 . . . . 4.02 113.076 -175.262 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.4 p -62.88 -39.49 94.63 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 114.942 -1.026 . . . . 5.64 110.942 167.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -68.98 137.43 53.72 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.286 1.434 . . . . 4.68 112.991 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.8 m -69.35 -32.79 72.08 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.954 1.701 . . . . 2.33 112.327 175.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.85 -50.53 57.82 Favored Glycine 0 N--CA 1.47 0.922 0 CA-C-N 119.568 1.076 . . . . 1.56 111.963 178.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -59.4 -29.29 67.63 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.971 -0.723 . . . . 3.36 112.35 172.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -80.02 -31.85 39.59 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.679 0.992 . . . . 5.85 113.679 174.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 mmmt -60.67 -35.88 77.34 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 119.249 -2.157 . . . . 3.7 111.872 169.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.88 -29.89 56.73 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 117.25 -1.357 . . . . 1.04 114.076 167.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.65 -41.32 79.53 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 120.514 1.506 . . . . 0.79 113.157 167.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -63.38 -35.31 79.99 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 125.845 1.658 . . . . 3.46 112.606 -177.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -47.82 -43.04 27.64 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.628 1.171 . . . . 3.27 112.835 168.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.487 ' HB3' HD22 ' A' ' 82' ' ' LEU . 16.4 mt -70.12 -38.48 75.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.601 -1.182 . . . . 1.01 110.35 -174.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.3 mm -63.89 -42.12 94.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 122.988 0.515 . . . . 0.87 111.518 -176.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -72.13 -37.4 69.46 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 123.319 0.648 . . . . 1.97 111.583 176.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -67.16 -30.68 70.72 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.183 -0.948 . . . . 3.6 112.383 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.444 HD22 HD11 ' A' ' 82' ' ' LEU . 28.2 tp -69.14 -24.3 64.07 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 120.895 -1.128 . . . . 3.5 112.394 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.51 -25.96 28.7 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.143 1.777 . . . . 4.89 113.731 171.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -85.47 -4.43 59.16 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.817 1.414 . . . . 3.77 114.817 174.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -127.59 -30.22 2.58 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 114.372 1.249 . . . . 3.94 114.372 -171.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -90.97 57.97 3.65 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.943 1.297 . . . . 5.72 112.528 -163.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -87.47 84.23 7.18 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.361 1.065 . . . . 5.68 111.543 177.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 74.0 -28.6 0.95 Allowed Glycine 0 N--CA 1.476 1.309 0 C-N-CA 125.831 1.681 . . . . 4.14 115.863 167.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 -89.14 152.15 21.79 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 126.229 1.812 . . . . 7.45 110.329 169.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.4 mp -127.39 138.48 54.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 106.0 -1.852 . . . . 4.27 106.0 170.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.0 152.28 20.38 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.579 0.228 . . . . 2.25 111.219 173.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -61.62 -48.67 79.84 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 123.408 1.575 . . . . 2.13 109.558 167.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.2 -16.5 64.34 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.95 2.9 . . . . 2.9 114.308 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.2 tt0 -59.85 -55.04 39.07 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.444 1.498 . . . . 2.92 110.256 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -59.49 -38.3 80.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.367 -0.833 . . . . 2.45 111.813 177.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 22.2 t-105 -61.96 -49.98 73.94 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 118.818 -0.611 . . . . 0.57 111.084 177.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.3 t -71.63 -15.6 62.25 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 113.924 1.083 . . . . 1.87 113.924 176.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.487 HD22 ' HB3' ' A' ' 62' ' ' LEU . 89.3 mt -74.34 -47.53 33.81 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 120.009 1.277 . . . . 0.76 111.861 164.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.8 mm -51.31 -40.66 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-N 120.895 1.679 . . . . 0.78 113.77 -174.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.11 -22.62 60.81 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 118.767 0.712 . . . . 0.72 113.641 177.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.41 -16.76 80.43 Favored Glycine 0 CA--C 1.534 1.234 0 O-C-N 121.181 -1.187 . . . . 0.59 113.882 175.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.8 mp -95.62 -46.36 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 CA-C-N 118.382 1.091 . . . . 0.79 110.871 161.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 28.8 m -84.78 83.55 8.0 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 126.128 1.771 . . . . 1.27 108.54 -171.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -167.45 -64.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.961 0 C-N-CA 125.428 1.49 . . . . 1.17 111.932 -171.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -58.19 -53.17 4.5 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 123.2 2.6 . . . . 1.47 111.293 165.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.9 pt -61.22 -24.61 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 113.115 0.783 . . . . 1.85 113.115 174.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.39 -53.42 52.64 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.412 1.006 . . . . 1.0 112.389 -175.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -61.08 -34.17 74.51 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.621 -1.299 . . . . 2.99 112.662 175.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.6 tt -66.24 -44.47 83.67 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.211 1.004 . . . . 1.29 111.23 -178.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 56.0 mt -49.32 -59.91 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.63 0.772 . . . . 1.06 109.734 166.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -61.95 -28.52 69.6 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.014 -1.054 . . . . 1.94 113.409 -173.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.348 3.2 pt-20 -87.21 -11.43 49.84 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 121.277 -0.89 . . . . 3.14 113.095 175.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.448 ' C ' ' H ' ' A' ' 99' ' ' GLN . 0.6 OUTLIER -81.86 -40.73 22.02 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.433 1.893 . . . . 2.19 113.935 169.553 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -66.43 7.66 0.31 Allowed 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 123.501 1.62 . . . . 2.45 112.889 174.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.448 ' H ' ' C ' ' A' ' 97' ' ' GLN . 16.0 mm-40 -130.8 -64.94 0.81 Allowed 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 126.891 2.076 . . . . 1.89 109.704 -175.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 49.05 12.06 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 130.419 3.488 . . . . 4.6 116.162 171.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.0 t 179.75 31.72 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 128.116 2.566 . . . . 6.6 109.764 -168.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 23.3 p -95.02 24.72 4.64 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 119.82 -1.8 . . . . 8.57 112.255 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 41.3 m . . . . . 0 N--CA 1.479 0.989 1 C-N-CA 133.504 4.722 . . . . 10.19 107.905 -162.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 23.1 m . . . . . 0 CA--C 1.503 -0.83 0 N-CA-C 108.626 -0.879 . . . . 9.84 108.626 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -134.49 -16.13 2.1 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 124.824 1.327 . . . . 6.7 113.364 -134.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 93.6 m 66.42 19.61 10.94 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.769 2.028 . . . . 3.44 115.798 162.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 5.9 m-30 -46.93 124.34 6.18 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.562 1.145 . . . . 2.45 112.237 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 5.4 p -65.52 166.78 9.85 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 118.436 0.562 . . . . 1.16 111.878 -176.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -62.19 -37.9 87.07 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.379 -0.826 . . . . 2.93 111.957 173.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.38 -51.49 65.66 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.278 0.631 . . . . 1.06 109.724 173.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.79 -54.8 10.29 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.26 -0.274 . . . . 2.47 110.26 -169.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . 0.257 0.7 OUTLIER -60.49 -23.41 64.48 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 122.057 -0.402 . . . . 4.62 111.621 177.06 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.24 -25.03 61.47 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 119.34 -2.1 . . . . 1.05 114.324 169.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 34.3 t -61.58 -35.38 66.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 121.297 1.862 . . . . 1.05 110.879 170.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 71.2 mt -54.52 -55.8 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 121.383 -0.823 . . . . 1.08 110.713 165.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 78.9 t -56.26 -41.45 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.951 1.3 . . . . 0.84 112.474 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.71 -38.77 87.41 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.369 0.668 . . . . 1.19 112.287 176.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 71.7 t -71.39 -39.32 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.709 0.804 . . . . 0.91 111.494 177.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -51.04 -55.89 15.24 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.726 1.21 . . . . 2.71 109.605 171.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -50.52 -40.77 52.43 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.9 1.444 . . . . 3.35 114.9 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -66.44 -57.53 7.18 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.705 0.684 . . . . 2.39 111.79 178.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -66.05 -20.52 66.2 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.617 0.969 . . . . 1.84 113.617 -171.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -45.88 -32.68 2.77 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 120.216 1.371 . . . . 3.08 113.526 170.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -93.89 8.37 41.51 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.242 1.417 . . . . 2.14 113.916 -174.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.0 m -135.74 175.56 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.742 1.617 . . . . 2.29 110.033 169.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.48 -32.65 64.42 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 120.823 -1.173 . . . . 3.46 113.93 -175.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 171.08 -55.41 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 129.846 3.258 . . . . 4.9 109.945 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -118.73 3.76 11.63 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.728 1.211 . . . . 7.53 113.855 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 1.4 m -78.29 41.77 0.39 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 117.047 2.24 . . . . 4.28 117.047 -152.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.05 10.02 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 129.065 2.946 . . . . 8.65 115.806 176.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 15.0 t -143.64 137.98 25.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 128.111 2.565 . . . . 4.28 106.916 -179.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt 75.29 -44.04 0.52 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.931 2.492 . . . . 8.41 114.166 -178.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -68.14 -64.18 0.91 Allowed 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.674 0.67 . . . . 6.59 111.842 -167.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.27 108.6 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.15 1.78 . . . . 6.71 112.954 177.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 22.0 pt -59.9 145.41 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 108.441 -0.948 . . . . 2.76 108.441 169.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 30.3 t -73.18 138.14 45.49 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 117.637 -1.625 . . . . 2.91 111.209 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mtpt -63.94 -13.93 49.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.641 0.776 . . . . 3.33 112.934 167.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 97.2 p -77.38 -27.73 52.6 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.02 -1.05 . . . . 2.46 113.233 163.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.3 m -78.55 -39.56 37.44 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.937 1.244 . . . . 1.17 113.118 -173.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.444 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 64.5 t80 -55.51 -55.9 26.47 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 120.366 1.439 . . . . 2.26 111.727 -177.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -55.49 -19.45 9.71 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.402 1.481 . . . . 2.51 113.805 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . 0.404 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 23.4 mt-10 -100.36 -46.23 5.32 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 125.332 1.453 . . . . 3.25 112.496 -174.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -51.15 -41.95 60.47 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.944 1.297 . . . . 1.19 110.646 165.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.8 mt -59.82 -17.25 34.62 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 116.098 1.888 . . . . 1.08 116.098 168.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -114.77 -5.0 12.65 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 120.679 1.581 . . . . 2.67 113.955 174.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . 0.404 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 1.3 mppt? -107.18 -36.02 6.67 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.605 1.562 . . . . 3.02 113.23 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -87.92 -72.65 0.52 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.307 1.443 . . . . 4.35 108.617 163.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.58 22.65 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.794 2.038 . . . . 1.57 114.918 -171.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -66.11 -25.67 67.1 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.376 2.67 . . . . 1.54 116.622 -166.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . 0.549 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 0.6 OUTLIER -73.17 -55.87 5.87 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.936 1.244 . . . . 1.51 109.805 -177.639 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 27.2 tpp -47.77 -49.79 27.5 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.704 2.002 . . . . 1.99 112.891 163.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 1.4 mt -99.7 35.37 2.02 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.667 1.187 . . . . 4.02 113.147 -174.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 13.5 p -65.51 -36.77 84.82 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 114.785 -1.098 . . . . 5.36 111.183 167.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -71.89 135.7 46.64 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.102 1.361 . . . . 4.96 113.062 174.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 96.9 m -67.07 -33.15 74.88 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.877 1.671 . . . . 2.49 112.533 174.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -64.29 -52.56 42.84 Favored Glycine 0 N--CA 1.471 0.992 0 CA-C-N 119.98 1.264 . . . . 1.66 112.152 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -58.4 -29.87 66.39 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.013 0.925 . . . . 3.54 112.446 173.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 57.7 mtm-85 -78.64 -31.52 46.9 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.779 1.4 . . . . 6.06 114.779 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -60.93 -37.09 81.11 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 119.879 -1.763 . . . . 3.85 111.68 168.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -53.22 -32.14 46.75 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-O 117.581 -1.2 . . . . 1.06 113.795 168.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.6 -44.42 74.36 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.869 1.268 . . . . 0.98 113.152 169.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -62.96 -36.32 83.08 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.754 2.022 . . . . 3.59 112.842 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 34.9 mtmt -52.53 -36.21 55.05 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.916 -1.115 . . . . 2.96 112.336 171.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 9.8 mt -73.36 -36.14 66.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.949 -0.569 . . . . 1.04 111.247 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.0 mm -58.86 -44.8 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 123.797 0.839 . . . . 0.92 111.54 177.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -76.04 -33.11 59.62 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 123.168 0.587 . . . . 1.74 112.014 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -67.29 -32.4 73.36 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.341 -0.85 . . . . 3.52 112.364 170.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 22.2 tp -67.73 -23.85 65.31 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.014 -1.054 . . . . 3.38 112.123 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.2 -32.78 49.77 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.537 1.535 . . . . 5.03 113.843 170.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.09 -7.4 58.86 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.645 1.35 . . . . 3.76 114.645 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -127.31 -26.44 3.07 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 115.091 1.515 . . . . 3.7 115.091 -168.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 32.7 t60 -100.21 66.75 1.33 Allowed 'General case' 0 CA--C 1.548 0.889 0 O-C-N 120.885 -1.135 . . . . 5.29 112.817 -163.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -81.41 69.58 8.08 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 122.847 1.308 . . . . 5.85 111.898 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.96 -24.54 1.04 Allowed Glycine 0 CA--C 1.536 1.399 0 C-N-CA 125.858 1.694 . . . . 3.69 115.694 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 16.9 mmt85 -79.97 142.71 34.8 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.752 1.221 . . . . 7.29 110.494 169.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 3.4 mp -111.27 145.53 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 N-CA-C 106.547 -1.649 . . . . 4.57 106.547 165.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.79 150.74 25.28 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 122.907 0.483 . . . . 2.22 109.816 168.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -59.61 -49.6 77.13 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 123.569 1.652 . . . . 2.14 109.559 169.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.44 -16.91 26.73 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 129.821 3.248 . . . . 3.16 114.687 176.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -59.36 -57.51 12.67 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.243 1.417 . . . . 3.03 110.649 175.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -57.62 -40.2 78.61 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.444 -0.785 . . . . 2.37 112.331 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.9 t-105 -60.85 -51.47 69.16 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 118.229 -0.891 . . . . 0.67 111.351 174.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 7.1 t -69.43 -18.58 63.75 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.982 1.264 . . . . 1.65 113.701 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.444 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 97.3 mt -68.87 -51.27 42.12 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 120.092 1.314 . . . . 0.78 110.978 164.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 30.1 mm -52.0 -37.29 21.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 CA-C-N 121.035 1.743 . . . . 0.7 114.336 -173.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.33 -22.07 65.02 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 119.309 0.959 . . . . 0.67 114.238 175.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.79 -18.22 78.72 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 118.63 1.215 . . . . 0.7 113.527 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.2 mp -101.48 -41.54 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 118.385 1.093 . . . . 0.83 110.681 166.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 24.7 m -82.11 84.93 6.87 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.272 1.429 . . . . 1.37 108.84 -177.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -171.88 -66.17 0.04 OUTLIER Glycine 0 CA--C 1.528 0.896 0 CA-C-O 118.258 -1.301 . . . . 1.07 112.194 -170.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -58.36 -54.19 3.3 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.066 2.511 . . . . 1.39 110.95 167.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 35.5 pt -64.95 -21.04 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 113.387 0.884 . . . . 1.8 113.387 175.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.01 -55.91 24.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.493 1.042 . . . . 0.98 112.643 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -59.56 -34.21 72.4 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.518 -1.364 . . . . 3.12 112.558 175.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.3 tt -66.14 -43.58 86.66 Favored 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 124.126 0.97 . . . . 1.45 110.725 -177.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 48.4 mt -51.69 -58.26 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.97 0.908 . . . . 1.23 109.631 167.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . 0.422 ' CD2' ' HE2' ' A' ' 25' ' ' LYS . 80.7 t60 -70.79 -5.57 31.22 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 114.668 1.358 . . . . 1.83 114.668 -173.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.339 3.5 pt-20 -104.01 -15.06 15.71 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.954 1.302 . . . . 3.06 112.842 167.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . 0.462 ' C ' ' H ' ' B' ' 202' ' ' GLN . 0.2 OUTLIER -80.08 -39.55 29.43 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 126.434 1.894 . . . . 2.17 114.674 169.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -66.06 10.34 0.11 Allowed 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 121.411 1.914 . . . . 2.51 112.977 171.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' B' ' 200' ' ' GLN . 2.3 mm-40 -126.29 -76.51 0.58 Allowed 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 127.241 2.216 . . . . 1.89 109.149 -178.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.17 17.07 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 130.333 3.453 . . . . 4.17 116.72 169.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 41.9 t -173.43 26.58 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 127.142 2.177 . . . . 6.4 109.937 -168.096 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 94.2 p -114.45 10.34 16.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.126 1.37 . . . . 8.55 112.783 -177.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 49.9 m . . . . . 0 C--O 1.247 0.938 1 C-N-CA 132.667 4.387 . . . . 9.91 107.198 -167.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 CA--C 1.504 -0.799 0 N-CA-C 109.165 -0.68 . . . . 9.88 109.165 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -131.29 -14.62 3.34 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 118.914 -1.114 . . . . 6.71 113.525 -132.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.9 t 69.25 3.39 4.09 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.836 2.054 . . . . 4.79 115.88 164.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -35.25 106.71 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 126.198 1.799 . . . . 2.04 113.94 -174.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 81.8 p -68.2 153.88 42.84 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.871 0.469 . . . . 1.03 110.661 -175.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.446 ' HG2' HG21 ' B' ' 117' ' ' VAL . 6.2 tp10 -52.58 -38.46 60.05 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.776 0.83 . . . . 2.57 111.355 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.59 -42.77 99.77 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.362 1.865 . . . . 0.83 111.672 177.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.35 -50.69 13.61 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 118.69 0.677 . . . . 2.8 111.607 -177.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -49.68 -34.82 19.59 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.237 1.015 . . . . 6.06 111.17 165.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.745 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.38 -40.63 77.31 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 116.821 -1.561 . . . . 0.58 114.229 171.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.4 t -53.76 -47.32 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 CA-C-N 121.438 1.926 . . . . 0.99 110.077 169.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.2 mt -52.46 -51.53 32.84 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 CA-C-N 118.556 0.617 . . . . 0.75 111.505 172.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 16.9 t -60.21 -47.67 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.421 1.088 . . . . 0.53 112.195 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 mp -57.92 -45.85 85.9 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.417 1.087 . . . . 0.9 111.022 175.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.9 t -59.22 -54.13 38.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 126.072 1.749 . . . . 0.7 111.792 -178.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.7 tp10 -71.22 -32.95 69.43 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.11 1.323 . . . . 5.04 112.234 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -67.72 -17.64 64.63 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 120.214 1.37 . . . . 2.59 113.432 176.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -80.26 -56.68 4.04 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.321 -0.862 . . . . 2.02 111.65 161.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.435 ' HB3' ' CE1' ' B' ' 198' ' ' HIS . 21.2 m-85 -59.67 -34.28 72.65 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.246 -0.883 . . . . 2.02 113.059 -169.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -47.6 -39.34 16.57 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.672 1.578 . . . . 2.9 113.949 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.476 ' CE2' ' HG3' ' A' ' 41' ' ' MET . 90.9 m-85 -82.61 -19.69 37.86 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 120.747 -1.221 . . . . 2.37 113.562 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 1.5 t -77.38 -38.64 26.92 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.283 1.833 . . . . 3.4 110.97 168.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.4 p 146.57 -110.67 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.891 1 C-N-CA 132.29 4.236 . . . . 4.82 111.648 171.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.42 -10.51 0.36 Allowed 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 116.266 1.951 . . . . 8.09 116.266 -170.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -151.92 -6.94 0.23 Allowed 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 116.208 1.929 . . . . 7.75 116.208 179.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.5 t -163.38 143.17 8.65 Favored 'General case' 0 N--CA 1.477 0.917 0 O-C-N 118.936 -2.353 . . . . 4.64 112.211 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 91.7 mt -49.58 -31.44 10.56 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 127.937 2.495 . . . . 8.17 114.002 172.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.9 t -133.94 61.67 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-O 123.935 1.826 . . . . 4.37 110.041 -175.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.8 ttpp -111.71 -6.19 14.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.414 2.286 . . . . 8.51 113.315 168.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -170.08 -35.01 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 128.024 2.53 . . . . 7.01 110.783 -168.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 71.89 84.98 0.13 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.062 1.345 . . . . 7.37 111.529 163.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.0 tt -50.94 142.1 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.647 0.779 . . . . 3.75 110.539 175.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.9 m -113.61 138.27 50.41 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.12 -1.437 . . . . 3.28 107.12 168.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.503 ' HE2' ' OE2' ' A' ' 78' ' ' GLU . 15.2 mttp -76.64 -15.96 59.68 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.133 0.973 . . . . 3.38 110.633 -154.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.3 p -41.49 -27.86 0.11 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.238 1.815 . . . . 2.15 114.722 154.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.9 m -74.33 -44.27 53.14 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.19 0.996 . . . . 1.48 112.64 171.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -52.95 -50.47 63.97 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.152 1.381 . . . . 1.82 112.104 -172.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -54.35 -31.53 54.76 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.878 1.271 . . . . 3.31 113.397 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -95.56 -36.67 11.18 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 112.78 0.659 . . . . 4.11 112.78 -174.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . 0.476 ' HG3' ' CE2' ' A' ' 22' ' ' TYR . 11.8 tmm? -48.57 -47.77 39.36 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.487 0.715 . . . . 1.56 110.179 159.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.1 mt -54.48 -51.49 64.89 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.523 0.729 . . . . 1.05 112.685 173.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.41 -6.49 59.39 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.535 1.68 . . . . 3.0 115.535 -174.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.93 -37.33 9.44 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.63 1.172 . . . . 2.17 113.715 167.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -107.1 -21.85 12.84 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.006 1.322 . . . . 2.93 114.537 -167.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 64.3 mt -111.01 44.49 1.28 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.846 1.258 . . . . 2.38 109.843 162.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.6 p30 -66.76 -2.78 5.43 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 115.865 1.802 . . . . 1.53 115.865 -169.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.433 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -100.34 -48.77 4.47 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.648 1.979 . . . . 2.51 111.977 178.678 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 45.4 tpp -72.17 33.03 0.06 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.801 2.04 . . . . 2.3 112.816 175.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 tp -89.1 -36.05 15.95 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 127.014 2.126 . . . . 4.03 113.129 -157.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.96 28.13 17.09 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.733 0.813 . . . . 4.98 112.094 -175.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 23.5 t70 58.61 -77.53 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 129.043 2.937 . . . . 5.23 112.617 -170.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 50.9 m -132.26 -17.28 2.68 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 126.827 2.051 . . . . 2.29 111.334 -173.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -69.84 -65.37 2.58 Favored Glycine 0 N--CA 1.473 1.129 0 CA-C-N 120.566 1.53 . . . . 1.56 112.983 -170.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -59.7 -24.09 63.67 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.652 0.781 . . . . 3.78 112.83 172.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -79.89 -46.04 17.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.675 1.19 . . . . 5.02 113.736 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -58.28 -37.1 74.34 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.039 -1.663 . . . . 3.6 111.26 167.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.26 -46.17 79.78 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 117.45 -1.262 . . . . 1.81 112.0 168.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.34 -48.76 65.3 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.244 1.018 . . . . 0.79 112.386 170.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.37 -28.53 69.76 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 124.458 1.103 . . . . 2.59 113.319 -178.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.6 mtmt -59.24 -38.22 79.47 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 120.446 -1.409 . . . . 3.54 112.196 173.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 mt -66.05 -35.35 80.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.308 -0.86 . . . . 0.88 110.953 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 20.0 mm -67.1 -50.11 66.94 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.253 0 C-N-CA 123.938 0.895 . . . . 1.02 110.973 -177.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -67.41 -24.91 65.71 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.234 1.014 . . . . 3.37 112.363 -178.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -67.71 -49.61 61.8 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 124.328 1.051 . . . . 3.06 113.795 164.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.408 HD12 ' HE2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -97.73 -34.0 11.08 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 120.461 -1.4 . . . . 2.51 114.674 -163.792 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -65.39 -14.43 60.86 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 119.888 -1.758 . . . . 4.58 112.861 169.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.25 -16.65 52.03 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.533 1.308 . . . . 3.62 114.533 167.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -128.44 -4.04 5.44 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.726 1.75 . . . . 3.73 115.726 -167.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -137.54 118.94 14.72 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 120.376 -1.453 . . . . 4.19 109.854 172.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -94.24 -108.03 0.13 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.485 1.514 . . . . 4.04 113.33 -163.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -89.03 15.44 57.98 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 128.09 2.757 . . . . 3.86 113.342 176.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 79.4 mmt-85 -126.38 147.57 49.74 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.816 1.646 . . . . 4.97 109.311 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.0 mm -142.8 141.35 27.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 125.337 1.455 . . . . 2.53 108.453 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.4 t -94.4 156.38 16.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.393 0.542 . . . . 2.34 112.059 169.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -58.98 -40.39 84.7 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.796 0.808 . . . . 1.93 111.188 161.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -73.38 -16.6 61.34 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.385 1.074 . . . . 4.09 112.686 -172.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.503 ' OE2' ' HE2' ' A' ' 35' ' ' LYS . 25.6 mt-10 -60.75 -52.44 65.08 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.893 0.77 . . . . 3.09 111.374 175.059 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -54.13 -42.84 69.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 121.228 -0.92 . . . . 1.85 111.092 174.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -65.33 -52.34 54.58 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 118.292 -0.861 . . . . 0.67 112.475 -177.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.7 t -68.65 -26.82 65.52 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.572 1.078 . . . . 1.84 112.742 177.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.0 mt -68.57 -38.71 80.93 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 119.986 1.266 . . . . 0.79 111.357 173.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.4 mm -58.42 -38.88 72.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 120.469 1.486 . . . . 0.97 112.718 -178.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.42 -24.64 52.85 Favored Glycine 0 CA--C 1.54 1.594 0 CA-C-N 119.288 0.949 . . . . 0.9 113.405 174.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.68 -8.81 57.62 Favored Glycine 0 CA--C 1.534 1.266 0 O-C-N 121.131 -1.217 . . . . 0.78 114.12 173.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.2 mp -124.44 -41.6 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 118.878 1.339 . . . . 1.04 112.154 172.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 79.5 m -81.74 94.05 6.93 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.052 1.741 . . . . 1.35 108.361 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -177.37 -68.95 0.06 OUTLIER Glycine 0 CA--C 1.527 0.829 0 CA-C-O 118.606 -1.108 . . . . 1.08 112.253 -172.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.76 -43.73 30.07 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.71 2.273 . . . . 1.1 111.378 169.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 12.2 pt -75.64 -19.56 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 N-CA-C 113.569 0.952 . . . . 1.21 113.569 172.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.08 -54.67 43.2 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.717 1.144 . . . . 1.18 111.973 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.49 -42.68 78.7 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 118.23 -0.89 . . . . 2.82 112.673 169.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.9 tt -59.78 -42.15 92.69 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 118.891 0.769 . . . . 1.25 112.126 -176.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.2 mt -55.79 -56.9 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 124.109 0.964 . . . . 1.21 109.504 173.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.4 ' CE1' ' HB3' ' B' ' 123' ' ' TYR . 60.0 t60 -59.64 -36.29 76.08 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.82 1.248 . . . . 2.24 112.789 -177.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -88.47 -9.19 53.32 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.07 0.948 . . . . 3.15 113.282 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -87.9 -48.47 7.77 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 124.453 1.101 . . . . 2.93 113.802 169.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -57.52 -37.59 73.27 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.128 0.966 . . . . 2.53 111.99 -171.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -68.56 -53.05 25.38 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.471 1.108 . . . . 2.38 111.553 174.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -59.71 -0.87 0.21 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 127.462 2.305 . . . . 6.37 114.098 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.1 m -144.73 30.2 1.21 Allowed 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.26 -1.525 . . . . 6.66 112.487 163.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 39.1 m -75.13 -6.3 48.83 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.933 -1.104 . . . . 10.02 113.316 168.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 C--O 1.247 0.932 0 C-N-CA 129.582 3.153 . . . . 11.52 109.313 -174.565 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 24.1 m . . . . . 0 CA--C 1.504 -0.816 0 N-CA-C 108.982 -0.748 . . . . 9.51 108.982 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -135.8 -10.1 2.08 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.821 1.045 . . . . 6.21 113.821 -132.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 8.6 t 78.45 -7.7 1.76 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 128.139 2.575 . . . . 6.1 114.799 169.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -35.25 106.4 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 126.881 2.072 . . . . 2.12 113.111 -175.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 82.2 p -74.08 157.47 36.01 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 122.831 0.453 . . . . 1.14 109.797 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -63.6 -23.34 67.34 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.656 -0.653 . . . . 2.65 111.962 176.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.4 -41.11 98.41 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.369 0.668 . . . . 0.75 110.053 170.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.76 -51.02 12.16 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.759 0.651 . . . . 3.03 112.759 -177.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -34.31 -50.26 0.41 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.774 1.23 . . . . 4.24 111.899 159.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.745 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.04 -41.85 85.84 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 116.488 -1.72 . . . . 0.74 113.959 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 15.6 t -53.83 -47.37 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-N 122.138 2.245 . . . . 1.01 110.788 168.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 16.6 mt -55.01 -49.19 73.62 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 119.454 1.025 . . . . 0.85 111.224 173.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.446 HG21 ' HG2' ' A' ' 7' ' ' GLU . 23.2 t -65.62 -42.14 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.958 1.303 . . . . 0.58 112.389 -176.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.6 mp -60.55 -42.44 96.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.615 1.166 . . . . 0.98 111.153 172.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 18.0 t -65.06 -54.13 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.113 1.365 . . . . 0.68 112.807 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 34.7 tp10 -69.69 -34.35 73.8 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 121.016 1.735 . . . . 4.75 111.874 176.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -68.73 -19.34 64.34 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.885 1.22 . . . . 2.58 113.481 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -72.65 -65.97 0.72 Allowed 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.452 -0.78 . . . . 2.05 110.985 158.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . 0.4 ' HB3' ' CE1' ' A' ' 95' ' ' HIS . 32.6 m-85 -56.35 -34.07 66.27 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 117.802 -1.094 . . . . 2.1 113.777 -167.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 13.5 ptmt -46.78 -38.06 9.54 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 121.392 1.905 . . . . 2.74 114.034 175.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . 0.535 ' CE2' ' HG3' ' B' ' 144' ' ' MET . 91.3 m-85 -82.89 -10.01 59.03 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 120.359 -1.463 . . . . 2.25 114.145 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 2.3 t -101.73 -30.87 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 127.057 2.143 . . . . 3.28 111.459 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 79.4 p 147.02 -110.5 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.873 1 C-N-CA 132.327 4.251 . . . . 4.76 111.913 163.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.87 -12.92 0.19 Allowed 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 116.057 1.873 . . . . 8.11 116.057 -168.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -151.65 -4.61 0.27 Allowed 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 116.157 1.91 . . . . 7.75 116.157 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 25.1 t -162.7 148.97 12.62 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 118.996 -2.315 . . . . 4.73 112.464 177.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.53 -26.62 68.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.932 1.693 . . . . 8.26 114.113 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 4.5 t -132.2 61.53 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 CA-C-O 123.749 1.738 . . . . 4.3 109.944 -177.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 4.6 ttpp -112.49 -5.2 14.07 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.947 2.099 . . . . 8.39 113.283 171.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -172.54 -35.78 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 127.58 2.352 . . . . 7.21 110.198 -165.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 71.48 83.84 0.14 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.978 1.311 . . . . 7.37 110.715 164.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 8.2 tt -51.45 144.77 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 123.316 0.646 . . . . 3.57 109.952 173.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 58.6 m -117.84 144.31 45.51 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 121.011 -1.055 . . . . 3.2 108.26 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . 0.453 ' HE2' ' OE1' ' B' ' 181' ' ' GLU . 17.2 mttp -73.1 -16.71 61.46 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 121.331 -0.856 . . . . 2.94 112.183 -154.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.1 p -48.85 -29.5 4.71 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 126.652 1.981 . . . . 2.0 114.048 161.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 46.7 m -68.59 -46.9 68.11 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 119.745 1.157 . . . . 1.31 112.577 171.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -55.93 -53.85 51.86 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 120.196 1.362 . . . . 1.92 112.245 -170.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -50.17 -29.56 9.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.285 1.034 . . . . 3.24 113.19 175.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -94.89 -36.2 11.72 Favored 'General case' 0 C--O 1.224 -0.24 0 N-CA-C 114.505 1.298 . . . . 3.6 114.505 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . 0.535 ' HG3' ' CE2' ' B' ' 125' ' ' TYR . 4.6 tmm? -53.37 -44.77 68.84 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 118.942 -0.551 . . . . 1.2 110.43 163.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 43.1 mt -53.21 -49.11 67.44 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.92 0.782 . . . . 1.18 112.155 170.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.0 -8.13 59.65 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 115.012 1.486 . . . . 2.67 115.012 -172.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.37 -40.64 7.0 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.852 1.261 . . . . 1.85 113.859 167.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -101.35 -28.74 12.43 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.382 1.473 . . . . 2.76 113.209 -165.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 46.3 mt -108.41 40.5 1.76 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.323 1.449 . . . . 2.64 111.022 166.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -62.0 -20.17 63.61 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.597 1.703 . . . . 1.35 115.597 -169.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . 0.584 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 0.0 OUTLIER -80.83 -59.94 2.49 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.165 1.386 . . . . 1.92 111.916 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 42.7 tpp -58.64 -15.63 12.5 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 126.055 1.742 . . . . 2.0 115.524 173.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 50.9 tp -51.08 -29.87 14.3 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.634 2.774 . . . . 4.24 115.779 -171.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 21.7 m 60.08 29.67 19.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.622 1.169 . . . . 4.69 112.823 -174.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 12.0 t70 42.64 -97.53 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.352 1.861 . . . . 6.18 111.71 -163.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 30.4 m -93.89 -25.3 17.37 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.106 1.362 . . . . 2.56 112.164 -168.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -67.13 -68.44 1.66 Allowed Glycine 0 N--CA 1.477 1.383 0 CA-C-N 120.712 1.596 . . . . 1.59 113.305 -167.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -60.53 -21.87 62.97 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.094 0.958 . . . . 3.57 112.759 173.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' B' ' 162' ' ' ALA . 1.1 ttt-85 -82.41 -37.83 24.94 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.326 1.45 . . . . 4.94 114.509 -178.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 18.2 mmmt -63.56 -37.54 87.71 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 119.981 -1.699 . . . . 4.65 111.387 165.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -55.03 -43.54 73.81 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-O 117.192 -1.385 . . . . 1.8 111.646 168.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' B' ' 159' ' ' ARG . . . -52.53 -52.57 54.05 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.46 1.104 . . . . 0.95 111.926 170.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -56.78 -37.18 70.74 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.865 1.266 . . . . 2.58 113.212 -178.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 34.7 mtmt -57.79 -38.36 75.37 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 121.167 -0.958 . . . . 3.59 112.753 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 10.2 mt -66.27 -42.42 88.47 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.037 -0.983 . . . . 0.95 110.619 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 17.3 mm -56.13 -56.09 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.464 1.106 . . . . 0.74 109.925 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -68.01 -27.56 66.67 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.201 0.815 . . . . 2.53 113.201 -175.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.08 -42.98 99.75 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.253 1.021 . . . . 2.73 113.472 167.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.46 -26.88 16.29 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.045 -1.034 . . . . 3.01 112.605 -169.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.17 -12.26 54.8 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.137 -1.602 . . . . 3.48 113.714 172.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.08 -11.79 60.0 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.942 1.09 . . . . 2.17 113.942 164.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -128.02 -15.55 4.76 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.502 1.667 . . . . 2.59 115.502 -166.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -143.18 125.81 15.91 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 120.448 1.476 . . . . 4.16 110.418 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' B' ' 175' ' ' GLY . 12.2 p-10 -114.6 -108.06 0.37 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 125.358 1.463 . . . . 3.77 112.835 -167.104 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . 0.423 ' H ' ' CG ' ' B' ' 174' ' ' ASP . . . -77.57 15.18 7.87 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 127.126 2.298 . . . . 3.58 114.196 173.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -131.57 150.24 52.22 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.412 1.885 . . . . 4.99 110.039 170.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 35.2 mm -143.8 139.61 25.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.975 0 C-N-CA 126.802 2.041 . . . . 2.62 107.622 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 25.2 t -92.33 151.4 20.31 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.133 0.424 . . . . 2.31 110.447 167.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -50.14 -41.37 48.78 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.403 0.621 . . . . 1.93 111.169 164.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -71.65 -12.89 61.56 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.5 0.926 . . . . 4.22 113.5 -173.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . 0.453 ' OE1' ' HE2' ' B' ' 138' ' ' LYS . 14.6 mt-10 -60.13 -51.63 68.77 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.655 1.116 . . . . 2.79 111.385 177.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -56.64 -43.58 80.42 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.134 -0.979 . . . . 2.04 111.89 174.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 24.2 t-105 -62.87 -57.38 11.02 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 118.837 -0.602 . . . . 0.63 111.875 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.7 t -65.09 -28.71 69.64 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 117.923 -1.037 . . . . 1.63 112.73 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 77.2 mt -71.54 -35.57 70.7 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.854 1.206 . . . . 0.77 112.975 173.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 7.0 mm -54.98 -39.2 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 CA-C-N 121.242 1.837 . . . . 0.8 112.292 177.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.07 -28.83 71.19 Favored Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.067 0.841 . . . . 0.73 113.317 176.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -67.98 -14.23 65.42 Favored Glycine 0 CA--C 1.533 1.164 0 O-C-N 121.03 -1.277 . . . . 0.82 113.461 175.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.7 mp -109.3 -32.52 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 118.465 1.133 . . . . 1.07 112.313 166.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 18.6 m -91.88 97.24 10.85 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.379 1.871 . . . . 1.5 110.05 -175.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -177.06 -64.77 0.06 OUTLIER Glycine 0 CA--C 1.529 0.938 0 C-N-CA 124.868 1.223 . . . . 1.05 111.968 -172.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -62.33 -47.86 8.98 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.627 2.218 . . . . 1.17 110.762 167.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 13.5 pt -67.93 -25.15 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 N-CA-C 112.966 0.728 . . . . 1.4 112.966 172.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.24 -58.95 6.18 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.836 1.198 . . . . 1.05 111.939 -178.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -38.99 74.21 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 118.378 -0.82 . . . . 2.91 112.549 173.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.1 tt -61.89 -41.97 98.52 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 118.511 -0.757 . . . . 1.5 112.019 -177.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 32.8 mt -55.59 -56.17 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 119.478 1.035 . . . . 1.27 109.639 173.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . 0.435 ' CE1' ' HB3' ' A' ' 20' ' ' TYR . 62.1 t60 -59.46 -36.13 75.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.275 1.03 . . . . 2.38 112.555 -176.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -90.51 -8.94 49.04 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.249 0.833 . . . . 3.36 113.249 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -88.16 -49.02 7.28 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.434 1.094 . . . . 3.0 113.792 169.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -58.82 -33.85 70.85 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.05 0.929 . . . . 2.66 112.144 -170.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -72.77 -52.82 13.48 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.675 1.19 . . . . 2.39 111.388 175.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -60.16 -0.29 0.22 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.212 2.205 . . . . 6.83 113.837 177.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 69.7 m -145.13 31.05 1.13 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.394 -1.441 . . . . 6.41 112.369 163.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 16.8 m -76.36 -3.67 38.15 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.809 -1.182 . . . . 9.76 112.973 168.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 74.6 m . . . . . 0 C--O 1.249 1.043 0 C-N-CA 129.347 3.059 . . . . 11.32 109.641 -175.684 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.5 m . . . . . 0 CA--C 1.502 -0.902 0 N-CA-C 108.773 -0.825 . . . . 10.4 108.773 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -133.32 -14.93 2.55 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 118.539 -1.264 . . . . 6.98 113.889 -134.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 87.5 m 61.97 -82.2 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.235 2.214 . . . . 3.3 113.061 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.418 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 3.6 m-30 59.43 104.77 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.674 2.39 . . . . 2.37 110.279 -159.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.3 p -71.82 155.52 40.33 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 119.186 0.903 . . . . 1.21 110.703 -176.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -61.29 -24.33 66.33 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 114.276 1.213 . . . . 2.76 114.276 -171.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -48.86 79.41 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 119.7 1.137 . . . . 1.03 110.643 170.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.24 -46.84 69.39 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.381 1.472 . . . . 2.89 112.025 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.4 mmtt -52.17 -42.09 63.14 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.973 -1.08 . . . . 6.18 111.495 169.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.42 -39.46 77.87 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 117.098 -1.43 . . . . 0.67 112.064 177.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.2 t -54.6 -40.09 48.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 121.503 1.956 . . . . 1.1 110.458 167.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.1 mt -59.67 -55.67 22.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 CA-C-N 120.07 1.304 . . . . 0.89 111.809 170.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.9 t -58.11 -39.28 72.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 125.467 1.507 . . . . 0.61 112.976 -177.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -70.48 -41.7 72.37 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.518 1.127 . . . . 0.95 112.098 176.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 70.6 t -71.03 -35.88 61.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 123.826 0.85 . . . . 0.6 111.396 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -62.32 -46.29 89.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.115 0.966 . . . . 2.7 110.848 168.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -55.11 -31.78 61.5 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.827 1.418 . . . . 2.08 114.827 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -78.24 -62.23 1.75 Allowed 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.645 -0.659 . . . . 2.12 111.607 171.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -64.6 -26.57 68.46 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 118.288 -0.863 . . . . 1.92 113.094 -169.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.0 -20.05 8.28 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 120.502 1.501 . . . . 2.5 114.146 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -90.41 0.22 57.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.142 1.377 . . . . 2.53 114.584 176.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.0 m -138.29 170.81 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 125.592 1.557 . . . . 2.37 111.007 178.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.33 -36.72 77.22 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.397 1.258 . . . . 3.33 114.397 -177.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt 150.37 -76.64 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 130.921 3.688 . . . . 5.87 110.45 -166.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -124.7 -0.35 8.04 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.133 1.531 . . . . 8.38 115.133 -171.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.6 m -61.67 -1.3 0.56 Allowed 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 116.634 2.087 . . . . 5.08 116.634 -173.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 84.7 mt -50.77 -28.34 9.05 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 127.936 2.494 . . . . 7.62 116.051 -156.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.06 -47.18 94.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 119.218 0.917 . . . . 5.23 110.745 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 mtpp -87.58 -53.16 4.94 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.17 0.988 . . . . 8.55 111.737 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -122.05 127.83 50.68 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.579 0.752 . . . . 7.41 111.581 -164.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.49 172.86 14.83 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.908 1.683 . . . . 7.34 111.451 -173.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.5 pt -82.21 173.78 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 123.979 0.912 . . . . 2.89 111.85 166.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.2 t -77.61 149.39 34.78 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.693 0.759 . . . . 3.06 111.533 168.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -56.1 -23.0 31.38 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 120.607 -1.308 . . . . 2.24 111.624 164.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.8 p -80.8 -9.42 59.81 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.009 -1.682 . . . . 1.69 115.388 170.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.8 m -83.36 -33.98 25.71 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.042 1.292 . . . . 1.25 112.24 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.451 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 23.8 t80 -45.49 -60.25 2.27 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.865 1.266 . . . . 2.05 110.934 176.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.7 ptt180 -58.1 -24.25 57.92 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.692 1.597 . . . . 2.33 113.229 -178.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -94.5 -40.39 9.91 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 126.154 1.782 . . . . 3.29 111.842 -172.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 5.7 tmm? -55.06 -40.44 70.32 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 120.298 -1.501 . . . . 1.24 111.811 163.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.428 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 81.8 mt -68.87 6.06 0.98 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 127.94 2.496 . . . . 1.73 114.972 169.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -115.58 -13.5 11.52 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.207 1.803 . . . . 2.69 113.607 165.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.55 -37.57 9.11 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.847 1.425 . . . . 1.75 114.847 178.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -82.9 -56.29 3.91 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 118.591 0.632 . . . . 4.58 109.77 164.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.95 75.06 4.49 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.482 -0.762 . . . . 2.12 109.704 171.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -121.82 -2.92 9.23 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.216 1.807 . . . . 2.19 113.965 -174.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -118.11 -28.01 5.96 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.114 -0.991 . . . . 1.78 112.027 176.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 36.9 tpp -65.49 -12.91 57.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.608 1.963 . . . . 1.93 112.443 163.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.3 pp -151.5 175.39 12.35 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.555 1.542 . . . . 3.59 112.841 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.0 m 156.06 -37.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 130.903 3.681 . . . . 7.46 107.922 -164.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -55.27 132.33 47.59 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.197 0.999 . . . . 4.25 110.505 156.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 50.3 m -80.73 -25.81 37.81 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 125.221 1.408 . . . . 2.47 111.274 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.16 -48.12 87.49 Favored Glycine 0 N--CA 1.472 1.098 0 C-N-CA 124.738 1.161 . . . . 1.67 111.82 177.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -46.52 -55.73 7.08 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.918 1.687 . . . . 3.35 112.173 166.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -60.59 -29.08 68.98 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.536 -0.727 . . . . 6.81 112.669 -177.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 mmmt -59.98 -37.73 80.47 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.613 -1.304 . . . . 4.34 113.213 174.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.82 -19.48 62.6 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.4 1.259 . . . . 1.02 114.4 172.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.2 -43.25 19.56 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.669 1.122 . . . . 0.66 111.42 164.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -60.96 -43.08 99.23 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 113.375 0.88 . . . . 2.23 113.375 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -56.4 -27.61 56.88 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.076 0.951 . . . . 2.69 112.715 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 24.3 mt -77.01 -35.22 57.26 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 121.809 -0.557 . . . . 0.78 111.763 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.6 mm -55.28 -40.81 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 124.244 1.018 . . . . 0.94 110.89 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -73.42 -35.14 65.78 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.462 0.912 . . . . 2.98 113.462 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -60.78 -28.05 68.45 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.782 0.833 . . . . 3.2 111.914 170.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.4 HD23 HD21 ' A' ' 82' ' ' LEU . 0.3 OUTLIER -85.74 -32.32 21.94 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.904 2.082 . . . . 2.01 111.832 174.14 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -67.46 -22.24 65.5 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.114 1.366 . . . . 3.81 113.972 172.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.4 -15.5 49.33 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.408 1.262 . . . . 2.48 114.408 169.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -151.37 -31.4 0.16 Allowed 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 118.048 2.61 . . . . 3.96 118.048 -170.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -90.37 100.95 13.69 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 121.427 1.921 . . . . 3.44 111.385 -177.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -65.76 -5.23 8.14 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 116.635 2.087 . . . . 3.93 116.635 -173.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.34 7.71 8.16 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.629 1.109 . . . . 2.51 115.179 -169.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 41.4 mmt-85 -75.28 -179.89 4.73 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.714 1.757 . . . . 4.63 109.71 149.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.5 mm -136.34 137.28 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 N-CA-C 106.672 -1.603 . . . . 2.07 106.672 166.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.3 m -96.41 146.7 24.54 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.144 0.884 . . . . 2.11 110.175 167.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -64.39 -51.34 63.71 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.729 0.641 . . . . 2.54 112.729 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -70.55 -20.67 62.78 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.702 1.201 . . . . 4.68 112.953 -177.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -63.78 -35.86 82.0 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 121.34 -0.85 . . . . 5.23 110.834 173.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -53.85 -52.13 61.39 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.213 -1.555 . . . . 1.72 110.749 170.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 -65.29 -45.82 82.88 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.865 0.866 . . . . 0.71 111.465 -175.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 99.5 m -57.83 -46.25 85.01 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 127.102 2.161 . . . . 2.4 111.287 177.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.451 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 85.1 mt -60.94 -26.52 67.56 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 118.196 -0.907 . . . . 0.75 113.06 174.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 35.9 mm -61.37 -32.69 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 CA-C-N 121.603 2.001 . . . . 0.99 112.445 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.59 -28.07 67.16 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 124.572 1.082 . . . . 0.72 112.939 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -72.79 -19.98 79.57 Favored Glycine 0 CA--C 1.533 1.192 0 O-C-N 121.373 -1.075 . . . . 0.62 114.301 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.9 mp -97.47 -35.25 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 CA-C-N 118.451 1.125 . . . . 0.78 110.281 166.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.4 m -82.83 56.64 3.49 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.688 1.995 . . . . 1.37 110.666 -175.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -131.98 -71.6 0.1 OUTLIER Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.341 1.924 . . . . 1.33 111.497 175.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -63.94 -56.04 0.55 Allowed 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.302 2.668 . . . . 1.62 111.872 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.3 pt -65.31 -27.16 41.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 N-CA-C 112.966 0.728 . . . . 1.8 112.966 173.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.32 -35.81 78.35 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.429 1.013 . . . . 1.29 113.458 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.4 ptpt -69.25 -32.41 71.6 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.379 -1.451 . . . . 3.22 113.478 166.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.96 -37.43 85.97 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 120.457 1.48 . . . . 1.49 112.031 176.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -47.04 -59.95 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-N 119.785 1.175 . . . . 1.12 109.411 162.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.418 ' NE2' ' HE3' ' B' ' 128' ' ' LYS . 30.0 t60 -64.72 -19.05 65.55 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.692 1.367 . . . . 2.31 114.692 -175.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -74.6 -47.36 32.82 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.307 -0.871 . . . . 3.17 112.372 162.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -69.21 -40.01 78.27 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 117.424 -1.274 . . . . 2.31 114.065 -172.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -60.37 -17.21 42.04 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 120.023 1.283 . . . . 2.74 112.227 173.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -92.11 -47.53 7.2 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.448 -1.407 . . . . 3.11 110.919 172.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -67.99 1.91 2.4 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.335 1.854 . . . . 5.16 113.097 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 52.0 m -143.72 35.64 1.28 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.829 1.652 . . . . 7.14 111.655 161.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.5 m -71.65 -1.53 14.04 Favored 'General case' 0 N--CA 1.483 1.177 0 O-C-N 120.594 -1.316 . . . . 9.67 113.811 168.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 58.5 m . . . . . 0 C--O 1.25 1.121 0 C-N-CA 129.595 3.158 . . . . 11.63 110.533 -176.185 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 CA--C 1.502 -0.894 0 N-CA-C 108.824 -0.806 . . . . 10.73 108.824 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -135.43 -17.91 1.74 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.656 1.222 . . . . 7.53 113.162 -135.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 85.5 m 59.63 -75.35 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 128.003 2.521 . . . . 3.42 114.489 172.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 56.54 106.74 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 128.175 2.59 . . . . 2.87 111.816 -154.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.36 166.44 14.46 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 119.126 0.876 . . . . 1.0 111.124 -177.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.87 -24.04 66.67 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 118.977 0.808 . . . . 2.9 113.155 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.37 -43.67 98.27 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.921 1.237 . . . . 0.86 110.036 172.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -71.34 -43.83 66.26 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.742 0.817 . . . . 3.19 112.004 175.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 44.7 mmtt -53.52 -42.27 67.22 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.798 1.181 . . . . 6.25 111.101 170.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.42 -45.41 69.25 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 124.331 1.052 . . . . 0.64 111.977 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 70.9 t -56.33 -38.83 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 120.428 1.467 . . . . 0.79 110.031 170.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 76.9 mt -59.29 -56.1 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-O 117.694 -1.146 . . . . 0.93 111.378 168.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 t -58.21 -35.36 52.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 126.048 1.739 . . . . 0.7 113.46 -177.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.42 -46.96 62.9 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.503 1.121 . . . . 0.97 111.227 174.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 68.0 t -69.13 -34.68 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.976 0.91 . . . . 0.61 111.316 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -67.98 -44.55 76.42 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.39 1.476 . . . . 2.67 110.445 170.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -55.63 -34.12 64.62 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 120.977 1.717 . . . . 2.1 113.952 175.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -73.31 -64.93 0.88 Allowed 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.885 -0.51 . . . . 1.99 111.405 170.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . 0.406 ' HB3' ' CE1' ' A' ' 95' ' ' HIS . 47.4 m-85 -64.93 -28.89 69.83 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.66 0.985 . . . . 1.86 113.66 -169.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -19.97 16.56 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 120.856 1.662 . . . . 2.65 113.834 177.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -89.94 -0.23 57.45 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.207 1.403 . . . . 2.13 114.17 176.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 33.6 m -136.66 172.77 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 125.295 1.438 . . . . 2.41 110.763 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.3 m -68.55 -38.19 80.59 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.292 1.219 . . . . 3.47 114.292 -178.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.446 ' HG2' ' CD2' ' B' ' 129' ' ' TYR . 8.4 ttmt 150.58 -76.21 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 130.845 3.658 . . . . 5.96 110.526 -164.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . 0.446 ' CD2' ' HG2' ' B' ' 128' ' ' LYS . 25.3 m-85 -127.64 3.17 6.13 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 115.329 1.603 . . . . 8.68 115.329 -173.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 10.9 m -61.81 0.04 0.41 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 116.551 2.056 . . . . 5.04 116.551 -175.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 80.6 mt -50.69 -28.17 8.47 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 128.321 2.648 . . . . 7.58 116.032 -157.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 24.3 t -62.51 -47.47 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 O-C-N 121.287 -0.883 . . . . 5.1 110.888 175.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp -87.9 -49.13 7.28 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.229 1.012 . . . . 8.45 112.341 178.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -126.03 129.95 50.2 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.485 0.714 . . . . 7.48 111.515 -164.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.36 171.57 11.9 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.098 1.759 . . . . 7.27 111.916 -172.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 23.9 pt -80.21 179.45 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.604 1.162 . . . . 2.95 112.583 166.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 42.1 t -83.04 148.92 27.25 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.369 -0.832 . . . . 2.91 111.233 171.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 18.0 ttpt -56.18 -20.3 17.31 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.734 -1.229 . . . . 2.43 112.14 163.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 76.0 p -83.04 -8.32 59.56 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 115.674 1.731 . . . . 1.67 115.674 169.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 67.4 m -76.71 -42.09 42.75 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.444 1.474 . . . . 1.16 112.692 -176.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -50.86 -54.79 20.89 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.443 1.019 . . . . 1.93 112.88 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 25.4 ptt180 -54.38 -26.26 29.21 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.292 1.037 . . . . 2.58 113.517 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -95.75 -42.37 8.4 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 126.231 1.813 . . . . 3.15 112.238 -174.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.9 tmm? -53.72 -40.06 65.78 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.852 -1.155 . . . . 1.13 111.917 163.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.71 -21.36 54.72 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.688 1.366 . . . . 1.02 114.688 168.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -97.24 -5.37 37.0 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.418 1.487 . . . . 2.61 112.386 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.85 -33.12 8.99 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.78 1.4 . . . . 1.55 114.78 168.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -89.09 -63.87 1.23 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.904 0.881 . . . . 4.03 111.521 175.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.35 35.98 0.15 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.045 1.338 . . . . 1.98 112.514 174.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -80.26 3.75 19.88 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.655 2.382 . . . . 1.9 114.43 -171.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . 0.418 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 17.3 m-70 -117.05 -26.12 6.95 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 118.826 0.739 . . . . 1.66 111.611 173.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 42.5 tpp -68.43 -26.99 65.8 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.21 2.204 . . . . 2.13 112.406 165.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 1.8 pp -123.98 167.25 14.4 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.849 1.66 . . . . 3.34 111.131 167.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 21.8 m -167.8 -54.58 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.299 1.84 . . . . 6.41 107.479 175.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -63.82 143.93 57.46 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.636 0.732 . . . . 4.26 109.678 160.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 5.9 m -65.58 -23.72 66.91 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.602 1.161 . . . . 4.2 111.08 172.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.36 -28.39 50.26 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.292 1.425 . . . . 2.31 114.793 -178.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -71.25 -61.86 1.61 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 118.133 0.967 . . . . 3.09 109.142 168.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.6 ttp-105 -48.56 -21.4 0.57 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.501 1.92 . . . . 4.67 116.137 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -45.68 -38.35 6.73 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.635 1.107 . . . . 3.63 113.224 164.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -70.94 -18.38 62.64 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 115.286 1.587 . . . . 1.04 115.286 174.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.46 -46.93 12.83 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 120.041 1.291 . . . . 0.74 109.926 165.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -57.32 -41.96 80.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.544 1.538 . . . . 1.98 112.539 -177.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -58.43 -28.33 65.15 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.445 1.276 . . . . 2.83 114.445 174.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 52.5 mt -76.98 -35.87 56.86 Favored 'General case' 0 C--O 1.222 -0.388 0 O-C-N 121.908 -0.495 . . . . 0.85 110.773 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 14.7 mm -55.38 -40.36 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.607 0.763 . . . . 0.9 110.64 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -71.35 -34.76 70.78 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.583 0.957 . . . . 3.14 113.583 176.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -64.15 -31.18 72.28 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.973 0.909 . . . . 3.23 111.712 171.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.56 -36.28 57.72 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.123 2.169 . . . . 2.1 111.56 172.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -70.3 -22.19 62.86 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.631 1.172 . . . . 3.82 113.556 177.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -63.61 -13.36 41.41 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.573 1.323 . . . . 2.29 114.573 169.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -149.36 -34.07 0.19 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 118.169 2.655 . . . . 3.92 118.169 -171.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -88.44 98.21 11.5 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 121.229 1.831 . . . . 3.33 111.326 -175.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -64.83 -4.21 4.17 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 116.994 2.22 . . . . 3.88 116.994 -172.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 120.41 5.67 10.18 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.679 -1.067 . . . . 2.44 115.044 -167.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 37.7 mmt-85 -75.94 176.14 8.16 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.829 1.815 . . . . 4.68 109.848 150.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 32.7 mm -135.3 136.63 51.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 N-CA-C 106.832 -1.544 . . . . 2.22 106.832 167.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 23.8 m -95.21 147.55 23.35 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.837 0.744 . . . . 2.15 110.28 168.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -61.87 -51.63 67.41 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.513 0.673 . . . . 2.5 112.384 177.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -70.36 -16.02 62.93 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.562 1.545 . . . . 4.57 112.777 -176.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -68.32 -38.02 81.16 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.085 -1.01 . . . . 4.82 111.319 174.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -56.16 -45.43 79.68 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 119.963 -1.711 . . . . 1.82 111.826 170.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.9 t-105 -68.09 -45.27 74.22 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.309 0.644 . . . . 0.72 112.062 -177.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 87.2 m -58.25 -48.23 81.08 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.702 2.001 . . . . 2.22 110.783 175.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 84.0 mt -61.25 -27.65 68.6 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.394 0.887 . . . . 0.56 113.394 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 23.7 mm -62.12 -39.88 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.175 0 CA-C-N 120.851 1.659 . . . . 0.65 111.604 176.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -59.34 -30.65 68.21 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.645 1.117 . . . . 0.59 113.012 175.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -69.12 -20.09 74.54 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-O 118.836 -0.98 . . . . 0.58 114.297 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.5 mp -98.27 -36.53 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 119.17 1.485 . . . . 0.79 110.912 163.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 17.4 m -81.54 64.92 6.46 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.973 2.109 . . . . 1.4 110.203 -173.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -137.66 -72.5 0.06 OUTLIER Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.403 1.478 . . . . 0.93 111.649 178.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -65.43 -47.74 3.99 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.049 2.5 . . . . 1.18 111.563 177.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 10.0 pt -66.99 -25.42 34.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 112.814 0.672 . . . . 1.23 112.814 174.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.76 -38.2 79.91 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.32 -0.863 . . . . 0.9 112.692 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.7 ptpt -65.78 -34.23 77.69 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 117.54 -1.219 . . . . 3.39 112.922 165.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.2 tt -65.82 -39.43 90.84 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 121.206 1.821 . . . . 1.61 111.872 177.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 96.3 mt -48.59 -59.28 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 CA-C-N 119.773 1.17 . . . . 1.09 109.655 163.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 21.5 t60 -63.86 -22.37 66.89 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.661 1.356 . . . . 2.21 114.661 -175.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -71.06 -46.29 62.21 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.385 1.074 . . . . 3.16 112.106 164.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 25.2 mm100 -68.6 -41.99 78.8 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 117.64 -1.171 . . . . 2.47 113.731 -173.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.25 -18.73 28.69 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.616 1.098 . . . . 2.7 112.553 174.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -91.38 -47.37 7.5 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.603 -1.31 . . . . 3.1 111.064 173.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -67.67 2.66 1.75 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 126.429 1.891 . . . . 5.44 113.355 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 48.9 m -145.4 33.63 1.07 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.248 1.819 . . . . 6.9 111.511 163.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 3.8 m -71.32 -5.25 31.02 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 120.727 -1.233 . . . . 9.62 113.649 167.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 55.5 m . . . . . 0 C--O 1.25 1.104 0 C-N-CA 130.293 3.437 . . . . 11.52 109.641 -176.269 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 t . . . . . 0 N--CA 1.469 0.516 0 N-CA-C 110.786 -0.079 . . . . 12.2 110.786 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -67.35 -100.12 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 128.947 2.899 . . . . 9.1 112.503 171.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 14.8 m -64.0 -44.88 91.3 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 120.662 -1.274 . . . . 4.64 112.12 -167.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -82.78 103.59 12.38 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 106.949 -1.5 . . . . 3.24 106.949 158.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 p -57.5 169.02 0.7 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.027 1.731 . . . . 2.13 113.799 -163.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -70.0 -8.94 53.23 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.743 -1.223 . . . . 3.68 113.786 172.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.51 -39.94 10.14 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.458 1.026 . . . . 1.19 110.641 167.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -77.51 -58.85 3.04 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 120.702 -1.249 . . . . 3.57 110.784 -173.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.437 ' O ' HG23 ' A' ' 14' ' ' VAL . 11.9 tptp -56.67 -23.56 42.65 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.865 -0.522 . . . . 5.86 111.624 171.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.801 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -66.04 -53.8 33.92 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.066 -1.021 . . . . 1.37 112.785 168.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.03 -36.04 64.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 CA-C-N 119.865 1.211 . . . . 1.32 110.727 174.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.4 mm -54.6 -50.93 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 CA-C-N 119.463 1.029 . . . . 2.1 110.645 167.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 10' ' ' LYS . 31.0 t -69.67 -29.49 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 124.759 1.224 . . . . 1.41 112.188 -174.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.2 mp -70.59 -39.79 73.63 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.7 1.137 . . . . 1.54 111.571 170.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.8 t -63.48 -46.46 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.046 0.938 . . . . 1.35 111.295 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -65.18 -45.72 83.73 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.362 0.983 . . . . 4.95 111.244 172.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -57.85 -27.93 63.67 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 119.534 -1.979 . . . . 3.92 113.815 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -74.63 -67.35 0.64 Allowed 'General case' 0 C--O 1.24 0.559 0 C-N-CA 123.266 0.626 . . . . 2.16 111.709 165.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -61.11 -34.67 75.33 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 117.578 -1.201 . . . . 2.62 112.334 -168.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.8 mtpt -43.54 -51.43 6.79 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 126.861 2.064 . . . . 2.27 113.044 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -81.6 -32.64 31.95 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.788 1.235 . . . . 2.61 111.248 -176.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.455 HG12 ' H ' ' A' ' 28' ' ' LEU . 60.6 t -77.96 56.01 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 128.217 2.607 . . . . 3.78 110.115 177.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 t 72.89 -29.07 0.2 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 130.263 3.425 . . . . 3.81 116.122 -171.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.1 tptp 119.32 -14.87 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.944 1 C-N-CA 133.677 4.791 . . . . 7.71 113.279 -158.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -166.45 -17.57 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 117.155 2.28 . . . . 7.11 117.155 -162.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.0 m -120.66 5.44 10.55 Favored 'General case' 0 N--CA 1.481 1.075 0 N-CA-C 118.308 2.707 . . . . 4.55 118.308 -140.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.455 ' H ' HG12 ' A' ' 23' ' ' VAL . 91.0 mt 56.37 -81.92 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.575 1.95 . . . . 7.6 113.286 177.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.5 p -102.74 -25.24 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 128.132 2.573 . . . . 3.98 113.535 -170.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.32 -36.18 65.94 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.076 0.95 . . . . 7.71 111.235 178.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.3 m120 -140.93 101.1 3.98 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.652 -1.61 . . . . 6.74 106.652 161.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.73 134.16 35.42 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 119.092 -0.48 . . . . 8.04 110.896 178.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 36.3 pt -68.83 160.48 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 CA-C-N 119.996 1.271 . . . . 2.09 111.337 169.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.5 m -78.19 135.98 37.72 Favored 'General case' 0 C--N 1.328 -0.369 0 O-C-N 121.196 -0.94 . . . . 2.42 109.072 157.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.5 mttp -59.1 -27.91 66.02 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.069 -1.02 . . . . 2.08 112.256 -178.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.2 p -57.37 -30.8 65.17 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 115.253 1.575 . . . . 1.64 115.253 168.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.8 m -71.19 -39.07 72.04 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.641 1.11 . . . . 1.3 112.461 177.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -50.95 -53.91 28.83 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.038 0.935 . . . . 2.1 111.611 176.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 23.7 ptt85 -69.61 -14.42 62.82 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.611 1.337 . . . . 2.95 114.611 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -89.18 -46.02 9.12 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.193 0.997 . . . . 4.52 111.009 175.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 3.3 tmm? -47.45 -47.25 27.1 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.518 1.127 . . . . 1.26 111.69 164.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.5 mt -60.12 -37.29 79.6 Favored 'General case' 0 C--O 1.212 -0.879 0 C-N-CA 123.49 0.716 . . . . 2.06 111.655 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -69.96 -14.31 62.65 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 120.001 1.273 . . . . 3.03 113.736 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.82 -46.48 3.48 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.391 1.476 . . . . 2.65 114.108 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -87.28 -28.17 22.46 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 119.478 1.035 . . . . 3.59 111.921 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.48 49.04 0.81 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.87 2.068 . . . . 1.71 110.766 162.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 42.1 p30 -69.05 -178.37 1.24 Allowed 'General case' 0 CA--C 1.548 0.904 0 O-C-N 120.561 -1.337 . . . . 4.67 111.467 166.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 61.5 m170 80.29 -32.27 0.12 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 116.872 2.175 . . . . 2.72 116.872 158.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.7 ptp -76.21 -19.66 58.18 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 113.383 0.883 . . . . 2.52 113.383 163.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.8 mp -69.28 107.87 3.44 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.505 0.722 . . . . 3.02 110.857 -177.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.5 m -76.58 -19.5 57.81 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.956 0.724 . . . . 4.04 112.956 167.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -162.67 160.61 25.83 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 127.73 2.412 . . . . 3.69 107.902 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 p -51.28 -20.93 1.85 Allowed 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 126.455 1.902 . . . . 4.23 114.004 164.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -48.88 -34.86 16.46 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-N 120.983 1.719 . . . . 2.17 114.291 176.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 30.5 t30 -71.57 -38.71 70.91 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 118.158 0.979 . . . . 3.61 112.304 175.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -63.73 -37.56 87.84 Favored 'General case' 0 C--N 1.346 0.446 0 O-C-N 121.003 -1.061 . . . . 4.7 112.184 165.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -64.34 -27.48 69.05 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 119.643 -1.911 . . . . 3.23 113.327 174.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.56 -12.95 61.63 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.906 1.076 . . . . 1.09 113.906 166.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.75 -46.47 14.2 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.162 0.892 . . . . 1.09 111.608 160.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -51.86 -44.01 63.48 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.64 1.176 . . . . 1.9 113.259 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -55.92 -28.45 56.88 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.715 1.005 . . . . 3.09 113.715 175.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.7 mt -79.39 -41.43 27.76 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.346 1.059 . . . . 0.97 111.238 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 9.9 mm -53.44 -54.22 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 124.407 1.083 . . . . 0.92 110.175 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -58.1 -43.06 86.94 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.234 0.54 . . . . 1.88 112.439 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -31.31 70.73 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.374 1.47 . . . . 2.85 112.829 178.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.6 mt -95.05 -23.24 17.43 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 114.01 1.115 . . . . 2.87 114.01 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -67.84 -14.67 63.15 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.506 1.503 . . . . 3.0 112.394 170.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.15 -18.73 48.95 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 115.064 1.505 . . . . 2.56 115.064 163.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -130.53 -24.17 2.53 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 116.455 2.02 . . . . 3.24 116.455 -166.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -121.88 138.94 54.2 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 120.288 -1.507 . . . . 4.44 112.885 -171.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -96.37 -160.6 0.81 Allowed 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 126.456 1.902 . . . . 4.58 111.072 -175.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -59.84 -10.74 14.52 Favored Glycine 0 CA--C 1.527 0.793 0 O-C-N 120.011 -1.681 . . . . 2.79 113.843 152.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.7 mmt-85 -69.93 79.1 0.47 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.356 1.578 . . . . 4.81 108.992 161.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.4 mt -83.32 135.54 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 N-CA-C 107.505 -1.294 . . . . 2.36 107.505 172.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.7 t -104.17 166.45 10.39 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.551 0.691 . . . . 1.66 111.79 172.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -78.11 -42.97 30.31 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.273 1.035 . . . . 2.69 112.496 -178.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.5 p-10 -71.63 -24.1 61.81 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.588 1.955 . . . . 3.65 112.644 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -52.86 -57.31 10.65 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.311 1.844 . . . . 2.88 111.103 169.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -56.47 -46.73 80.26 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.223 -0.923 . . . . 2.27 111.814 177.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -59.76 -39.94 86.52 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.822 -0.549 . . . . 1.21 111.747 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 73.2 m -63.9 -42.02 97.55 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 126.243 1.817 . . . . 2.03 110.769 175.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.01 -38.83 92.22 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 117.929 -1.034 . . . . 0.82 113.289 174.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.1 mm -57.75 -34.4 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 120.716 1.598 . . . . 1.13 110.947 173.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.02 -6.06 36.32 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.87 1.224 . . . . 1.41 114.618 176.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -97.46 -19.85 24.18 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.034 1.417 . . . . 0.74 114.599 171.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 5.1 mp -92.89 -35.96 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 118.776 1.288 . . . . 1.64 110.451 170.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.8 m -74.42 145.7 43.49 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.575 -0.898 . . . . 2.28 108.575 171.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.45 -60.15 0.49 Allowed Glycine 0 CA--C 1.535 1.292 0 CA-C-O 117.086 -1.952 . . . . 0.91 115.428 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -65.55 -64.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.81 0 CA-C-N 121.356 2.578 . . . . 1.16 111.095 -173.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.5 -7.98 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 112.897 0.703 . . . . 1.72 112.897 175.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.512 ' HA ' HD12 ' A' ' 94' ' ' ILE . . . -58.67 -34.04 70.8 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.846 1.203 . . . . 1.17 113.225 -178.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -66.68 -27.59 67.78 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.335 -1.478 . . . . 3.8 111.873 175.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.1 tt -80.21 -33.56 38.01 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.655 1.582 . . . . 1.47 111.564 174.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.512 HD12 ' HA ' ' A' ' 91' ' ' ALA . 98.0 mt -47.42 -52.49 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 CA-C-N 119.226 0.921 . . . . 0.92 110.435 165.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -53.53 -42.06 67.02 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.157 1.169 . . . . 3.7 114.157 177.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.56 -49.5 76.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.794 0.838 . . . . 6.5 110.731 173.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -60.56 -39.91 89.72 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 120.905 -1.122 . . . . 2.66 113.35 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -66.94 -22.71 65.93 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 119.589 1.086 . . . . 3.44 112.283 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -96.9 -47.72 5.72 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.162 -0.961 . . . . 2.11 112.017 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -67.45 -18.8 65.22 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.601 0.76 . . . . 4.61 112.329 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.1 t -86.7 11.31 13.3 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.699 1.2 . . . . 8.54 113.515 164.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 46.8 t -150.73 52.13 0.87 Allowed 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.296 -1.503 . . . . 9.38 112.798 -169.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 C--O 1.25 1.107 0 C-N-CA 126.997 2.119 . . . . 11.2 110.844 172.934 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 N--CA 1.47 0.556 0 CA-C-O 120.362 0.125 . . . . 12.05 110.856 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -65.07 -100.42 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 129.172 2.989 . . . . 8.76 112.689 172.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 19.1 m -66.2 -51.11 60.87 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.435 -1.415 . . . . 4.36 111.668 -168.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -74.61 98.21 3.34 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 106.426 -1.694 . . . . 3.28 106.426 159.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 11.2 p -58.32 168.2 1.15 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 126.214 1.805 . . . . 2.16 113.72 -162.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.51 -6.88 21.73 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.432 -1.417 . . . . 3.44 113.742 171.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -97.61 -38.72 9.43 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.663 1.12 . . . . 1.07 111.344 166.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.87 -58.39 3.29 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 120.537 -1.352 . . . . 3.5 110.407 -174.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . 0.461 ' O ' HG23 ' B' ' 117' ' ' VAL . 14.0 tptp -57.84 -26.06 61.51 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 122.087 -0.383 . . . . 6.7 110.66 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.801 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -62.23 -55.97 23.25 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 121.477 -0.764 . . . . 1.27 112.887 169.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.25 -35.09 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-N 119.911 1.232 . . . . 1.33 110.668 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 19.8 mt -57.68 -44.53 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 118.596 0.635 . . . . 1.32 112.167 167.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.461 HG23 ' O ' ' B' ' 113' ' ' LYS . 39.8 t -72.73 -29.46 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 124.26 1.024 . . . . 1.45 111.558 -177.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.4 mp -69.68 -43.44 72.51 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.15 0.886 . . . . 1.66 111.184 168.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 19.2 t -57.41 -46.76 85.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 124.566 1.146 . . . . 1.42 111.728 171.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -62.31 -51.9 65.81 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.961 0.904 . . . . 4.68 111.869 172.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -59.95 -25.59 65.32 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 120.489 -1.382 . . . . 3.92 113.497 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -72.64 -69.54 0.4 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.688 0.795 . . . . 2.52 111.534 164.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -62.98 -32.15 73.42 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 118.328 -0.844 . . . . 2.43 113.025 -167.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 28.0 mtpt -43.86 -54.23 5.42 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.376 1.87 . . . . 2.2 113.2 174.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . 0.458 ' CZ ' ' HG3' ' B' ' 144' ' ' MET . 43.1 m-85 -75.5 -30.2 59.78 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 123.531 0.732 . . . . 2.43 110.783 -177.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.509 HG12 ' H ' ' B' ' 131' ' ' LEU . 65.2 t -79.29 49.91 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 C-N-CA 127.683 2.393 . . . . 3.35 110.702 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 72.97 -26.41 0.19 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 129.504 3.122 . . . . 3.81 115.791 -172.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 38.9 tptt 116.67 -17.79 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.946 1 C-N-CA 133.47 4.708 . . . . 8.47 113.631 -157.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -159.54 -26.07 0.07 Allowed 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 117.693 2.479 . . . . 7.27 117.693 -169.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 4.0 m -104.66 6.72 34.57 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 118.57 2.804 . . . . 4.67 118.57 -140.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . 0.509 ' H ' HG12 ' B' ' 126' ' ' VAL . 88.0 mt 57.43 -79.31 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.987 2.115 . . . . 7.28 113.788 173.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 11.0 p -102.71 -25.12 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 126.12 1.768 . . . . 4.08 113.56 -174.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.15 -40.4 77.13 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.382 1.073 . . . . 7.62 111.164 177.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 23.1 m120 -131.12 83.81 2.14 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.449 1.5 . . . . 6.79 107.652 162.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.92 133.31 49.75 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.106 -0.637 . . . . 8.06 111.757 171.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 35.9 pt -80.09 168.12 2.0 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-O 121.708 0.766 . . . . 2.08 112.403 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 5.5 m -99.07 127.2 44.97 Favored 'General case' 0 C--N 1.329 -0.315 0 O-C-N 121.825 -0.547 . . . . 2.39 109.933 176.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 32.0 mttp -60.79 -28.63 68.9 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 120.836 -1.165 . . . . 2.06 112.256 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 10.8 p -60.2 -33.69 72.58 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.75 1.62 . . . . 1.59 113.801 168.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.2 m -79.95 -37.36 34.63 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 118.197 -0.906 . . . . 1.81 111.792 174.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -49.05 -54.07 17.49 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.571 1.078 . . . . 2.02 111.878 173.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 14.0 ptt85 -66.08 -17.17 64.53 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 114.211 1.189 . . . . 3.01 114.211 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -94.02 -48.12 6.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.205 1.402 . . . . 3.86 110.086 -177.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . 0.458 ' HG3' ' CZ ' ' B' ' 125' ' ' TYR . 5.6 tmm? -45.17 -45.73 11.69 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.118 2.167 . . . . 1.25 112.51 162.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 8.9 mt -54.35 -40.87 68.48 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 123.625 0.77 . . . . 2.2 111.292 176.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -71.04 -13.66 62.06 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.634 -1.292 . . . . 2.97 113.944 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.76 -53.78 3.31 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.902 1.281 . . . . 1.93 113.086 175.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -86.98 -26.96 23.55 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.385 0.539 . . . . 3.64 111.657 -174.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -107.61 46.83 0.92 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 126.921 2.089 . . . . 1.8 110.951 164.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 48.9 p30 -65.84 -178.38 0.57 Allowed 'General case' 0 CA--C 1.554 1.109 0 O-C-N 120.952 -1.093 . . . . 4.79 111.864 168.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 60.6 m170 79.17 -35.43 0.16 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 117.168 2.284 . . . . 2.65 117.168 156.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 10.5 ptp -73.46 -19.37 60.96 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 118.716 0.689 . . . . 2.42 112.77 162.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.33 99.83 0.58 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.935 0.894 . . . . 2.95 111.04 -172.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 1.2 m -75.14 -14.7 60.58 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.259 1.024 . . . . 4.21 113.378 175.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -167.22 159.97 13.29 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 128.574 2.749 . . . . 3.89 108.035 166.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 72.9 p -50.01 -24.19 2.47 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 126.035 1.734 . . . . 5.01 113.5 165.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -51.71 -29.67 26.24 Favored Glycine 0 CA--C 1.529 0.967 0 CA-C-N 120.822 1.646 . . . . 2.37 114.073 174.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -74.31 -36.16 63.71 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 118.3 1.05 . . . . 3.47 112.377 174.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 17.4 ttt-85 -64.12 -39.56 94.3 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.994 0.815 . . . . 4.6 111.884 162.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.6 mtmt -65.8 -20.95 66.44 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 119.893 -1.754 . . . . 3.54 113.652 174.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . 0.428 ' HA ' ' HG2' ' B' ' 164' ' ' LYS . . . -73.18 -10.39 59.72 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.239 -0.913 . . . . 1.28 113.447 168.367 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -83.02 -44.44 15.21 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 117.334 -1.317 . . . . 1.11 111.471 158.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . 0.408 ' HA ' HG12 ' B' ' 166' ' ' ILE . 1.8 m-20 -48.52 -44.59 36.31 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 120.86 1.664 . . . . 1.94 113.632 176.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' B' ' 161' ' ' ALA . 3.0 ptmm? -55.37 -30.29 60.06 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.105 1.15 . . . . 3.74 114.105 174.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 39.5 mt -78.4 -38.25 42.04 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.481 -0.762 . . . . 1.19 111.892 173.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . 0.408 HG12 ' HA ' ' B' ' 163' ' ' ASP . 9.5 mm -58.8 -53.39 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 124.004 0.815 . . . . 1.22 109.669 -174.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -60.61 -31.34 70.52 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.256 0.835 . . . . 2.1 113.256 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -73.84 -39.9 63.69 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.927 1.691 . . . . 2.61 112.738 176.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.02 -18.02 22.29 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 114.09 1.144 . . . . 3.09 114.09 -173.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -58.88 -24.2 61.92 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.847 1.259 . . . . 3.08 113.021 166.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.58 -24.75 45.35 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.065 1.135 . . . . 2.34 114.065 169.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -109.34 -16.49 14.02 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.739 1.385 . . . . 2.59 114.739 -170.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 5.7 t-80 -142.08 97.2 3.09 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 120.57 -1.331 . . . . 3.52 112.576 -163.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -65.49 167.52 8.68 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 108.857 -0.794 . . . . 4.8 108.857 149.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -67.39 31.35 0.21 Allowed Glycine 0 CA--C 1.527 0.818 0 C-N-CA 126.113 1.816 . . . . 3.11 116.799 178.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 30.8 mmt-85 -76.24 50.57 0.64 Allowed 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.476 1.638 . . . . 5.25 109.864 161.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.9 mt -62.29 136.71 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.023 1.329 . . . . 2.65 111.144 -162.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 12.8 t -117.83 155.91 29.28 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.667 1.187 . . . . 2.57 109.471 167.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -56.35 -34.78 66.94 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.488 1.115 . . . . 2.54 113.122 -173.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -68.52 -21.78 64.56 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.773 2.029 . . . . 3.92 114.052 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -66.96 -58.63 4.59 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.008 1.277 . . . . 3.09 110.944 178.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -50.03 -49.56 50.48 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.787 -0.571 . . . . 2.26 111.706 172.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -61.17 -39.57 90.61 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.725 -0.609 . . . . 1.26 112.085 -176.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 27.5 m -64.85 -44.18 90.58 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.746 1.618 . . . . 2.03 110.86 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 88.4 mt -64.83 -36.47 84.45 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 117.847 -1.073 . . . . 1.02 113.097 177.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 34.5 mm -56.21 -45.32 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 CA-C-N 120.898 1.681 . . . . 1.06 111.344 172.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -64.82 -19.4 65.32 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 123.849 0.738 . . . . 1.12 113.272 177.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.37 -20.82 65.94 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-O 118.257 -1.302 . . . . 1.03 113.915 173.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.3 mp -86.95 -43.09 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 CA-C-N 119.607 1.704 . . . . 1.18 109.994 164.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 11.5 m -77.92 66.01 3.48 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.868 1.667 . . . . 1.53 111.375 -168.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -131.91 -75.39 0.12 Allowed Glycine 0 CA--C 1.533 1.191 0 C-N-CA 125.853 1.692 . . . . 1.32 112.961 -174.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.52 -59.43 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.256 2.638 . . . . 1.47 112.753 -168.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.3 pp -69.08 -11.55 14.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 113.282 0.845 . . . . 1.63 113.282 -173.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . 0.489 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -56.5 -35.9 68.53 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.624 1.102 . . . . 1.27 112.899 175.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 51.3 mtpt -74.08 -10.24 59.43 Favored 'General case' 0 CA--C 1.55 0.979 0 O-C-N 120.287 -1.508 . . . . 4.3 112.785 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.1 tt -93.88 -30.33 14.84 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.176 2.19 . . . . 1.81 112.377 166.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . 0.489 HD12 ' HA ' ' B' ' 194' ' ' ALA . 91.6 mt -49.24 -48.14 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 120.661 -1.274 . . . . 1.06 109.558 165.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -57.21 -30.31 64.46 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 115.458 1.651 . . . . 3.57 115.458 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.67 -54.14 15.27 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.846 -0.427 . . . . 6.18 109.846 168.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -58.8 -41.69 87.36 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.791 1.404 . . . . 2.76 114.791 -172.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -69.66 -17.65 63.52 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 119.541 1.064 . . . . 3.25 112.471 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.8 -50.82 4.3 Favored 'General case' 0 CA--C 1.514 -0.409 0 O-C-N 121.232 -0.918 . . . . 1.98 111.735 177.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -67.08 -17.13 64.74 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.954 -1.021 . . . . 4.22 112.757 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 26.3 t -91.71 15.29 13.04 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.549 1.14 . . . . 8.27 113.031 165.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 41.4 t -148.17 55.5 1.04 Allowed 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.62 -1.3 . . . . 9.09 112.106 -173.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 26.5 t . . . . . 0 C--O 1.254 1.315 0 C-N-CA 127.52 2.328 . . . . 11.1 111.029 174.892 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.1 m . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 120.997 0.427 . . . . 11.33 110.185 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -110.16 53.66 0.69 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 125.454 2.549 . . . . 7.08 112.964 -133.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 74.0 m -83.49 77.25 9.85 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 109.608 -3.451 . . . . 3.38 109.75 176.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -43.92 110.26 0.2 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.705 1.202 . . . . 2.07 111.942 175.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.9 t -64.69 151.9 43.8 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.48 0.712 . . . . 3.01 110.329 176.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.425 ' HG2' HG21 ' B' ' 117' ' ' VAL . 4.5 tp10 -51.09 -38.95 54.82 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.484 1.114 . . . . 2.53 112.033 -173.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.54 -49.16 73.39 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.281 1.432 . . . . 0.82 111.611 178.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -72.95 -46.14 54.13 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.521 -0.737 . . . . 3.17 111.341 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.85 -37.13 18.6 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.635 0.731 . . . . 6.09 110.951 169.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.822 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -75.96 -47.35 25.43 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.301 1.44 . . . . 0.53 112.326 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 74.3 t -54.66 -38.5 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 120.027 1.285 . . . . 0.62 110.398 171.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 85.5 mt -60.37 -55.01 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 118.403 -0.808 . . . . 0.93 110.364 170.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.4 t -56.09 -40.98 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 119.537 1.062 . . . . 0.64 112.569 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -64.35 -36.98 85.88 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.265 -0.897 . . . . 1.07 111.566 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 78.5 t -80.84 -35.98 15.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 124.363 1.065 . . . . 0.74 111.339 -178.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.457 ' CD ' ' HZ2' ' A' ' 21' ' ' LYS . 14.6 tm-20 -54.83 -49.96 69.78 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.032 0.933 . . . . 2.88 109.98 164.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.535 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 6.3 t30 -66.14 -9.48 31.94 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.496 1.295 . . . . 2.64 114.496 -170.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -112.46 -50.42 2.9 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.729 1.211 . . . . 2.56 113.631 -178.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -59.68 -25.87 65.1 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.368 1.44 . . . . 2.02 112.912 177.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.535 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 7.3 ptmt -53.64 -20.45 5.29 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 120.623 -1.298 . . . . 2.11 114.437 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -80.3 -2.86 47.05 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.43 1.27 . . . . 2.58 114.43 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.8 m -128.46 152.5 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 126.298 1.839 . . . . 2.7 109.53 171.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.0 p -92.2 -45.04 8.45 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.161 1.541 . . . . 3.75 115.161 -174.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 178.0 -63.54 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.9 1.28 . . . . 5.46 113.01 -174.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -99.14 128.76 45.33 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.426 -0.806 . . . . 8.49 110.624 -161.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 48.3 t -170.73 157.6 5.68 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.237 0.615 . . . . 5.09 111.877 -166.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 34.8 mt -87.32 4.57 42.34 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.483 1.913 . . . . 10.11 113.237 176.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.4 p -164.81 153.76 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.631 1.972 . . . . 5.53 110.541 -165.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.6 ' HE3' ' H ' ' A' ' 76' ' ' PHE . 46.1 mtmt -61.18 -28.48 69.17 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.186 1.18 . . . . 16.93 114.186 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -151.11 154.88 37.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.382 1.473 . . . . 11.42 112.423 168.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . 0.256 44.0 tttt -147.28 46.46 1.14 Allowed 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 125.19 1.396 . . . . 8.63 111.235 162.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.9 pt -68.99 167.26 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-N 114.722 -1.127 . . . . 2.5 109.735 172.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.7 t -71.82 129.72 39.33 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 120.549 -1.344 . . . . 2.79 109.932 166.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.6 mttp -61.53 -20.52 63.34 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.023 -1.048 . . . . 2.3 111.815 173.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.8 m -68.72 -28.41 66.8 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.357 -0.839 . . . . 2.36 112.99 172.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.2 m -74.98 -21.42 59.16 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 120.029 1.286 . . . . 1.25 113.71 -173.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -63.15 -57.26 11.14 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.656 -1.278 . . . . 1.86 112.021 165.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -60.65 -30.06 69.65 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.849 -0.532 . . . . 2.92 112.227 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.98 -58.64 5.58 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.31 2.244 . . . . 3.51 110.266 171.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -52.53 -37.66 58.05 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 127.798 2.439 . . . . 1.4 113.868 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 58.9 mt -56.68 -16.17 5.83 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 115.088 1.514 . . . . 1.19 115.088 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . 0.253 0.1 OUTLIER -110.87 11.42 22.36 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 115.058 1.503 . . . . 2.2 115.058 171.786 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.94 -56.28 2.22 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.54 1.136 . . . . 1.76 111.532 164.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -81.28 -46.86 14.14 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.327 -0.858 . . . . 3.12 112.344 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.43 15.4 3.06 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.385 -1.447 . . . . 2.09 114.295 -172.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.15 29.69 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 130.582 3.553 . . . . 2.33 118.226 -174.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.428 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 21.4 m-70 -126.89 -67.1 0.87 Allowed 'General case' 0 CA--C 1.545 0.786 0 O-C-N 120.07 -1.644 . . . . 1.75 111.705 -178.054 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.3 ptp -65.3 -11.83 45.61 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.301 1.41 . . . . 2.15 114.181 167.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.4 tp -58.44 99.54 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.12 1.768 . . . . 2.35 110.286 -176.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.19 61.39 6.8 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.412 1.085 . . . . 4.45 110.143 -171.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.1 t70 48.1 -135.74 1.04 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 127.318 2.247 . . . . 5.0 112.904 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.4 p -76.61 -37.89 55.67 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 127.082 2.153 . . . . 2.75 111.18 -170.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.82 -40.58 93.19 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 119.166 0.893 . . . . 1.65 111.824 175.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -68.81 -56.91 6.51 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.326 1.051 . . . . 3.14 111.259 172.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -56.4 -39.27 72.72 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 114.459 1.281 . . . . 4.85 114.459 -176.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 48.6 mmtt -54.15 -38.19 65.24 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.67 1.577 . . . . 3.02 113.45 174.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.14 -30.02 61.54 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.869 -1.062 . . . . 1.07 113.423 175.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.61 -47.96 65.33 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.173 0.897 . . . . 0.81 111.206 171.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -63.46 -32.36 73.78 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.433 1.093 . . . . 2.04 112.825 -175.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -57.27 -32.24 66.41 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 119.287 0.949 . . . . 3.34 113.35 173.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.0 mt -75.58 -43.54 47.77 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.01 0.924 . . . . 0.94 111.637 175.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 27.0 mm -59.88 -45.21 95.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 117.847 0.294 . . . . 1.05 110.671 -170.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -59.28 -40.4 85.98 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.837 0.827 . . . . 2.37 113.094 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -65.2 -23.83 67.2 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.794 1.238 . . . . 2.99 112.486 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -93.21 -33.68 13.89 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 125.827 1.651 . . . . 2.37 113.171 174.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -58.71 -28.87 66.21 Favored 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.663 -1.273 . . . . 2.72 112.961 163.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.34 -14.43 62.92 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.115 1.524 . . . . 1.92 115.115 167.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -136.69 3.1 2.72 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.972 1.841 . . . . 2.55 115.972 -165.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.414 ' CD2' ' HA ' ' A' ' 74' ' ' ILE . 0.2 OUTLIER -150.54 127.89 11.37 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 119.789 -1.819 . . . . 3.38 112.231 -171.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -58.71 13.13 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 130.494 3.518 . . . . 4.77 115.134 173.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.47 -18.96 4.12 Favored Glycine 0 CA--C 1.53 1.019 0 O-C-N 118.537 -2.602 . . . . 3.24 111.745 -162.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -44.19 135.83 4.22 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.181 1.49 . . . . 4.5 107.232 150.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.414 ' HA ' ' CD2' ' A' ' 70' ' ' HIS . 0.9 OUTLIER -140.23 146.77 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.983 0.897 . . . . 3.35 109.367 171.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 16.1 m -56.69 167.82 0.69 Allowed 'General case' 0 CA--C 1.552 1.057 0 CA-C-O 121.995 0.902 . . . . 1.87 111.969 162.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.6 ' H ' ' HE3' ' A' ' 30' ' ' LYS . 19.6 t80 -76.23 -33.16 59.21 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-O 124.258 1.98 . . . . 2.31 109.874 160.221 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.31 -20.38 48.09 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 130.284 3.434 . . . . 3.67 110.859 -162.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -68.11 -58.46 4.44 Favored 'General case' 0 C--O 1.22 -0.475 0 C-N-CA 127.242 2.217 . . . . 4.85 111.859 176.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -48.32 -49.14 35.26 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 121.395 1.907 . . . . 1.75 111.937 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 14.7 t-105 -59.68 -47.71 84.56 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 118.802 -0.618 . . . . 1.0 110.84 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 94.6 m -58.59 -51.29 70.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.958 1.303 . . . . 2.59 111.249 175.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.8 mt -58.6 -33.35 69.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.33 1.452 . . . . 1.16 113.227 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 19.5 mm -50.6 -42.48 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 CA-C-N 120.441 1.473 . . . . 0.69 111.047 173.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.94 -17.88 37.96 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.455 1.026 . . . . 0.71 114.776 179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.75 -24.21 60.69 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-N 118.472 1.136 . . . . 0.78 113.741 174.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.6 mp -95.32 -44.32 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 119.398 1.599 . . . . 0.74 109.704 169.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.8 m -74.29 54.07 0.54 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.167 2.187 . . . . 1.25 109.983 165.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -124.1 -77.79 0.35 Allowed Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.532 1.539 . . . . 0.81 111.182 177.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.88 -46.84 0.68 Allowed 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 123.323 2.682 . . . . 0.93 112.685 -174.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -76.11 -16.38 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 113.195 0.813 . . . . 1.28 113.195 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.89 -31.38 64.64 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.34 0.867 . . . . 1.22 113.34 -169.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -45.84 90.87 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 121.283 -0.886 . . . . 2.86 111.777 168.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -57.81 -36.75 72.67 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 123.83 0.852 . . . . 1.68 111.493 -173.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.1 mt -48.42 -59.7 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.72 1.208 . . . . 1.13 110.699 171.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -64.39 -32.93 74.75 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.379 -0.825 . . . . 1.82 112.978 -176.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.322 3.1 pt-20 -81.91 -22.66 36.68 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 112.989 0.737 . . . . 2.91 112.989 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -68.15 -41.48 81.51 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 125.381 1.472 . . . . 3.0 113.761 167.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.08 -40.42 76.91 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.642 1.11 . . . . 2.67 110.371 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -58.92 -49.88 76.16 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.339 0.656 . . . . 3.14 111.28 173.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -67.97 -9.7 47.49 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.281 1.032 . . . . 5.71 113.451 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.4 m -111.76 7.83 20.39 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.048 1.739 . . . . 6.72 111.912 177.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.0 m -82.63 10.18 7.98 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.637 1.347 . . . . 9.52 114.637 -172.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 96.2 p . . . . . 0 C--O 1.247 0.968 0 C-N-CA 125.461 1.504 . . . . 11.86 112.96 -169.676 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 74.5 m . . . . . 0 N--CA 1.479 0.99 0 CA-C-O 121.333 0.587 . . . . 11.26 110.133 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -113.39 65.78 0.65 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 125.137 2.399 . . . . 6.96 110.908 -138.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 39.4 t -66.43 -25.91 66.97 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 109.142 -3.663 . . . . 3.8 113.849 -178.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.428 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 15.6 m-85 52.98 82.46 0.07 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 126.543 1.937 . . . . 2.37 113.481 -174.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.4 t -67.43 152.92 44.84 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.514 0.726 . . . . 3.27 111.73 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -64.86 -31.65 72.98 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 114.149 1.166 . . . . 2.59 114.149 -159.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.77 -46.39 84.62 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.524 1.056 . . . . 0.87 110.184 177.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -73.25 -50.34 22.85 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.136 -0.935 . . . . 3.11 110.913 -176.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -38.43 -50.17 1.5 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.479 1.036 . . . . 4.16 113.239 164.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.822 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.19 -37.39 80.89 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 118.234 -0.889 . . . . 0.5 112.553 -177.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 70.4 t -61.43 -40.2 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 119.842 1.201 . . . . 0.62 110.477 169.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 48.0 mt -58.72 -51.12 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 119.452 1.024 . . . . 0.77 109.894 170.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.425 HG21 ' HG2' ' A' ' 7' ' ' GLU . 19.7 t -61.95 -41.02 89.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.799 1.24 . . . . 0.57 112.717 -176.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.7 mp -63.72 -43.39 96.68 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.287 -0.883 . . . . 0.97 111.078 175.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 54.1 t -71.66 -36.16 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 123.861 0.865 . . . . 0.63 112.142 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . 0.431 ' CD ' ' HZ2' ' B' ' 124' ' ' LYS . 10.0 tm-20 -55.07 -51.06 67.55 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.496 1.118 . . . . 3.21 110.358 166.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . 0.54 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 5.5 t30 -64.32 -6.52 7.14 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.947 1.462 . . . . 2.47 114.947 -174.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -110.24 -57.37 2.21 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.988 1.315 . . . . 2.25 112.856 -178.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -61.5 -20.86 63.67 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.426 1.012 . . . . 2.09 113.45 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . 0.54 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 5.9 ptmt -53.86 -19.36 4.33 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 120.278 -1.513 . . . . 2.0 114.598 173.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -81.14 -1.66 45.35 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 114.406 1.261 . . . . 2.52 114.406 174.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 29.4 m -128.72 158.47 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 125.503 1.521 . . . . 2.59 110.778 172.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 5.8 p -84.52 -41.82 16.14 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 114.959 1.466 . . . . 3.79 114.959 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.474 ' HZ2' ' HB2' ' B' ' 128' ' ' LYS . 4.6 ttmp? 141.1 -43.97 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.941 1 C-N-CA 132.121 4.168 . . . . 5.3 112.546 -164.291 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -95.41 116.16 28.41 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.879 0.871 . . . . 8.74 111.124 -166.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 29.3 t -174.2 160.67 3.4 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.165 0.986 . . . . 4.97 110.961 -165.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 80.2 mt -81.51 -7.07 59.53 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.793 1.237 . . . . 10.24 113.436 171.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . 0.453 HG11 HH11 ' B' ' 176' ' ' ARG . 2.3 m -153.43 160.58 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 126.629 1.972 . . . . 5.16 111.716 -174.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . 0.41 ' HE3' ' C ' ' B' ' 178' ' ' SER . 46.9 mtmt -48.66 -50.99 30.66 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.539 1.136 . . . . 16.5 111.985 171.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -144.25 136.87 26.86 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.06 0.944 . . . . 11.24 112.502 170.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -126.82 54.65 1.6 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.953 1.301 . . . . 8.86 108.55 153.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 29.7 pt -77.19 156.13 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 N-CA-C 108.72 -0.845 . . . . 2.54 108.72 173.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 41.7 t -61.21 122.2 14.47 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.918 -1.114 . . . . 2.68 109.726 173.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 14.2 mttp -64.45 -17.35 63.74 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 120.961 -1.087 . . . . 2.64 111.379 177.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 37.0 m -63.98 -29.54 70.69 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.331 -0.856 . . . . 2.28 112.778 167.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 58.6 m -74.83 -20.89 59.57 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.967 1.258 . . . . 1.3 113.733 -174.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.18 -58.68 5.38 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.171 1.35 . . . . 1.97 110.744 167.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.6 ptt180 -60.49 -27.04 67.27 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.658 -0.651 . . . . 3.38 112.475 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -66.82 -58.61 4.69 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.259 1.824 . . . . 3.62 110.601 169.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.9 tmm? -50.98 -39.11 54.71 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 127.744 2.418 . . . . 1.25 113.514 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 75.2 mt -63.14 -0.03 0.69 Allowed 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 116.106 1.891 . . . . 1.57 116.106 175.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . 0.263 0.1 OUTLIER -118.46 9.88 12.49 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.27 1.582 . . . . 2.19 115.27 164.044 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.91 -64.36 1.19 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.29 1.436 . . . . 1.75 111.826 168.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -76.57 -30.2 56.95 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.778 0.717 . . . . 3.13 111.511 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 mp -100.98 77.78 1.87 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.777 0.798 . . . . 1.88 110.87 165.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -109.68 0.7 19.09 Favored 'General case' 0 CA--C 1.549 0.94 0 N-CA-C 114.74 1.385 . . . . 2.07 114.74 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -109.9 -39.83 4.95 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.9 1.227 . . . . 1.63 113.671 -171.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 17.3 ptp -85.41 -15.78 41.94 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.766 -1.209 . . . . 2.4 113.714 171.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.65 103.41 0.25 Allowed 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 126.357 1.863 . . . . 2.34 111.575 -166.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.406 ' H ' ' ND2' ' B' ' 158' ' ' ASN . 0.9 OUTLIER -85.14 59.1 5.42 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.076 0.951 . . . . 4.53 110.841 -172.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . 0.417 ' CG ' ' H ' ' B' ' 156' ' ' THR . 35.3 t70 50.19 -139.7 0.86 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 127.042 2.137 . . . . 4.81 112.395 -176.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . 0.417 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 18.9 p -77.34 -35.58 54.58 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 126.669 1.988 . . . . 2.99 111.485 -167.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.3 -41.65 95.11 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 119.773 1.17 . . . . 1.72 111.509 176.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . 0.406 ' ND2' ' H ' ' B' ' 154' ' ' SER . 35.0 t-20 -66.62 -55.82 13.53 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.955 1.302 . . . . 3.01 111.346 173.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -53.36 -39.36 64.12 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.573 1.323 . . . . 5.0 114.573 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -60.34 -33.6 72.63 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 120.603 1.547 . . . . 3.08 113.511 177.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -56.21 -28.16 57.31 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 118.148 -0.929 . . . . 1.05 113.095 175.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.73 -48.68 63.19 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 118.757 0.708 . . . . 0.92 111.657 169.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -65.88 -30.87 71.54 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.174 0.99 . . . . 2.22 113.174 -173.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 23.5 mtmt -58.16 -30.38 66.34 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.19 0.905 . . . . 3.45 113.351 171.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 5.9 mt -80.77 -42.51 21.65 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.145 0.978 . . . . 1.02 111.742 174.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 16.1 mm -58.12 -44.73 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 CA-C-N 118.556 0.617 . . . . 1.08 110.701 -173.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -56.49 -42.23 77.94 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.655 0.613 . . . . 2.58 112.655 177.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -65.57 -25.8 67.58 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.504 1.121 . . . . 2.79 113.275 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -98.24 -37.47 9.66 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.888 1.275 . . . . 2.65 113.131 -177.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -65.69 -22.45 66.63 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 120.904 -1.122 . . . . 3.24 112.418 165.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.57 -23.54 62.62 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 114.729 1.381 . . . . 2.01 114.729 164.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -118.31 -9.86 10.33 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.853 1.797 . . . . 2.53 115.853 -169.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -140.83 129.44 22.76 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 120.887 1.676 . . . . 3.99 112.721 -171.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -64.09 70.41 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 126.993 2.117 . . . . 4.63 112.986 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 57.05 -1.75 0.11 Allowed Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.467 1.508 . . . . 3.96 114.209 -167.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . 0.453 HH11 HG11 ' B' ' 132' ' ' VAL . 15.3 mmt85 -69.39 144.53 53.36 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 118.675 1.237 . . . . 4.74 109.1 -172.067 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.7 mt -126.86 138.15 55.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 104.767 -2.309 . . . . 3.93 104.767 156.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . 0.41 ' C ' ' HE3' ' B' ' 133' ' ' LYS . 39.3 m -74.98 -100.31 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.663 -0.648 . . . . 2.21 110.086 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -151.85 -66.72 0.17 Allowed 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.278 -1.513 . . . . 2.42 109.339 166.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -22.2 -46.91 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 130.486 3.515 . . . . 3.22 114.808 149.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -48.63 -61.65 1.92 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.583 1.953 . . . . 4.8 115.291 169.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -54.85 -42.54 72.11 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 119.759 -1.838 . . . . 1.83 111.56 -178.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 18.6 t-105 -62.09 -44.75 95.98 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.959 0.903 . . . . 0.95 111.509 178.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 90.6 m -61.26 -44.93 96.44 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.956 1.702 . . . . 2.45 111.302 174.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.7 mt -62.28 -32.67 73.42 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 117.32 -1.324 . . . . 1.08 112.794 177.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 26.4 mm -52.94 -42.13 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 121.556 1.98 . . . . 0.65 110.684 173.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.82 -9.86 35.55 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 125.153 1.358 . . . . 0.68 115.115 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -83.67 -21.67 57.49 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-N 119.023 1.412 . . . . 0.86 113.528 169.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.7 mp -100.12 -52.1 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 118.771 1.285 . . . . 0.8 109.187 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 18.2 m -75.46 58.89 1.05 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.395 2.278 . . . . 1.41 109.269 166.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -141.94 -70.54 0.03 OUTLIER Glycine 0 CA--C 1.526 0.725 0 C-N-CA 126.183 1.849 . . . . 0.93 110.15 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.23 -51.67 3.35 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.959 2.439 . . . . 1.13 112.051 175.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 1.8 pp -81.64 -13.74 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 113.038 0.755 . . . . 1.31 113.038 -174.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.26 -31.64 72.12 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.221 0.822 . . . . 1.07 113.221 -170.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.62 -46.82 77.33 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.538 -0.726 . . . . 2.93 112.558 167.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.9 tt -60.17 -34.62 73.83 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.588 -0.72 . . . . 1.4 111.379 -172.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 62.3 mt -51.46 -61.91 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.65 1.18 . . . . 1.07 109.853 171.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -59.47 -36.15 75.45 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.835 0.68 . . . . 1.97 112.835 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.345 3.1 pt-20 -80.19 -22.29 42.06 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 112.746 0.647 . . . . 2.99 112.746 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -70.61 -39.87 73.5 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 125.003 1.321 . . . . 2.82 113.617 167.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -53.54 -40.81 65.81 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 119.918 1.235 . . . . 2.52 110.506 175.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -48.13 76.62 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.267 1.027 . . . . 3.24 110.936 177.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -69.43 -10.93 60.16 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.725 1.009 . . . . 5.72 113.725 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 5.8 m -105.86 7.14 32.11 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.921 1.688 . . . . 6.64 112.221 175.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 67.9 m -84.11 6.48 22.14 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 115.167 1.543 . . . . 9.32 115.167 -172.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 92.7 p . . . . . 0 C--O 1.248 1.02 0 C-N-CA 125.13 1.372 . . . . 11.46 113.014 -173.926 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 CA--C 1.504 -0.808 0 N-CA-C 107.104 -1.443 . . . . 10.64 107.104 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -140.33 -13.28 1.03 Allowed 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 114.337 1.236 . . . . 9.19 114.337 -148.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 33.1 t 135.07 -66.5 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.501 1 C-N-CA 132.02 4.128 . . . . 4.57 104.505 -157.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -58.88 147.18 34.8 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 124.881 1.272 . . . . 2.18 111.148 159.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.0 p -75.13 165.75 24.73 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.185 0.594 . . . . 1.05 111.962 -175.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -58.68 -44.98 90.39 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.445 0.698 . . . . 2.7 110.643 173.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.87 -38.61 86.17 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.194 1.398 . . . . 0.94 110.134 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -73.09 -53.79 10.16 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.085 -1.01 . . . . 2.95 110.931 -177.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.0 mmtp -54.82 -33.32 61.45 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.777 -1.202 . . . . 4.84 112.296 168.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.795 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.95 -45.09 83.03 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 117.955 -1.022 . . . . 0.75 112.425 169.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.6 t -58.53 -38.62 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-N 120.745 1.611 . . . . 0.89 110.458 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.7 mt -56.34 -52.95 45.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-O 118.042 -0.98 . . . . 1.05 111.323 165.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -61.52 -33.93 59.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 120.759 1.618 . . . . 0.73 114.094 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.19 -36.48 79.64 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 120.424 -1.422 . . . . 1.01 111.124 172.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 43.9 t -74.35 -34.94 38.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 123.707 0.803 . . . . 0.68 110.855 178.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.55 -53.8 54.05 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.897 1.279 . . . . 3.45 111.122 164.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.465 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 21.0 t-20 -52.93 -28.92 25.71 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.83 1.418 . . . . 3.55 114.83 -178.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -81.33 -61.75 1.85 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.121 0.785 . . . . 2.24 113.121 168.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -64.0 -29.12 70.3 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.736 0.643 . . . . 1.81 112.736 -167.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.465 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 12.5 ptmt -51.36 -27.19 9.14 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.867 1.062 . . . . 2.34 113.867 173.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -94.95 -8.97 35.44 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 115.362 1.616 . . . . 2.68 115.362 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.7 m -99.68 -148.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 CA-C-N 120.312 1.415 . . . . 2.5 109.606 167.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.5 m -141.69 98.34 3.32 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 119.983 -1.698 . . . . 3.63 110.38 165.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.528 ' HE3' ' CZ ' ' A' ' 26' ' ' TYR . 49.2 tttp 66.64 -70.74 0.1 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 128.304 2.641 . . . . 5.45 115.154 167.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.528 ' CZ ' ' HE3' ' A' ' 25' ' ' LYS . 18.0 m-85 -114.71 -63.59 1.43 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.696 1.198 . . . . 6.6 109.095 172.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.4 m 65.5 -57.99 0.3 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 127.71 2.404 . . . . 4.69 114.867 176.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 64.1 mt 67.71 -38.85 0.37 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 130.311 3.445 . . . . 6.48 115.6 162.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -152.74 -33.81 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 C-N-CA 127.872 2.469 . . . . 4.3 110.655 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -82.0 53.01 2.09 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.258 1.023 . . . . 7.84 111.131 167.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -74.86 138.79 42.72 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.761 1.023 . . . . 8.54 113.761 -170.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 53.2 tttt -90.24 -5.15 56.67 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.132 0.79 . . . . 11.38 113.132 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 15.4 tt -91.87 138.55 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 123.776 0.831 . . . . 3.19 109.115 171.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.8 t -113.36 163.53 14.73 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.729 0.776 . . . . 2.3 110.623 167.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -53.63 -27.66 28.44 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.385 1.074 . . . . 4.62 113.696 168.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.9 p -72.36 -25.81 61.67 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.695 0.998 . . . . 2.36 113.695 172.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 m -78.08 -49.1 14.59 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.805 0.842 . . . . 1.54 111.257 -175.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -48.07 -57.61 5.58 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.798 1.239 . . . . 2.24 112.024 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 13.4 ptt85 -59.23 -15.53 15.82 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.011 1.115 . . . . 4.29 114.011 -178.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -109.66 -26.05 10.09 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 114.513 1.301 . . . . 3.33 114.513 -176.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 10.5 tmm? -53.06 -45.48 68.13 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 109.003 -0.74 . . . . 1.7 109.003 151.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.8 mt -64.1 -11.77 33.04 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.114 1.524 . . . . 1.25 115.114 172.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -101.23 -23.3 14.45 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.1 0.96 . . . . 2.38 113.582 172.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -99.71 -41.28 7.36 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.257 1.206 . . . . 1.71 114.257 178.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -100.95 -20.45 15.43 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.89 1.276 . . . . 3.11 114.356 -168.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.5 mt -118.48 41.4 2.98 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.534 1.534 . . . . 2.48 111.406 165.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -70.72 -15.94 62.74 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.648 1.351 . . . . 1.46 114.648 -172.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -94.59 -15.44 24.06 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.547 1.067 . . . . 1.83 112.542 -170.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.2 mmm -80.64 14.62 2.02 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 126.153 1.781 . . . . 1.93 114.703 174.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.3 mp -99.01 128.37 45.13 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.758 2.023 . . . . 3.01 111.914 -176.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -109.49 -1.94 17.98 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.722 1.209 . . . . 4.58 112.78 169.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -177.5 170.06 2.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 129.758 3.223 . . . . 4.32 106.387 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -31.83 -39.08 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 125.329 1.452 . . . . 2.37 112.573 147.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.13 -41.08 52.88 Favored Glycine 0 N--CA 1.473 1.16 0 C-N-CA 128.806 3.098 . . . . 1.68 115.608 -171.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -59.22 -41.17 88.03 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 117.874 0.837 . . . . 3.47 110.563 172.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 74.8 mtm-85 -73.5 -36.58 65.78 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 118.169 -0.919 . . . . 4.85 112.79 172.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.3 mtmm -54.88 -28.94 54.11 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 121.485 1.948 . . . . 5.06 112.516 171.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.12 -19.16 60.67 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 115.592 1.701 . . . . 1.23 115.592 170.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.87 -52.67 9.84 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.565 1.146 . . . . 0.81 110.191 161.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -66.42 -31.33 72.02 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.984 0.914 . . . . 2.16 112.493 -170.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.8 ptmm? -55.76 -25.0 38.63 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.302 1.223 . . . . 3.54 114.302 166.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 12.0 mt -84.92 -43.09 14.37 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.31 1.044 . . . . 0.78 111.379 172.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.7 mm -51.83 -39.74 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.102 1.361 . . . . 0.8 112.12 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -69.91 -30.13 67.47 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.348 1.459 . . . . 1.91 113.899 177.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -85.66 -23.75 27.34 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.09 1.756 . . . . 3.34 112.742 175.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.14 -26.09 68.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.868 1.267 . . . . 4.01 112.456 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -67.11 -13.25 61.76 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.485 1.914 . . . . 2.8 114.499 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -78.69 -6.11 54.89 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.192 0.812 . . . . 4.06 113.192 166.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -132.07 -34.54 1.26 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.78 1.232 . . . . 3.92 114.192 -169.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.8 m170 -110.28 67.78 0.65 Allowed 'General case' 0 CA--C 1.548 0.899 0 O-C-N 120.345 -1.472 . . . . 4.37 114.764 -165.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -74.44 67.17 1.44 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.564 1.545 . . . . 4.32 111.996 173.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.67 -40.0 0.94 Allowed Glycine 0 CA--C 1.532 1.147 0 C-N-CA 126.285 1.898 . . . . 2.52 113.502 -177.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -68.14 76.51 0.24 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 127.924 2.489 . . . . 8.47 110.369 173.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.7 mm -65.58 139.01 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 O-C-N 121.425 -0.797 . . . . 2.73 109.814 171.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.7 t -91.92 167.27 12.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.414 1.086 . . . . 1.66 112.864 176.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -72.72 -57.8 3.83 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.752 0.787 . . . . 2.08 109.731 160.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.09 -35.81 62.5 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.933 2.093 . . . . 3.37 112.946 -167.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -73.23 -22.89 60.33 Favored 'General case' 0 C--O 1.223 -0.318 0 N-CA-C 113.722 1.008 . . . . 5.94 113.722 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -57.01 -48.81 77.59 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 119.552 -1.968 . . . . 2.08 110.51 166.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.7 t-105 -67.2 -41.99 84.91 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.691 -0.671 . . . . 0.85 111.502 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.62 -41.66 92.45 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 119.342 0.973 . . . . 2.74 112.049 171.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.66 -37.48 78.84 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.524 1.056 . . . . 0.88 112.525 176.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 40.0 mm -55.06 -42.82 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 CA-C-N 120.7 1.591 . . . . 0.85 111.802 173.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.97 -27.63 73.62 Favored Glycine 0 CA--C 1.531 1.063 0 CA-C-N 118.54 0.609 . . . . 1.05 112.588 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.25 -20.38 71.22 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-N 118.164 0.982 . . . . 0.73 113.983 177.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 mp -91.74 -50.07 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.512 1.125 . . . . 0.85 110.107 162.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 2.8 m -81.96 46.36 1.0 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.441 2.297 . . . . 1.68 112.097 -171.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.59 -70.97 0.57 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 126.084 1.802 . . . . 1.08 110.514 175.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -61.61 -45.28 18.18 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 123.012 2.475 . . . . 1.06 112.82 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.3 pt -73.12 -14.91 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 114.435 1.272 . . . . 1.06 114.435 177.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.6 -40.57 83.61 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.094 0.861 . . . . 1.07 113.198 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -40.17 91.3 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 117.741 -1.584 . . . . 2.8 111.663 171.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -39.07 91.59 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 124.053 0.941 . . . . 1.47 111.353 -175.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -53.9 -58.52 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 123.982 0.913 . . . . 1.08 110.893 166.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -63.44 -36.68 84.53 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.946 -1.096 . . . . 1.85 113.08 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.279 2.6 pt-20 -81.29 -13.02 58.89 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.822 0.849 . . . . 3.08 112.222 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.44 ' C ' ' H ' ' A' ' 99' ' ' GLN . 0.4 OUTLIER -72.82 -35.17 67.24 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 125.082 1.353 . . . . 2.12 113.232 165.094 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -71.54 16.62 0.1 Allowed 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 123.935 1.826 . . . . 3.56 111.505 168.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.44 ' H ' ' C ' ' A' ' 97' ' ' GLN . 4.2 mm-40 -130.23 -72.07 0.58 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.068 1.747 . . . . 2.56 109.184 174.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 53.95 -2.72 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.284 1 C-N-CA 131.932 4.093 . . . . 4.62 116.43 171.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.7 t -162.06 28.37 0.12 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.411 1.484 . . . . 6.96 110.81 -165.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 31.3 t -173.89 97.13 0.1 Allowed 'General case' 0 C--O 1.236 0.375 0 C-N-CA 126.844 2.057 . . . . 7.98 106.019 -171.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--O 1.251 1.17 0 C-N-CA 127.875 2.47 . . . . 11.6 111.913 -178.292 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 8.2 m . . . . . 0 CA--C 1.5 -0.955 0 N-CA-C 108.412 -0.959 . . . . 10.7 108.412 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -136.88 -15.71 1.53 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 118.206 -1.398 . . . . 8.35 113.828 -125.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 27.6 t 158.9 -55.93 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 130.189 3.396 . . . . 4.25 106.944 -168.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -54.51 137.6 42.54 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 115.459 -0.791 . . . . 2.22 109.923 160.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.9 p -73.17 162.88 28.9 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 118.138 0.427 . . . . 0.88 110.994 -175.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 35.1 tp10 -60.14 -43.93 95.32 Favored 'General case' 0 C--O 1.221 -0.431 0 O-C-N 121.359 -0.838 . . . . 2.1 111.196 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.87 -41.75 71.2 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.48 1.512 . . . . 0.89 110.694 175.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -72.91 -54.81 7.73 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.421 1.088 . . . . 3.04 112.249 -175.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -56.27 -26.9 53.44 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.89 1.276 . . . . 4.87 112.239 168.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.795 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -76.73 -40.34 48.91 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 120.451 -1.406 . . . . 0.97 112.608 169.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 37.3 t -58.81 -30.42 42.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 120.924 1.693 . . . . 0.91 110.624 171.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 70.7 mt -58.22 -57.4 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 119.448 1.022 . . . . 1.19 110.763 164.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 41.2 t -55.26 -38.56 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 125.656 1.582 . . . . 0.76 114.617 177.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.7 mp -66.37 -33.96 76.88 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.408 -1.432 . . . . 1.17 111.858 174.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 52.5 t -78.45 -33.59 17.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.157 0.583 . . . . 0.71 110.768 -178.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.0 tm-20 -56.41 -51.58 67.85 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.797 0.839 . . . . 3.6 111.563 164.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . 0.47 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 19.2 t-20 -52.65 -29.55 26.91 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.927 1.455 . . . . 3.6 114.927 -177.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -82.37 -60.18 2.29 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.017 0.747 . . . . 2.08 113.017 170.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -63.11 -29.3 70.69 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 119.01 -0.519 . . . . 1.81 112.217 -166.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 10.7 ptmt -51.31 -25.44 5.88 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.931 1.292 . . . . 2.14 114.137 172.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -98.24 -9.41 25.62 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 115.083 1.512 . . . . 2.8 115.083 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 16.8 m -101.46 -150.16 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 CA-C-N 119.818 1.19 . . . . 2.45 109.158 166.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 66.3 m -143.66 99.97 3.51 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 119.855 -1.778 . . . . 3.81 111.261 168.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.514 ' HE3' ' CZ ' ' B' ' 129' ' ' TYR . 44.1 tttp 64.55 -80.2 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 127.461 2.305 . . . . 5.16 114.323 168.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . 0.514 ' CZ ' ' HE3' ' B' ' 128' ' ' LYS . 19.3 m-85 -110.46 -49.74 3.03 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.074 0.949 . . . . 6.58 111.287 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 63.4 m 63.23 -61.82 0.14 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 127.513 2.325 . . . . 4.66 115.382 170.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 62.9 mt 69.26 -48.28 0.59 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 130.603 3.561 . . . . 6.82 114.124 168.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 7.2 p -153.97 -32.36 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 127.882 2.473 . . . . 4.45 110.971 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -77.39 67.83 3.39 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.922 0.889 . . . . 7.84 110.887 163.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -79.26 162.98 25.31 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.16 0.984 . . . . 8.72 112.736 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -122.6 -2.76 8.85 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.28 1.032 . . . . 11.0 112.994 179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 19.9 tt -89.7 132.71 33.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.105 0.962 . . . . 3.27 109.754 176.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 30.2 t -94.04 149.15 21.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.6 0.714 . . . . 2.4 110.677 166.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 57.9 pttt -52.43 -20.56 2.92 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.772 1.229 . . . . 4.39 113.975 164.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 92.8 p -81.56 -21.31 38.55 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.354 1.242 . . . . 2.07 114.354 169.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 14.0 m -78.06 -45.4 23.65 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.916 -1.115 . . . . 1.22 111.408 -175.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -47.07 -58.36 4.09 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.625 1.17 . . . . 2.34 111.516 178.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 18.1 ptt85 -58.57 -14.98 9.44 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.438 1.495 . . . . 3.83 113.652 -178.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -107.86 -31.01 8.19 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 114.706 1.373 . . . . 2.84 114.706 -178.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . 0.424 ' CG ' HD21 ' B' ' 121' ' ' ASN . 7.4 tmm? -52.52 -44.42 65.72 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.651 -0.499 . . . . 1.43 109.651 156.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.5 mt -59.9 -22.34 62.25 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.931 1.692 . . . . 1.01 114.182 173.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -94.65 -15.2 24.18 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.411 1.084 . . . . 2.42 112.979 177.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.17 -41.54 5.11 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.91 1.078 . . . . 1.66 113.91 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -100.24 -15.99 17.89 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 125.369 1.468 . . . . 3.11 113.899 -171.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 96.9 mt -125.38 38.33 4.2 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.296 1.839 . . . . 2.44 111.966 166.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -69.57 -17.73 63.58 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.827 1.417 . . . . 1.3 114.827 -172.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -88.93 -0.79 57.7 Favored 'General case' 0 CA--C 1.555 1.153 0 O-C-N 120.565 -1.334 . . . . 1.64 112.375 -171.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 4.5 mmm -101.71 12.97 36.23 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.273 2.229 . . . . 1.95 113.447 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 9.2 mp -96.71 128.64 43.85 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.734 2.014 . . . . 3.02 111.412 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 33.0 t -112.23 -1.75 15.1 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.117 1.367 . . . . 4.75 112.808 169.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -178.04 170.8 1.81 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 129.751 3.22 . . . . 4.5 106.917 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.2 m -33.24 -40.0 0.06 Allowed 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 125.133 1.373 . . . . 2.68 111.915 148.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.09 -42.49 39.95 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 128.394 2.902 . . . . 1.73 115.389 -171.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -58.35 -43.56 88.38 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 117.642 0.721 . . . . 3.45 110.78 172.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 83.2 mtm-85 -69.68 -39.52 76.92 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 118.244 -0.884 . . . . 4.94 112.467 172.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 17.2 mtmm -54.16 -29.58 46.12 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 121.35 1.886 . . . . 4.95 112.299 174.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -75.29 -19.37 59.72 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 115.282 1.586 . . . . 1.18 115.282 171.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -76.37 -54.29 6.96 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.141 1.376 . . . . 0.76 110.395 161.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -66.43 -31.82 72.8 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.87 0.868 . . . . 2.01 112.394 -169.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 6.0 ptmm? -56.17 -25.56 47.22 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.774 1.028 . . . . 3.48 113.774 167.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.6 mt -84.54 -41.78 16.15 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.216 1.007 . . . . 0.75 111.391 174.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 20.3 mm -54.57 -43.1 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.385 1.074 . . . . 0.81 111.233 -177.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -65.09 -27.87 69.06 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.861 1.264 . . . . 1.74 113.68 176.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -85.21 -24.22 27.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.956 1.303 . . . . 3.41 112.782 174.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 14.2 tp -66.88 -23.85 66.05 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.596 1.158 . . . . 3.83 112.355 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.46 -25.08 34.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.223 2.209 . . . . 3.14 114.326 166.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.2 -9.08 59.04 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 113.601 0.963 . . . . 3.74 113.601 174.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -130.61 -33.05 1.66 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.259 1.207 . . . . 3.46 114.259 -166.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 22.4 m170 -114.21 74.76 0.89 Allowed 'General case' 0 CA--C 1.548 0.88 0 O-C-N 120.463 -1.398 . . . . 4.18 114.749 -168.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 30.9 t0 -82.67 76.76 9.51 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.002 0.921 . . . . 4.06 110.824 166.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.61 -41.5 1.2 Allowed Glycine 0 N--CA 1.478 1.46 0 C-N-CA 126.518 2.009 . . . . 2.67 114.598 177.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -68.52 82.83 0.27 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 128.064 2.546 . . . . 8.64 109.967 171.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 26.6 mm -72.41 136.62 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 O-C-N 120.877 -1.14 . . . . 2.71 109.519 171.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 8.4 t -94.06 137.67 33.0 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.457 1.103 . . . . 1.79 111.275 170.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -50.14 -54.49 20.36 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.487 1.115 . . . . 2.22 110.28 171.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.65 -30.67 65.59 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.813 2.045 . . . . 3.49 112.278 -170.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -74.29 -22.93 59.06 Favored 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 113.049 0.759 . . . . 5.91 113.049 -177.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -58.63 -47.32 84.8 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 119.503 -1.998 . . . . 2.1 110.471 165.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 19.0 t-105 -68.59 -37.61 79.97 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.144 -0.931 . . . . 0.85 111.724 -173.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 82.3 p -63.09 -47.09 84.35 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 119.649 1.113 . . . . 2.6 110.689 171.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.29 -37.71 81.36 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.087 -0.959 . . . . 0.88 112.85 -178.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 39.6 mm -54.62 -41.89 57.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 CA-C-N 120.589 1.54 . . . . 0.83 111.467 173.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.55 -26.31 73.69 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 123.684 0.659 . . . . 1.01 112.789 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -67.52 -19.99 71.38 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-N 118.097 0.949 . . . . 0.69 113.326 177.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.8 mp -96.71 -46.47 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 CA-C-N 118.284 1.042 . . . . 0.85 110.132 165.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 2.9 m -81.15 39.43 0.51 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 127.042 2.137 . . . . 1.7 112.351 -175.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -108.97 -70.62 0.68 Allowed Glycine 0 CA--C 1.529 0.96 0 C-N-CA 126.149 1.833 . . . . 0.99 110.174 173.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -61.02 -43.39 30.36 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.057 2.505 . . . . 0.94 113.029 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 11.1 pt -75.15 -17.56 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 114.454 1.279 . . . . 1.04 114.454 177.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -58.36 -42.51 87.12 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.548 1.067 . . . . 1.01 113.588 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.29 -41.62 89.41 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.979 1.263 . . . . 2.98 111.993 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -40.22 90.78 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 123.997 0.919 . . . . 1.72 111.714 -176.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 88.0 mt -52.85 -63.09 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 123.591 0.756 . . . . 1.02 110.041 168.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -59.09 -37.19 76.54 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.292 -0.88 . . . . 1.78 112.906 -175.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.295 2.5 pt-20 -78.02 -18.29 56.05 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 112.385 0.513 . . . . 3.21 112.385 178.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.99 -35.02 59.75 Favored 'General case' 0 C--N 1.344 0.334 0 C-N-CA 125.392 1.477 . . . . 2.1 114.611 169.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -65.19 -1.13 2.03 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 122.801 1.286 . . . . 2.98 111.736 171.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -112.89 -70.16 0.82 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.001 1.721 . . . . 2.83 109.597 177.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 50.18 1.63 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 131.695 3.998 . . . . 4.33 116.413 177.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 44.5 t -150.47 31.08 0.66 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.297 1.839 . . . . 7.05 110.247 -169.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 27.1 t -174.83 103.41 0.09 Allowed 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 126.68 1.992 . . . . 8.13 105.758 -174.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 17.7 t . . . . . 0 C--O 1.249 1.068 0 C-N-CA 128.395 2.678 . . . . 11.79 111.082 172.565 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.3 m . . . . . 0 CA--C 1.502 -0.883 0 N-CA-C 108.841 -0.8 . . . . 10.19 108.841 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -130.19 -12.33 4.08 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 118.722 -1.191 . . . . 6.78 113.669 -130.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.7 t 73.09 -18.25 0.37 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 127.825 2.45 . . . . 5.19 115.858 166.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.481 ' HA ' ' CD2' ' B' ' 151' ' ' HIS . 50.8 m-85 -32.85 100.46 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 126.686 1.994 . . . . 2.09 115.948 -172.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.6 p -65.5 158.27 27.37 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.164 0.585 . . . . 0.98 109.975 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -60.5 -31.05 70.12 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 117.885 -1.055 . . . . 3.73 110.908 172.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.22 -41.3 85.94 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.057 1.299 . . . . 0.83 111.278 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -55.99 9.87 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.886 0.874 . . . . 2.92 110.722 178.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -45.05 -43.82 9.68 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.762 1.625 . . . . 4.7 113.593 166.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.875 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.08 -45.86 83.54 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.553 1.141 . . . . 0.51 113.088 173.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -60.99 -41.06 87.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 120.248 1.385 . . . . 0.66 110.608 173.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.6 mt -53.28 -49.7 51.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-N 119.187 0.903 . . . . 0.8 111.331 166.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.4 t -65.6 -35.86 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 119.707 1.139 . . . . 0.54 112.783 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp -65.45 -41.78 93.09 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 120.862 -1.149 . . . . 0.97 111.338 172.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 41.0 t -67.4 -43.34 87.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 125.455 1.502 . . . . 0.59 111.917 176.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -53.69 -51.96 61.58 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 119.119 0.872 . . . . 3.23 109.835 168.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.503 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 54.4 t30 -64.13 -23.11 67.2 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.035 1.124 . . . . 2.07 114.035 -169.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -76.24 -61.1 2.06 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.7 0.8 . . . . 2.33 112.335 168.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.6 m-85 -67.49 -21.84 65.49 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.984 1.105 . . . . 1.79 113.984 -170.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.503 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 1.6 ptmt -53.69 -21.94 8.01 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.342 1.428 . . . . 2.15 112.975 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -89.98 8.14 33.93 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.453 1.901 . . . . 2.48 115.023 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.0 m -141.66 171.56 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.136 1.374 . . . . 2.4 110.885 173.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.05 -8.53 58.65 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-O 115.547 -2.168 . . . . 3.9 116.24 -177.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' B' ' 199' ' ' GLU . 2.3 ttpm? 123.09 -67.0 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 130.23 3.412 . . . . 5.34 113.778 177.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -94.97 8.88 41.44 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.326 1.45 . . . . 8.53 113.569 -176.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.2 p -115.4 37.95 3.39 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.054 -1.654 . . . . 4.5 115.099 -152.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.5 mt -25.36 -42.49 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 129.189 2.996 . . . . 6.66 117.412 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.1 t -150.07 60.19 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 126.703 2.001 . . . . 4.76 109.658 175.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -124.88 -0.49 7.93 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.272 1.429 . . . . 7.89 114.634 175.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 141.96 132.71 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 1 C-N-CA 132.267 4.227 . . . . 8.34 108.89 169.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.0 pttm -174.95 -172.54 0.62 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.312 1.445 . . . . 6.33 111.176 -158.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 16.3 pt -86.7 -178.37 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.968 1.707 . . . . 3.4 113.87 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.2 m -125.72 156.82 38.77 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.711 2.004 . . . . 2.57 109.523 171.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -58.07 -21.8 47.43 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 115.343 1.609 . . . . 2.02 115.343 -164.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.4 m -47.85 -42.25 26.05 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 121.269 -0.894 . . . . 2.04 113.304 165.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 41.9 m -74.36 -11.6 60.3 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.534 1.309 . . . . 1.89 114.534 -172.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -69.82 -56.71 6.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 121.045 1.748 . . . . 2.14 111.444 165.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -61.78 -26.04 67.84 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.466 0.543 . . . . 2.3 112.466 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -71.52 -50.59 29.86 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.671 1.189 . . . . 3.88 110.625 170.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -59.96 -43.04 95.3 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.886 1.674 . . . . 1.33 112.733 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 31.8 mt -50.69 -36.86 38.06 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.907 1.283 . . . . 1.48 112.434 168.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -83.88 -20.21 33.47 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 118.108 -0.949 . . . . 2.56 112.771 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.52 -45.57 19.04 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.68 1.582 . . . . 2.82 112.117 166.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -90.22 -41.07 11.8 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.926 1.084 . . . . 3.47 113.926 -167.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.4 mt -107.0 28.68 7.78 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.216 1.007 . . . . 2.44 112.803 -170.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -67.63 23.83 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 117.059 2.244 . . . . 1.99 117.059 -171.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.466 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 0.2 OUTLIER -127.65 -42.88 1.59 Allowed 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.267 -1.521 . . . . 2.03 111.731 -178.372 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.9 ptp -77.54 -19.97 54.91 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.667 1.187 . . . . 2.77 113.555 164.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.1 tt -99.92 104.9 16.57 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.254 1.422 . . . . 2.95 111.046 -175.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.3 t -71.63 109.28 5.45 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.581 -0.699 . . . . 5.22 111.3 168.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 49.79 -88.39 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.68 1.992 . . . . 7.26 114.062 136.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 71.3 p -130.89 -19.91 2.87 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.439 1.495 . . . . 3.47 112.33 167.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.64 -41.44 99.59 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 119.976 1.262 . . . . 2.7 112.081 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -82.88 -48.98 10.14 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 117.552 0.676 . . . . 3.55 112.345 165.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -55.13 -37.13 66.52 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.901 1.445 . . . . 4.97 114.901 -172.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.4 mmmp? -63.84 -31.58 72.81 Favored 'General case' 0 N--CA 1.479 1.024 0 O-C-N 120.883 -1.136 . . . . 3.36 114.015 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.77 -40.19 96.08 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 122.96 0.504 . . . . 2.1 111.653 168.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.86 98.68 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.131 0.572 . . . . 1.27 112.291 172.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -54.67 -29.66 53.27 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.256 1.022 . . . . 2.58 112.626 174.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -24.72 59.92 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.177 -1.577 . . . . 6.05 114.004 175.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 15.4 mt -65.82 -43.0 89.88 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 120.523 -0.471 . . . . 1.09 110.973 163.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 24.5 mm -59.61 -48.32 87.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 123.205 0.602 . . . . 0.94 110.739 -177.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -59.32 -38.13 79.53 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.092 0.473 . . . . 1.8 112.258 178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 -65.92 -30.46 71.05 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.782 0.833 . . . . 3.49 113.071 175.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.16 -30.69 22.28 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.351 1.46 . . . . 1.95 111.827 178.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -64.87 -32.38 74.06 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.441 1.496 . . . . 3.15 113.147 166.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.0 -23.31 66.55 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.122 1.156 . . . . 2.2 114.122 170.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -122.71 -7.84 8.5 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.839 1.792 . . . . 2.45 115.839 -167.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.35 117.97 13.05 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.302 1.865 . . . . 3.44 112.757 -177.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -78.6 63.63 3.44 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.908 2.483 . . . . 4.04 111.926 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.78 7.87 62.6 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.344 0.974 . . . . 2.99 114.228 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.8 mmt85 -70.12 175.16 4.72 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.268 1.427 . . . . 5.63 111.957 176.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 25.0 mm -140.02 150.18 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 126.191 1.797 . . . . 2.35 106.853 161.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.7 t -127.0 165.16 19.96 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.536 1.534 . . . . 1.52 111.902 169.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -67.62 -51.78 46.14 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 122.54 1.162 . . . . 2.02 111.93 175.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -25.02 67.39 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 127.422 2.289 . . . . 3.4 113.914 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.6 -59.26 5.45 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.049 1.339 . . . . 3.46 111.888 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -58.06 -42.31 85.21 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.063 -1.023 . . . . 2.33 111.466 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 20.9 t-105 -62.33 -48.27 80.55 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.922 -0.561 . . . . 0.62 111.767 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.1 t -69.82 -32.75 71.35 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 117.637 -1.173 . . . . 1.72 111.718 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 30.9 mt -66.93 -40.94 87.76 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 117.798 -1.096 . . . . 0.67 112.553 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 12.1 mm -50.26 -44.58 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-N 120.174 1.352 . . . . 0.75 111.688 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.05 -19.13 50.3 Favored Glycine 0 CA--C 1.539 1.545 0 CA-C-O 119.459 -0.634 . . . . 0.63 114.579 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.45 -23.29 60.84 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 118.72 1.26 . . . . 0.6 114.013 177.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -94.98 -44.97 13.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-N 119.446 1.623 . . . . 1.04 109.647 165.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.3 m -83.44 35.43 0.5 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.055 2.542 . . . . 1.48 112.035 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -93.59 -78.9 1.42 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 125.009 1.29 . . . . 1.0 110.761 172.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.2 -41.27 16.86 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.885 2.39 . . . . 1.16 112.263 -176.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -70.17 -12.95 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 113.761 1.023 . . . . 1.2 113.761 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.78 -43.66 92.54 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.343 0.974 . . . . 0.93 111.816 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -61.45 -34.23 75.07 Favored 'General case' 0 C--O 1.221 -0.397 0 O-C-N 120.442 -1.411 . . . . 2.69 112.291 171.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.1 tt -66.88 -41.08 87.85 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.924 0.89 . . . . 1.24 111.271 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.2 mt -51.37 -62.58 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-O 121.642 0.734 . . . . 0.93 109.541 162.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -60.41 -27.77 67.73 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.113 1.153 . . . . 1.92 114.113 -172.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.494 ' HA ' ' HE3' ' B' ' 128' ' ' LYS 0.305 3.9 pt-20 -89.45 -9.33 50.57 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.715 1.206 . . . . 3.16 112.769 178.664 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.439 ' C ' ' H ' ' A' ' 99' ' ' GLN . 5.5 tp-100 -89.48 -30.51 18.23 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.882 1.673 . . . . 3.51 111.826 169.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -63.99 6.27 0.18 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 126.849 2.059 . . . . 3.3 113.314 165.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.439 ' H ' ' C ' ' A' ' 97' ' ' GLN . 10.2 mm-40 -133.09 -77.32 0.49 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 126.153 1.781 . . . . 2.23 110.273 -173.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 58.2 -11.56 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.986 1 C-N-CA 131.934 4.094 . . . . 4.33 116.253 167.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 27.7 t -111.36 5.01 19.45 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.469 1.108 . . . . 7.53 113.656 -162.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 30.3 t -172.69 -15.73 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.793 1.637 . . . . 9.54 114.0 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.47 ' OXT' ' HE2' ' B' ' 128' ' ' LYS . 4.7 t . . . . . 0 C--O 1.254 1.333 0 C-N-CA 129.236 3.015 . . . . 11.04 109.19 173.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 26.6 m . . . . . 0 CA--C 1.505 -0.757 0 N-CA-C 109.174 -0.676 . . . . 10.18 109.174 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -128.56 -12.28 4.94 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 118.54 -1.264 . . . . 6.64 113.546 -131.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 7.1 t 71.45 -17.36 0.33 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.963 2.505 . . . . 4.92 115.806 166.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.466 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 46.5 m-85 -32.21 96.54 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.416 1.886 . . . . 2.29 115.554 -171.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 36.0 p -64.27 157.79 25.03 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.069 0.947 . . . . 1.06 109.871 178.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -59.59 -33.98 72.15 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-O 117.108 -1.425 . . . . 3.72 110.952 173.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.27 -43.29 95.29 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 120.641 1.564 . . . . 0.83 111.323 176.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -57.52 5.68 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.822 0.849 . . . . 2.95 110.598 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -42.79 -44.25 4.34 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.37 1.868 . . . . 4.75 114.278 164.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.875 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -65.27 -44.75 87.03 Favored 'General case' 0 C--O 1.223 -0.337 0 O-C-N 120.821 -1.175 . . . . 0.52 112.586 174.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.3 -42.66 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.936 1.244 . . . . 0.66 110.506 172.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 71.0 mt -53.03 -48.03 53.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.344 1.058 . . . . 0.75 110.57 168.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.3 t -66.58 -35.09 74.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.396 1.078 . . . . 0.62 112.82 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -67.87 -40.0 83.66 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 120.567 -1.333 . . . . 1.0 111.222 173.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 29.7 t -67.91 -38.48 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 126.036 1.734 . . . . 0.61 111.993 175.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -57.93 -53.05 62.57 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.153 0.981 . . . . 3.57 110.294 167.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . 0.42 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 27.0 t30 -66.57 -7.34 19.52 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.214 1.561 . . . . 2.11 115.214 -177.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -87.56 -65.43 1.02 Allowed 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.367 -0.833 . . . . 2.48 111.972 160.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -69.69 -22.31 63.43 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.921 1.452 . . . . 1.79 114.921 -166.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . 0.42 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 10.4 ptmt -53.78 -22.34 9.25 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 121.265 1.848 . . . . 2.14 113.436 177.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -84.39 7.82 18.3 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.641 1.976 . . . . 2.55 114.907 176.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 30.9 m -139.59 170.38 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.989 1.715 . . . . 2.5 110.161 170.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.77 -23.17 59.67 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 116.703 -1.617 . . . . 3.92 114.89 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 96' ' ' GLU . 0.4 OUTLIER 148.38 -57.93 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.24 1 C-N-CA 132.059 4.144 . . . . 5.26 112.515 -179.645 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -110.07 8.55 24.02 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.496 1.918 . . . . 8.53 113.224 -172.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 4.8 m -82.96 30.97 0.43 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.607 1.706 . . . . 4.81 115.607 -156.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 62.5 mt -35.97 -52.19 0.74 Allowed 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 128.064 2.546 . . . . 6.56 115.792 -162.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 3.9 t -139.2 59.36 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-O 123.806 1.765 . . . . 4.75 109.175 165.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -134.11 -2.55 2.85 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.448 1.899 . . . . 7.71 114.727 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 143.02 123.81 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.844 1 C-N-CA 132.114 4.166 . . . . 8.21 108.857 173.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -169.03 175.25 5.88 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.79 1.636 . . . . 6.32 109.847 -164.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 18.9 pt -76.23 -178.39 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 N-CA-C 114.821 1.415 . . . . 3.17 114.821 173.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 71.1 m -118.33 155.08 31.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.818 1.247 . . . . 2.64 109.867 165.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -50.92 -36.01 36.25 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.17 1.388 . . . . 1.95 114.144 -171.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 4.9 m -52.34 -17.41 1.16 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.811 2.044 . . . . 1.85 115.43 174.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 1.4 m -75.43 -37.33 60.48 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.502 1.121 . . . . 1.26 112.545 175.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -58.39 -49.74 76.16 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.277 1.031 . . . . 1.99 111.948 -175.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -55.82 -29.2 59.39 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.455 1.102 . . . . 2.23 113.77 175.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -86.69 -44.73 11.6 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.645 1.178 . . . . 3.88 111.365 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 2.7 tmm? -52.67 -45.77 66.92 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.182 0.593 . . . . 1.14 111.641 167.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 21.3 mt -55.51 -52.51 63.45 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.624 1.57 . . . . 1.5 112.869 170.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -61.09 -18.48 58.15 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.7 1.2 . . . . 2.22 113.406 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.29 -44.14 5.25 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.848 1.055 . . . . 2.23 113.848 177.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -79.42 -38.14 35.45 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.715 1.206 . . . . 3.59 113.626 -178.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.7 mt -111.81 28.08 9.08 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.421 0.897 . . . . 2.51 113.421 -169.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -71.09 9.71 0.68 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 116.689 2.107 . . . . 1.51 116.689 -165.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . 0.481 ' CD2' ' HA ' ' A' ' 5' ' ' TYR . 0.5 OUTLIER -108.01 -32.13 7.68 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 120.041 -1.662 . . . . 2.05 111.851 -173.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 21.1 ptp -83.01 -27.71 30.17 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.045 1.738 . . . . 2.79 112.473 159.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 5.5 tt -94.79 97.49 10.08 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.089 1.356 . . . . 3.2 110.749 -176.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 30.3 t -74.64 104.36 5.29 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.99 0.9 . . . . 5.2 110.416 167.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 54.75 -100.01 0.1 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.802 1.241 . . . . 7.89 112.809 138.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 41.5 p -130.75 14.29 5.36 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.86 1.664 . . . . 4.13 113.766 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -86.4 -64.7 1.44 Allowed Glycine 0 N--CA 1.466 0.663 0 N-CA-C 109.876 -1.29 . . . . 2.91 109.876 160.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -67.2 -46.34 74.19 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 118.409 -0.805 . . . . 3.77 111.753 -177.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 8.9 ttp180 -59.4 -22.91 62.11 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 120.691 1.587 . . . . 4.72 114.95 -176.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp -52.28 -38.1 57.37 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.888 1.222 . . . . 4.33 113.118 168.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -63.88 -48.03 78.27 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.824 0.45 . . . . 1.87 110.91 172.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -56.62 -49.37 75.16 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.523 0.601 . . . . 1.03 111.693 176.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -66.31 -33.0 74.76 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.726 0.811 . . . . 2.39 112.351 -175.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -47.25 82.04 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.004 -1.06 . . . . 6.7 112.894 167.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.67 -47.8 76.12 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.044 0.84 . . . . 1.32 111.019 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 38.9 mm -50.48 -51.64 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 123.404 0.682 . . . . 0.97 110.493 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -73.73 -31.03 63.16 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.322 0.582 . . . . 3.02 112.265 -173.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 38.2 m-20 -62.42 -27.47 69.12 Favored 'General case' 0 CA--C 1.555 1.165 0 N-CA-C 112.548 0.573 . . . . 4.18 112.548 169.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.47 -28.76 20.63 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.999 1.72 . . . . 2.17 111.54 177.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -63.75 -28.97 70.24 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.741 -1.224 . . . . 2.98 113.309 164.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -68.27 -14.07 62.72 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 114.345 1.239 . . . . 2.29 114.345 166.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -125.71 -13.3 6.47 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 116.628 2.084 . . . . 2.41 116.628 -170.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -139.88 122.35 16.15 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 122.057 2.208 . . . . 3.58 113.233 -174.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -79.07 66.06 4.41 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 127.514 2.325 . . . . 4.1 112.137 -175.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.1 5.57 66.17 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.731 1.157 . . . . 3.2 114.75 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 18.8 mmt85 -68.43 178.21 2.08 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.154 1.782 . . . . 5.69 112.415 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 21.5 mm -137.6 151.83 26.49 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 126.84 2.056 . . . . 2.61 105.461 158.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 9.8 t -132.46 164.05 27.41 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.22 1.408 . . . . 1.56 113.277 170.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -63.91 -55.46 22.52 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 122.881 1.324 . . . . 2.29 111.359 175.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -27.27 68.13 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.606 2.363 . . . . 3.53 113.71 178.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -57.04 -60.39 3.65 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.995 1.318 . . . . 3.39 111.153 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -55.42 -46.45 76.67 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.234 -0.916 . . . . 2.21 111.477 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 23.4 t-105 -62.64 -47.29 84.37 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.967 -0.54 . . . . 0.63 111.55 -177.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.5 t -70.7 -32.18 69.32 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 117.658 -1.163 . . . . 1.64 111.664 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 46.1 mt -67.33 -40.51 85.9 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-O 117.24 -1.362 . . . . 0.62 112.105 175.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 13.1 mm -49.03 -46.13 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 CA-C-N 120.691 1.587 . . . . 0.66 111.901 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -60.98 -19.6 56.77 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 123.997 0.808 . . . . 0.69 114.381 178.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -78.12 -18.37 76.68 Favored Glycine 0 CA--C 1.531 1.077 0 CA-C-N 118.687 1.244 . . . . 0.77 113.54 174.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -101.61 -48.17 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-N 119.482 1.641 . . . . 0.98 109.976 166.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 25.7 m -80.45 68.58 6.68 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 127.038 2.135 . . . . 1.39 109.45 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -129.67 -83.49 0.33 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 125.731 1.634 . . . . 0.91 110.961 177.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -61.89 -39.29 52.54 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 122.479 2.119 . . . . 1.24 111.656 178.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.95 -11.31 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 113.461 0.911 . . . . 1.27 113.461 177.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -67.12 -42.87 83.78 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.534 1.061 . . . . 0.87 111.293 177.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -61.42 -35.42 77.5 Favored 'General case' 0 C--O 1.22 -0.475 0 O-C-N 120.508 -1.37 . . . . 2.95 112.262 169.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.85 -43.7 95.34 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.149 0.98 . . . . 1.5 111.165 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 78.7 mt -50.17 -62.11 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-O 121.43 0.633 . . . . 0.95 109.824 163.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -58.67 -31.06 67.84 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.865 1.061 . . . . 2.09 113.865 -173.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . 0.434 ' HA ' ' HE3' ' A' ' 25' ' ' LYS 0.258 3.8 pt-20 -88.7 -12.28 42.79 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.691 1.196 . . . . 3.23 112.76 -179.416 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -84.28 -34.19 23.83 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.308 1.443 . . . . 3.77 111.252 169.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -63.19 2.93 0.31 Allowed 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 126.421 1.889 . . . . 3.25 113.222 166.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -128.21 -72.48 0.62 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.92 1.688 . . . . 2.5 111.21 -176.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 56.6 -8.68 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.867 1 C-N-CA 132.14 4.176 . . . . 4.18 116.513 170.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 31.1 t -126.03 1.6 7.26 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.183 1.179 . . . . 7.84 114.183 -162.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 38.8 t -152.58 10.88 0.5 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.919 1.288 . . . . 9.64 112.538 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . 0.404 ' OXT' ' HE2' ' A' ' 25' ' ' LYS . 14.0 t . . . . . 0 C--O 1.252 1.232 0 C-N-CA 130.994 3.718 . . . . 11.24 109.64 -159.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.8 m . . . . . 0 N--CA 1.472 0.655 0 CA-C-O 118.819 -0.61 . . . . 9.39 110.228 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -63.38 -134.69 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.366 0 O-C-N 124.431 1.082 . . . . 5.8 109.408 135.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 60.6 m -73.53 -33.96 64.99 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.245 -1.534 . . . . 3.86 112.021 178.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -55.23 113.75 1.51 Allowed 'General case' 0 C--O 1.241 0.607 0 C-N-CA 123.747 0.819 . . . . 2.67 112.861 -172.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.31 153.59 40.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.771 -0.826 . . . . 1.07 108.771 -176.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -59.81 -43.31 94.56 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-O 119.125 -0.464 . . . . 2.09 110.891 178.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.91 -44.44 94.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.086 1.754 . . . . 1.81 111.639 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -71.15 -53.8 13.27 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 125.837 1.655 . . . . 3.11 110.819 -175.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -58.55 -27.5 64.63 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.107 -0.996 . . . . 5.39 111.828 167.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.813 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -71.6 -37.39 70.97 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 119.474 -2.016 . . . . 0.57 111.72 172.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 91.4 t -60.41 -37.46 74.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.84 1.655 . . . . 0.67 110.504 167.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 13.3 mt -55.23 -54.1 28.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 CA-C-N 120.335 1.425 . . . . 0.77 112.196 165.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.4 t -58.5 -44.36 88.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-N 119.633 1.106 . . . . 0.57 112.951 -179.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.6 mp -63.2 -42.32 99.31 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.58 1.082 . . . . 0.91 111.393 175.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.6 t -65.34 -41.3 90.96 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 C-N-CA 123.819 0.848 . . . . 0.62 110.825 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.58 -43.08 99.51 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.396 0.544 . . . . 3.15 112.161 166.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.57 -23.76 64.9 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.704 -1.247 . . . . 3.91 113.556 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -75.43 -72.83 0.28 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.907 0.883 . . . . 1.81 112.455 158.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -58.95 -26.65 64.6 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.39 1.626 . . . . 2.09 115.39 -167.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -47.45 -32.66 5.3 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.986 1.266 . . . . 2.6 112.555 173.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -93.11 -19.22 21.72 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.257 1.823 . . . . 2.38 115.219 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.1 t -88.62 51.49 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 CA-C-N 120.455 1.479 . . . . 2.59 110.109 -168.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.5 -69.62 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.665 1.986 . . . . 4.58 111.197 -152.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tppm? 176.03 -47.43 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 129.362 3.065 . . . . 8.71 111.495 176.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -111.87 10.51 20.72 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.043 1.337 . . . . 8.32 113.105 -171.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.2 t -112.99 166.98 10.9 Favored 'General case' 0 N--CA 1.466 0.327 0 O-C-N 120.868 -1.145 . . . . 5.73 112.684 -175.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.6 mt -122.23 -72.01 0.7 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 127.316 2.246 . . . . 7.99 107.723 169.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.4 p -89.59 -38.43 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 N-CA-C 114.116 1.154 . . . . 4.84 114.116 -164.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -92.96 121.57 34.44 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.504 -0.747 . . . . 8.09 110.165 -178.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.6 m120 78.93 40.39 0.11 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 125.343 1.457 . . . . 7.35 112.01 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.6 175.12 10.67 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 126.0 1.72 . . . . 7.84 114.259 -175.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 28.0 pt -79.18 166.07 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 N-CA-C 116.032 1.864 . . . . 2.15 116.032 -174.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.4 t -77.67 137.51 38.56 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 120.41 -1.431 . . . . 2.72 110.068 164.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mttp -60.7 -21.86 63.34 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 121.063 -1.023 . . . . 2.3 112.161 172.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 55.4 p -67.66 -32.95 73.99 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 120.492 -1.38 . . . . 1.78 113.427 171.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.5 m -63.59 -39.68 94.99 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.593 1.088 . . . . 1.09 111.543 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.463 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 25.9 t80 -52.1 -60.47 3.16 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.816 0.846 . . . . 2.1 111.733 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -61.88 -28.68 69.67 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.458 0.54 . . . . 3.01 112.458 -176.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -83.79 -42.01 16.95 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.288 0.566 . . . . 2.84 112.098 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 15.7 tmm? -58.58 -37.48 75.87 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.681 -1.262 . . . . 1.54 111.099 170.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.6 mt -69.56 -8.03 43.65 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.302 1.593 . . . . 1.51 115.302 167.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -92.14 -7.72 47.69 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 120.932 -1.105 . . . . 3.1 113.405 163.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -62.84 1.51 Allowed 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.404 1.261 . . . . 1.54 114.404 174.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -82.14 -4.61 57.32 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 119.338 -2.101 . . . . 2.66 114.011 -168.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.86 24.81 5.0 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.802 2.041 . . . . 1.7 111.794 175.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -74.87 -26.76 59.91 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 115.418 1.636 . . . . 2.09 115.418 -164.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 16.8 m80 -70.02 -20.54 63.26 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.472 1.487 . . . . 3.07 111.072 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 4.5 tpp -70.72 3.98 2.81 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.28 1.432 . . . . 1.7 114.323 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 7.1 mp -85.35 119.37 25.64 Favored 'General case' 0 C--O 1.225 -0.23 0 O-C-N 120.734 -1.229 . . . . 3.15 110.27 174.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.7 t -110.08 5.45 22.11 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 114.911 -1.041 . . . . 5.05 112.552 175.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.9 t70 164.94 158.85 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 129.992 3.317 . . . . 4.98 109.492 -177.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.5 m -25.08 -48.5 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 129.959 3.304 . . . . 3.59 114.206 157.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.18 -33.61 75.88 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 125.545 1.545 . . . . 2.1 113.515 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 -71.35 -23.71 61.97 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.074 0.937 . . . . 3.38 112.929 177.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.46 ' HA ' ' CZ ' ' A' ' 56' ' ' ARG . 0.7 OUTLIER -81.39 -45.34 16.24 Favored 'General case' 0 C--N 1.344 0.354 0 CA-C-N 119.301 0.955 . . . . 6.8 112.487 164.213 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.8 mmtm -55.24 -34.57 64.11 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.906 0.776 . . . . 3.21 112.892 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.27 -27.58 36.11 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.442 1.275 . . . . 1.07 114.442 172.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.38 -43.41 50.37 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 119.149 0.886 . . . . 0.94 111.62 171.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -60.45 -36.63 78.69 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.279 1.432 . . . . 2.85 112.771 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -58.19 -30.21 66.26 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.514 0.931 . . . . 3.35 113.514 173.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.9 mt -78.06 -42.18 33.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 118.415 -0.802 . . . . 1.0 111.425 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 10.7 mm -60.73 -43.65 95.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 118.951 0.796 . . . . 1.16 110.373 -175.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -62.09 -28.72 69.81 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.536 0.939 . . . . 2.24 113.536 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.6 m-20 -81.64 -44.63 16.92 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.283 1.433 . . . . 3.01 113.01 175.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.87 -30.19 26.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.612 1.165 . . . . 2.34 111.703 -171.07 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -71.5 -22.93 61.73 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.914 1.079 . . . . 2.77 113.914 -177.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.55 -2.4 3.4 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 113.88 1.067 . . . . 2.53 113.88 164.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -138.4 -173.31 3.5 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 127.514 2.326 . . . . 3.85 110.287 -176.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 7.2 m80 55.52 45.34 25.22 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.97 1.47 . . . . 4.2 114.97 158.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.402 ' C ' ' H ' ' A' ' 73' ' ' ARG . 0.3 OUTLIER -134.09 155.46 50.01 Favored 'General case' 0 C--O 1.232 0.158 0 O-C-N 121.378 -0.826 . . . . 6.68 112.592 166.657 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.56 -18.9 0.41 Allowed Glycine 0 CA--C 1.538 1.515 0 CA-C-O 118.918 -0.934 . . . . 4.96 113.392 -161.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.402 ' H ' ' C ' ' A' ' 71' ' ' ASP . 87.5 mmt-85 -141.38 149.83 41.61 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 128.359 2.664 . . . . 4.9 110.42 172.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.4 mm -138.02 148.16 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 126.296 1.839 . . . . 3.06 109.83 173.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.7 m -117.39 144.44 44.96 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.148 1.779 . . . . 1.96 108.681 177.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -59.37 -36.67 76.19 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.773 1.273 . . . . 1.93 112.112 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.83 -20.54 65.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.512 2.725 . . . . 3.02 114.488 177.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -56.8 -58.91 6.05 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.888 1.222 . . . . 3.32 109.888 171.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -58.79 -44.39 90.73 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 121.343 -0.848 . . . . 2.38 112.035 -175.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.6 t-105 -62.07 -47.66 83.67 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 118.561 -0.733 . . . . 0.66 112.138 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.2 t -70.3 -28.14 64.95 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 119.446 1.021 . . . . 1.84 112.124 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.463 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 57.9 mt -68.04 -40.96 82.75 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 117.631 -1.176 . . . . 0.64 111.75 172.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 25.6 mm -54.76 -42.03 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 CA-C-N 121.545 1.975 . . . . 0.57 111.977 176.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -65.38 -19.39 66.49 Favored Glycine 0 N--CA 1.472 1.041 0 C-N-CA 124.111 0.862 . . . . 0.66 114.149 178.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.09 -22.29 63.62 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-N 118.307 1.054 . . . . 0.66 113.706 177.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.1 mp -90.42 -40.82 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 118.829 1.314 . . . . 0.82 109.955 163.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.3 m -80.75 80.61 7.19 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.452 1.501 . . . . 1.35 109.074 -175.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -153.98 -75.61 0.02 OUTLIER Glycine 0 CA--C 1.532 1.132 0 C-N-CA 125.752 1.644 . . . . 0.76 112.861 -174.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -62.37 -45.77 14.03 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.74 2.293 . . . . 0.98 111.641 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 pt -72.87 -16.37 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 114.839 1.422 . . . . 1.2 114.839 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -50.51 -58.53 5.56 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.792 1.633 . . . . 1.11 112.715 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -60.69 -40.23 91.4 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.112 -0.992 . . . . 2.91 112.466 176.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.3 tt -58.63 -47.15 85.35 Favored 'General case' 0 C--O 1.224 -0.288 0 C-N-CA 124.424 1.09 . . . . 1.15 110.579 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 42.4 mt -47.7 -58.49 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.792 1.237 . . . . 1.14 111.117 174.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -70.55 -34.65 72.49 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.57 -0.706 . . . . 2.56 112.099 -175.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.284 4.3 pt-20 -77.15 -24.19 51.57 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.636 -0.665 . . . . 2.91 111.876 -175.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -59.0 -58.35 9.04 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.262 1.825 . . . . 2.12 112.438 164.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -71.62 -12.54 61.4 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.024 0.829 . . . . 3.52 112.431 -171.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -79.4 -54.3 6.07 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.209 -0.932 . . . . 1.87 111.146 163.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.76 -16.18 37.43 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.027 1.121 . . . . 4.75 114.027 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 29.0 t -125.06 31.29 5.65 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.594 2.357 . . . . 7.13 111.625 171.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.7 t -71.0 0.56 7.2 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 115.255 1.576 . . . . 10.37 115.255 -176.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 41.9 t . . . . . 0 C--O 1.25 1.122 0 C-N-CA 128.866 2.866 . . . . 13.06 109.842 -174.078 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 68.9 m . . . . . 0 N--CA 1.472 0.67 0 CA-C-O 118.455 -0.783 . . . . 9.55 110.049 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -71.56 -129.61 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.259 0 O-C-N 124.815 1.322 . . . . 5.96 108.729 137.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 74.7 m -70.99 -42.69 69.32 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.222 1.374 . . . . 4.0 114.328 -173.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -57.88 123.62 16.43 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.023 -1.048 . . . . 2.23 112.664 -174.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.17 156.61 37.18 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.712 0.805 . . . . 1.32 109.774 -173.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -63.03 -39.85 95.98 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-O 117.78 -1.105 . . . . 2.49 111.341 175.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.16 -47.37 81.35 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.784 1.278 . . . . 1.01 109.895 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.08 -56.1 7.78 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 126.57 1.948 . . . . 2.84 111.593 -173.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -57.92 -29.87 65.47 Favored 'General case' 0 CA--C 1.545 0.75 0 O-C-N 120.75 -1.219 . . . . 4.71 112.238 169.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.813 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.43 -40.81 77.01 Favored 'General case' 0 C--O 1.224 -0.251 0 O-C-N 119.826 -1.796 . . . . 0.49 111.992 169.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 53.2 t -59.65 -31.93 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 120.762 1.619 . . . . 0.73 111.162 171.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 35.2 mt -60.78 -54.37 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 CA-C-N 119.859 1.209 . . . . 0.75 110.872 166.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.24 -36.92 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.479 1.112 . . . . 0.5 113.268 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.83 -44.76 76.48 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.474 1.034 . . . . 0.94 111.39 173.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.4 t -64.12 -39.44 85.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.947 0.899 . . . . 0.58 111.406 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -69.9 -38.15 76.21 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.112 0.782 . . . . 3.37 113.112 170.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -59.31 -23.07 62.14 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 120.582 -1.324 . . . . 3.6 113.017 173.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 63.9 t80 -81.44 -68.82 0.66 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.671 0.788 . . . . 1.92 112.704 163.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -60.24 -25.75 65.9 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.892 1.441 . . . . 2.03 114.892 -168.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -47.87 -33.19 7.13 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.922 1.237 . . . . 2.61 112.925 172.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -89.47 -16.82 29.94 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 114.862 1.43 . . . . 2.16 114.862 177.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 5.5 t -90.25 51.25 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-O 123.235 1.493 . . . . 2.45 109.914 -167.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.3 t 65.22 -68.0 0.12 Allowed 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 128.25 2.62 . . . . 4.8 111.87 -164.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -178.41 -43.54 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 127.185 2.194 . . . . 8.56 113.449 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -132.59 14.74 4.45 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.877 1.271 . . . . 8.08 112.878 -171.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 3.1 t -108.79 175.69 5.37 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 120.693 -1.254 . . . . 5.84 113.867 -170.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 18.5 mt -134.25 -72.17 0.49 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 127.68 2.392 . . . . 8.06 107.095 171.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 5.2 p -94.74 -37.85 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 113.889 1.07 . . . . 4.79 113.889 -163.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 27.9 ttpt -89.94 119.46 30.33 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.577 -0.702 . . . . 8.13 109.494 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 14.0 m120 76.77 43.89 0.12 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.348 1.459 . . . . 7.33 111.914 178.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.84 176.47 7.05 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 125.707 1.603 . . . . 7.72 114.537 -177.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 19.7 pt -83.99 175.96 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 115.292 1.59 . . . . 2.18 115.292 -173.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 29.8 t -94.29 137.88 32.93 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.469 -1.395 . . . . 2.73 109.97 164.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . 0.405 ' HE2' HD12 ' B' ' 169' ' ' LEU . 23.0 mttp -68.78 -17.07 63.97 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.732 -1.23 . . . . 2.61 111.469 171.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 10.0 p -65.53 -27.68 68.63 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.589 -1.319 . . . . 1.68 113.116 165.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 12.6 m -77.94 -39.29 43.2 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.364 0.984 . . . . 1.18 111.545 175.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.476 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 47.7 t80 -47.58 -57.48 5.39 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.008 0.923 . . . . 2.1 111.171 173.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.3 ptt180 -62.12 -26.73 68.47 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.361 0.874 . . . . 2.91 113.361 -176.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -87.82 -43.68 11.66 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.425 1.09 . . . . 2.44 111.941 -176.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.46 -41.41 69.45 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.393 1.477 . . . . 1.27 111.245 170.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 71.2 mt -71.02 -4.3 24.17 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.54 1.936 . . . . 1.6 115.183 171.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -98.92 -10.09 23.27 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.325 1.45 . . . . 2.96 112.725 165.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.19 -57.31 2.09 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.867 1.267 . . . . 1.38 113.658 174.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -86.76 -6.03 58.94 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.505 -1.372 . . . . 2.78 114.044 -169.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.35 14.85 8.3 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.784 2.034 . . . . 1.75 112.618 176.029 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -66.87 -26.87 67.1 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.264 1.579 . . . . 1.92 115.264 -163.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -70.86 -14.21 62.32 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.182 1.355 . . . . 2.95 112.304 178.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.6 tpp -80.25 5.37 14.82 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.339 1.455 . . . . 1.76 113.731 174.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.9 mp -91.49 132.04 36.53 Favored 'General case' 0 C--O 1.227 -0.122 0 O-C-N 120.678 -1.264 . . . . 3.18 109.404 177.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 20.1 m -140.4 16.88 2.39 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.165 -0.959 . . . . 5.21 112.118 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 18.7 t70 172.13 158.57 0.1 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 129.4 3.08 . . . . 5.42 109.762 173.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 3.7 m -25.2 -52.87 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 129.498 3.119 . . . . 4.24 113.326 156.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.0 -33.5 69.25 Favored Glycine 0 CA--C 1.525 0.674 0 C-N-CA 124.817 1.199 . . . . 2.42 113.262 -175.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -70.92 -23.83 62.33 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 118.516 1.158 . . . . 3.33 113.516 -178.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -84.4 -50.05 8.14 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.084 0.857 . . . . 7.28 112.62 164.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -54.33 -34.46 61.1 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 119.007 0.821 . . . . 3.26 112.552 -178.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -53.62 -29.44 37.95 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.41 1.263 . . . . 1.07 114.41 173.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -74.12 -40.34 62.72 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.224 0.92 . . . . 0.88 112.274 171.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -70.13 -27.63 64.71 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.292 1.037 . . . . 1.92 112.876 -177.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 23.4 mtmt -60.05 -27.82 67.26 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 121.138 -0.976 . . . . 3.41 113.274 168.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 6.5 mt -78.14 -40.89 36.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.702 -0.681 . . . . 0.96 110.998 173.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 19.1 mm -61.06 -44.69 98.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 118.393 0.542 . . . . 1.29 110.926 -178.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -61.94 -27.66 68.99 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.491 0.923 . . . . 2.6 113.491 -179.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 m-20 -83.2 -45.23 14.12 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.158 1.383 . . . . 3.06 113.092 174.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . 0.405 HD12 ' HE2' ' B' ' 138' ' ' LYS . 0.1 OUTLIER -96.72 -31.34 12.72 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.311 1.044 . . . . 2.96 112.673 -166.086 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -79.83 -8.4 59.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.703 1.201 . . . . 3.43 112.966 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -74.97 -7.13 52.73 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 124.894 1.278 . . . . 2.92 113.484 159.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -134.48 -173.41 3.28 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.439 2.296 . . . . 4.01 110.514 -178.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 57.6 73.08 0.48 Allowed 'General case' 0 CA--C 1.552 1.034 0 CA-C-O 122.809 1.29 . . . . 4.0 113.269 164.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -155.81 159.23 39.23 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 124.791 1.237 . . . . 6.1 110.899 172.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 69.01 -27.43 0.3 Allowed Glycine 0 CA--C 1.534 1.221 0 C-N-CA 124.381 0.991 . . . . 5.38 112.337 -160.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 81.9 mmt-85 -134.58 149.65 50.63 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.027 2.531 . . . . 5.18 110.302 167.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 26.2 mm -140.3 152.24 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.893 2.077 . . . . 3.45 107.315 172.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.4 m -117.38 144.01 45.39 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.503 1.521 . . . . 1.99 109.501 -177.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -58.91 -38.93 80.02 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 122.986 1.374 . . . . 1.84 111.937 177.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -63.5 -20.98 66.05 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.305 2.642 . . . . 2.96 114.346 175.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -57.5 -55.48 34.21 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.919 1.236 . . . . 2.97 109.713 171.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -55.39 -51.24 67.47 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.838 -0.539 . . . . 2.4 111.507 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.3 t-105 -61.05 -45.58 94.19 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 118.927 -0.559 . . . . 0.66 112.351 -178.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.7 t -72.12 -27.53 62.68 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 117.81 -1.091 . . . . 1.69 112.343 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.476 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 74.4 mt -65.21 -44.71 87.46 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.769 1.168 . . . . 0.78 111.535 168.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 36.8 mm -52.89 -38.55 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 CA-C-N 121.578 1.99 . . . . 0.95 113.417 -177.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.2 -18.96 67.77 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 123.928 0.775 . . . . 0.73 113.924 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -77.7 -25.16 63.31 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 118.522 1.161 . . . . 0.81 113.321 176.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -87.55 -43.06 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 CA-C-N 118.44 1.12 . . . . 0.95 110.238 164.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 8.0 m -86.41 86.04 7.33 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.912 1.285 . . . . 1.51 109.177 -170.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -160.07 -74.37 0.02 OUTLIER Glycine 0 CA--C 1.533 1.206 0 C-N-CA 126.259 1.885 . . . . 0.73 113.18 -171.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.59 -45.59 17.19 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.917 2.411 . . . . 0.96 111.751 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.5 pt -71.82 -19.31 20.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 116.874 -1.536 . . . . 1.25 114.533 172.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -46.79 -58.91 3.43 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 121.71 2.05 . . . . 1.11 112.902 178.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.13 -40.96 87.08 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.42 -1.425 . . . . 3.28 112.583 177.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.2 tt -61.01 -46.67 89.8 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 118.465 0.575 . . . . 1.46 110.334 -178.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 49.7 mt -49.36 -48.21 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 126.141 1.776 . . . . 1.34 111.903 175.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -76.72 -42.78 40.02 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.254 -0.579 . . . . 2.52 111.601 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -76.13 -21.64 56.38 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.888 -0.508 . . . . 2.89 111.896 -169.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -50.74 -59.76 3.75 Favored 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 126.516 1.926 . . . . 2.14 112.888 162.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -75.56 0.75 16.3 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 122.196 0.998 . . . . 3.42 111.631 -170.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -98.09 -53.91 3.23 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.715 1.606 . . . . 2.39 110.257 165.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.93 -14.28 45.08 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.563 0.949 . . . . 5.13 113.563 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 34.5 t -125.24 28.67 6.28 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 127.713 2.405 . . . . 6.86 112.079 171.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 26.2 t -73.76 -2.88 25.25 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 115.4 1.63 . . . . 10.19 115.4 -176.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 44.7 t . . . . . 0 C--O 1.254 1.322 0 C-N-CA 128.751 2.82 . . . . 12.72 110.946 -176.649 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 p . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 118.968 -0.539 . . . . 12.0 110.343 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -91.4 -43.2 9.88 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.989 1.716 . . . . 8.16 111.911 167.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.9 t 177.42 -38.35 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 129.21 3.004 . . . . 4.62 109.577 -165.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -68.48 119.28 12.7 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 108.121 -1.066 . . . . 2.62 108.121 162.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 70.0 p -59.6 141.18 55.5 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 118.956 0.798 . . . . 1.2 110.751 -170.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.404 ' HG2' HG21 ' B' ' 117' ' ' VAL . 6.6 tt0 -65.39 -21.76 66.71 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 117.992 -1.004 . . . . 3.38 112.33 -175.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -47.92 64.69 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 119.019 0.827 . . . . 0.8 110.912 169.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -69.64 -52.21 27.9 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.863 0.756 . . . . 3.13 110.783 -178.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -44.57 -45.94 9.71 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.193 1.397 . . . . 4.49 114.01 164.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.911 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -63.0 -48.07 80.4 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 118.05 -0.976 . . . . 0.5 112.321 174.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 93.8 t -58.93 -35.52 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 120.061 1.3 . . . . 0.65 111.296 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.0 mt -54.13 -46.77 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 CA-C-N 120.066 1.303 . . . . 0.79 112.312 165.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 53.9 t -71.62 -42.01 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 120.459 -1.4 . . . . 0.68 112.938 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.19 -30.49 68.25 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.886 -1.134 . . . . 1.0 111.052 174.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.3 t -73.49 -48.74 40.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-O 117.038 -1.458 . . . . 0.58 111.799 172.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -38.54 81.97 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-N 121.416 1.916 . . . . 3.41 112.949 176.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.8 t30 -64.88 -32.64 74.44 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.786 1.032 . . . . 2.13 113.786 -176.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.461 ' CZ ' HG21 ' A' ' 23' ' ' VAL . 36.0 t80 -65.63 -57.51 7.94 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.69 -0.631 . . . . 2.28 110.713 167.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.479 ' HA ' HG22 ' A' ' 23' ' ' VAL . 55.4 m-85 -68.97 -24.7 64.28 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.927 1.084 . . . . 1.78 113.927 -170.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.5 pttt -66.71 -24.8 66.29 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 121.27 1.85 . . . . 2.54 112.661 168.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -100.33 10.7 40.85 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.053 1.741 . . . . 2.86 114.433 172.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.479 HG22 ' HA ' ' A' ' 20' ' ' TYR . 34.1 m -140.9 -148.55 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 125.626 1.57 . . . . 2.81 108.207 164.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.5 t 74.99 154.56 0.15 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.058 1.743 . . . . 5.42 111.011 169.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 11.7 ttmm 72.42 -51.77 0.7 Allowed 'General case' 0 CA--C 1.557 1.228 0 N-CA-C 115.259 1.577 . . . . 7.4 115.259 160.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -76.1 73.62 2.96 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 127.87 2.468 . . . . 13.17 111.737 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.1 t 83.61 170.19 0.09 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 127.352 2.261 . . . . 7.69 112.924 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.91 -35.61 75.24 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.366 1.066 . . . . 9.28 112.514 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.3 p -165.18 -54.53 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 C-N-CA 125.278 1.431 . . . . 3.82 112.072 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.8 mmmt -58.31 -19.65 36.58 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 117.031 2.234 . . . . 13.31 117.031 -163.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -117.6 12.47 14.07 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.48 1.112 . . . . 7.47 113.548 -173.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -73.11 -39.23 65.95 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.506 1.299 . . . . 10.28 114.506 -172.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.5 tt -152.3 170.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 125.162 1.385 . . . . 3.36 108.986 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.0 m -114.27 142.15 46.66 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 107.77 -1.196 . . . . 2.84 107.77 148.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.5 mttp -63.31 -19.58 64.73 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.614 -1.304 . . . . 2.76 113.143 -168.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 5.3 p -49.97 -20.15 0.87 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.442 2.297 . . . . 2.18 115.877 163.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.5 m -92.48 -18.34 23.33 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 115.565 1.691 . . . . 1.61 115.565 170.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.412 ' CE1' HD11 ' A' ' 42' ' ' LEU . 27.7 t80 -60.47 -47.16 87.36 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 118.592 -2.567 . . . . 2.31 111.296 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -58.04 -20.77 41.64 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.91 1.684 . . . . 2.55 114.344 170.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.65 -49.13 6.25 Favored 'General case' 0 C--O 1.221 -0.439 0 C-N-CA 126.591 1.956 . . . . 3.8 108.853 -171.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 1.2 tmm? -48.67 -49.89 35.56 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.413 1.485 . . . . 1.49 111.295 163.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.412 HD11 ' CE1' ' A' ' 38' ' ' PHE . 38.4 mt -59.98 -9.96 3.64 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 115.627 1.714 . . . . 1.19 115.627 172.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -112.23 -16.87 12.9 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.551 1.54 . . . . 2.0 112.589 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.8 -42.61 11.8 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.999 0.818 . . . . 2.94 112.837 166.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -84.76 -53.16 5.54 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.099 1.36 . . . . 3.0 111.746 -174.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.3 mt -96.14 39.82 1.14 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.769 1.228 . . . . 2.54 112.334 -176.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -76.41 -12.15 60.01 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.838 1.421 . . . . 1.58 114.838 -169.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -88.19 -22.45 24.01 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 119.814 1.188 . . . . 1.66 111.318 178.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.3 tpp -63.81 -6.87 6.44 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 128.054 2.541 . . . . 2.38 114.336 172.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.2 mp -100.55 -179.9 4.23 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 128.393 2.677 . . . . 2.83 113.754 -168.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.8 m -177.28 -101.19 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 129.086 2.954 . . . . 4.6 107.148 175.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.59 17.3 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 128.202 2.601 . . . . 4.52 115.066 -171.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.6 m 68.53 -1.85 1.8 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.425 2.29 . . . . 3.89 111.316 -152.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.36 -47.26 69.51 Favored Glycine 0 N--CA 1.471 0.972 0 C-N-CA 125.119 1.342 . . . . 2.51 113.874 -165.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -59.58 -51.83 68.14 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 117.699 0.749 . . . . 4.71 112.17 174.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -55.34 -28.9 56.83 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.584 1.327 . . . . 5.08 114.584 171.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -55.18 -39.46 69.59 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 122.567 2.439 . . . . 3.68 111.984 173.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.34 -12.06 60.97 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.078 1.51 . . . . 1.53 115.078 174.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.26 -52.25 6.38 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.598 1.159 . . . . 1.31 112.284 163.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.92 -30.87 71.88 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.685 0.794 . . . . 2.71 111.758 -175.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.0 ptmm? -60.91 -27.4 68.16 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.999 1.111 . . . . 3.39 113.999 171.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.3 mt -83.39 -32.49 26.15 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.227 0.611 . . . . 1.38 112.297 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.1 mm -53.6 -55.54 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.719 1.207 . . . . 1.48 110.334 178.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -62.69 -39.4 93.88 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.227 1.011 . . . . 3.58 112.531 -177.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.24 -28.97 56.99 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.775 1.23 . . . . 3.56 113.767 171.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.5 mt -104.27 -26.4 12.5 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.763 1.394 . . . . 2.66 114.763 177.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -66.39 -15.25 63.15 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.55 1.068 . . . . 3.62 111.821 165.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.32 -27.32 59.22 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 115.07 1.507 . . . . 2.63 115.07 160.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -109.62 -20.39 12.86 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.625 1.713 . . . . 2.43 115.625 -168.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -139.15 124.84 19.54 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.584 -1.322 . . . . 4.43 113.541 -166.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -77.59 17.96 0.48 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.202 1.801 . . . . 4.73 115.422 -170.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 91.76 5.28 66.69 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 124.08 0.848 . . . . 2.47 112.658 -159.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.23 134.73 57.34 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.408 1.104 . . . . 4.85 109.204 146.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 34.8 mm -150.39 115.69 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 127.375 2.27 . . . . 2.16 107.97 -176.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.8 t -95.8 -172.38 2.58 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.731 1.612 . . . . 2.65 111.609 167.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -78.24 -40.45 37.23 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.474 1.11 . . . . 2.09 112.034 170.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.75 -32.28 73.73 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.847 2.459 . . . . 3.19 112.981 -168.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -58.59 -50.97 71.85 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 124.786 1.235 . . . . 4.08 110.49 176.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -57.41 -49.66 75.48 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.588 -0.695 . . . . 2.61 112.489 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 14.0 t-105 -61.83 -39.73 92.82 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 118.779 0.718 . . . . 0.86 111.778 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.0 m -59.64 -47.12 86.86 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.283 1.433 . . . . 2.19 111.082 174.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.86 -48.57 79.92 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 118.123 -0.941 . . . . 0.87 111.976 178.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.3 mm -55.09 -34.68 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 120.506 1.503 . . . . 1.02 112.84 -170.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -69.6 -21.21 76.2 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.072 0.844 . . . . 0.71 113.753 177.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.47 -23.74 77.33 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.394 0.997 . . . . 0.74 113.081 173.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.1 mp -89.74 -48.5 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.219 1.01 . . . . 1.16 110.344 163.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.9 m -82.7 67.2 8.66 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 126.096 1.758 . . . . 1.32 108.974 -173.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -146.69 -77.33 0.02 OUTLIER Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.596 1.569 . . . . 1.01 112.103 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -60.99 -40.66 50.43 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.545 2.83 . . . . 1.24 114.181 -170.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.7 pt -86.57 -14.91 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 119.455 1.025 . . . . 1.64 113.146 173.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.48 -35.77 80.39 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.352 0.978 . . . . 1.29 113.155 -172.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -55.33 -44.69 76.09 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.094 -1.004 . . . . 2.62 112.75 167.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.6 tt -60.7 -36.57 79.13 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.247 1.019 . . . . 1.2 111.222 -178.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.2 mt -50.39 -61.09 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 123.79 0.836 . . . . 0.89 110.151 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.1 t60 -62.16 -35.36 78.55 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.245 -0.91 . . . . 1.9 112.846 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -70.11 -23.07 62.97 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 122.986 0.514 . . . . 3.23 111.018 178.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -81.05 -30.28 34.84 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.228 1.411 . . . . 2.71 113.944 171.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -67.8 3.89 1.32 Allowed 'General case' 0 N--CA 1.485 1.283 0 CA-C-N 120.292 1.405 . . . . 2.83 112.182 166.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -118.58 -79.89 0.6 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.705 1.602 . . . . 2.17 111.08 170.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 56.65 3.97 0.14 Allowed 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 129.864 3.266 . . . . 4.35 115.536 172.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 58.0 m -165.26 49.63 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.933 2.093 . . . . 6.77 108.385 -172.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 58.5 m -141.66 8.5 1.95 Allowed 'General case' 0 N--CA 1.482 1.15 0 O-C-N 120.022 -1.674 . . . . 9.24 114.992 173.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 C--O 1.246 0.913 0 C-N-CA 131.067 3.747 . . . . 10.81 107.963 176.844 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 72.6 m . . . . . 0 N--CA 1.474 0.734 0 CA-C-O 118.741 -0.647 . . . . 11.37 110.594 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -66.97 -133.06 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 O-C-N 124.659 1.224 . . . . 7.94 109.743 138.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 42.2 t -77.49 -38.93 48.01 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.215 -1.553 . . . . 3.73 112.313 -172.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.65 111.66 1.34 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.162 0.985 . . . . 2.72 110.989 178.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 77.4 p -54.01 139.85 33.2 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.863 1.21 . . . . 1.17 110.018 -171.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -60.41 -36.67 78.68 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-O 116.433 -1.746 . . . . 3.73 109.514 -176.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.92 -50.56 66.13 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.61 1.55 . . . . 0.73 111.364 174.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -68.02 -50.56 54.66 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.856 0.753 . . . . 3.0 111.737 -177.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -49.72 -40.93 42.31 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.705 -1.247 . . . . 4.7 113.831 168.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.911 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.91 -40.53 75.53 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 124.971 1.308 . . . . 0.56 111.766 177.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 95.6 t -60.79 -42.56 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 120.018 1.281 . . . . 0.79 110.719 168.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 21.0 mt -52.46 -45.38 46.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 CA-C-N 120.436 1.471 . . . . 0.77 111.934 168.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.404 HG21 ' HG2' ' A' ' 7' ' ' GLU . 22.4 t -68.62 -38.63 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 O-C-N 120.885 -1.134 . . . . 0.55 113.232 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -58.02 -35.41 71.23 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.979 -1.076 . . . . 1.09 111.536 170.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 93.9 t -74.71 -44.67 46.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 117.575 -1.203 . . . . 0.66 111.042 -178.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.51 -37.94 85.55 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 120.551 1.523 . . . . 3.71 112.719 174.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -65.28 -33.24 75.52 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.833 1.049 . . . . 2.17 113.833 -176.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -66.77 -55.57 14.37 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 121.266 -0.896 . . . . 2.13 110.843 168.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . 0.437 ' HA ' HG22 ' B' ' 126' ' ' VAL . 51.4 m-85 -68.55 -24.21 64.6 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.791 1.034 . . . . 1.79 113.791 -171.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 36.7 pttt -69.18 -20.77 64.0 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 120.925 1.693 . . . . 2.42 113.264 168.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -98.75 -0.02 43.57 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.828 1.651 . . . . 2.61 115.001 170.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.437 HG22 ' HA ' ' B' ' 123' ' ' TYR . 27.7 m -135.25 -145.3 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 126.118 1.767 . . . . 2.7 109.45 171.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 3.7 t 71.63 162.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.892 1.677 . . . . 5.55 112.413 172.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.9 ttmm 68.13 -55.6 0.5 Allowed 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 116.989 2.218 . . . . 7.09 116.989 158.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -75.59 87.75 2.7 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.916 2.487 . . . . 13.04 111.955 -174.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 9.3 t 75.62 -179.32 0.16 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.524 1.53 . . . . 7.76 112.52 179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 97.5 mt -63.75 -40.03 95.71 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.03 -1.044 . . . . 9.37 111.082 175.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 5.9 p -168.4 -55.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.503 1.297 . . . . 3.98 114.503 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -62.05 -14.19 33.62 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.709 2.114 . . . . 13.19 116.709 -165.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -101.64 -0.81 34.07 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.442 1.497 . . . . 7.8 112.863 -178.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -78.7 -46.32 19.3 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.997 1.48 . . . . 10.22 114.997 -164.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.3 tt -151.04 143.69 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 CA-C-N 119.113 0.87 . . . . 3.32 110.928 -173.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 60.3 m -92.08 138.54 31.45 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 108.679 -0.859 . . . . 3.31 108.679 167.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -53.86 -26.02 22.6 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 120.532 -1.355 . . . . 2.75 114.259 -175.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 20.0 p -71.23 -8.65 55.0 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.811 2.044 . . . . 2.06 116.057 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 2.2 m -80.59 -42.7 21.83 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.988 1.267 . . . . 1.48 112.459 -172.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.513 ' CE1' HD11 ' B' ' 145' ' ' LEU . 3.5 t80 -57.91 -49.06 78.03 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.661 1.184 . . . . 1.94 112.011 -176.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -54.39 -20.69 7.88 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.162 1.171 . . . . 2.24 114.162 173.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -105.39 -34.56 7.8 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.981 0.912 . . . . 2.45 113.261 -173.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.6 tmm? -49.91 -49.96 47.96 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.554 1.142 . . . . 1.35 110.697 158.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . 0.513 HD11 ' CE1' ' B' ' 141' ' ' PHE . 77.1 mt -57.05 -11.24 1.44 Allowed 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.813 1.783 . . . . 1.1 115.813 168.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -106.35 -14.62 15.05 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 120.351 1.432 . . . . 2.14 112.42 177.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.96 -38.27 6.67 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.201 1.4 . . . . 1.69 113.387 176.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -77.68 -57.3 3.89 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.677 1.191 . . . . 3.22 109.65 173.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.6 mt -91.95 42.3 1.1 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.26 1.024 . . . . 2.45 111.643 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -71.76 -9.36 58.17 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.198 1.184 . . . . 2.07 114.198 -172.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -92.98 -31.76 14.78 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.541 1.064 . . . . 1.6 111.491 179.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 22.2 tpp -56.76 -1.73 0.07 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 128.897 2.879 . . . . 2.34 115.933 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.7 mp -100.43 -173.98 2.54 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.638 2.375 . . . . 2.84 114.427 -166.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 16.6 m -176.25 -104.98 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 129.824 3.25 . . . . 4.51 107.393 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.44 12.73 0.06 Allowed 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 128.068 2.547 . . . . 4.89 115.511 -171.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 67.64 13.81 9.36 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.992 1.717 . . . . 4.51 110.444 -134.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -58.19 -48.01 85.88 Favored Glycine 0 N--CA 1.473 1.155 0 C-N-CA 126.089 1.804 . . . . 3.04 115.854 -161.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -66.33 -48.65 69.59 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.611 1.205 . . . . 4.59 111.42 174.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.0 ttt-85 -53.54 -28.22 30.32 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.664 1.357 . . . . 4.82 114.664 175.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 55.9 mmtt -53.78 -36.17 62.11 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 122.247 2.294 . . . . 5.23 111.535 173.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.44 -11.59 59.86 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.284 1.587 . . . . 1.35 115.284 175.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -81.14 -51.58 8.3 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.274 1.03 . . . . 1.14 111.616 164.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.18 -33.76 75.14 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.816 0.446 . . . . 2.63 111.737 -173.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 7.6 ptmm? -58.11 -28.38 64.58 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.386 1.254 . . . . 3.42 114.386 172.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 30.0 mt -79.09 -33.04 44.79 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.875 -0.516 . . . . 1.16 112.163 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.4 mm -64.0 -52.19 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 C-N-CA 123.686 0.794 . . . . 1.4 109.372 -174.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -60.45 -38.01 82.8 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.828 1.251 . . . . 3.43 112.251 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.02 -33.69 72.34 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.434 1.094 . . . . 3.22 112.774 172.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.02 -21.57 19.66 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.193 -0.942 . . . . 3.52 112.401 -177.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -65.21 -19.62 66.06 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 125.16 1.384 . . . . 2.74 113.519 166.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -73.06 -24.17 60.65 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.012 1.115 . . . . 2.16 114.012 162.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 -116.71 -10.37 11.13 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.88 1.808 . . . . 2.28 115.88 -165.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.51 138.11 24.58 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 121.326 1.876 . . . . 4.25 114.76 -173.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -87.4 1.15 54.2 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 115.416 1.635 . . . . 4.39 115.416 -172.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 97.27 9.84 54.99 Favored Glycine 0 CA--C 1.533 1.194 0 O-C-N 121.201 -0.937 . . . . 2.52 112.907 -161.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.4 153.81 42.82 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 119.064 -1.054 . . . . 4.71 109.044 131.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 36.2 mm -152.74 140.58 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 128.814 2.846 . . . . 2.53 106.32 178.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 3.7 t -106.2 167.51 9.76 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 119.849 1.204 . . . . 2.6 112.431 163.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -57.51 -44.35 84.96 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.502 1.144 . . . . 2.11 112.144 172.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -29.72 70.68 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.448 2.699 . . . . 3.52 112.248 -171.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.98 -46.38 81.73 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.024 0.93 . . . . 3.83 111.024 178.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -57.57 -47.62 81.59 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.256 0.935 . . . . 2.42 111.859 175.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.4 t-105 -60.06 -46.12 90.6 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.541 0.609 . . . . 0.86 111.354 178.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 89.9 m -57.07 -46.09 82.76 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.968 1.307 . . . . 2.45 110.766 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 71.9 mt -65.86 -40.67 91.89 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 117.056 -1.449 . . . . 1.0 112.603 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 25.3 mm -53.23 -39.24 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.186 0 CA-C-N 121.02 1.736 . . . . 0.88 112.261 -177.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.77 -18.63 62.04 Favored Glycine 0 CA--C 1.535 1.332 0 CA-C-N 119.446 1.021 . . . . 0.61 114.034 176.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -77.78 -20.75 73.14 Favored Glycine 0 CA--C 1.532 1.12 0 CA-C-N 118.721 1.26 . . . . 0.85 113.623 175.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 4.1 mp -94.44 -45.29 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.394 1.078 . . . . 1.49 110.666 166.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 23.8 m -82.16 80.01 8.5 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 125.937 1.695 . . . . 1.4 107.727 -177.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -155.9 -78.98 0.02 OUTLIER Glycine 0 CA--C 1.531 1.067 0 CA-C-O 118.656 -1.08 . . . . 1.04 113.138 -174.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.09 -40.08 35.7 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.337 2.691 . . . . 1.09 113.268 -172.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 18.9 pt -88.25 -14.69 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 N-CA-C 113.62 0.97 . . . . 1.66 113.62 171.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -58.07 -39.56 78.81 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.926 1.239 . . . . 1.2 113.19 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -57.81 -45.61 85.85 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 120.617 -1.302 . . . . 2.88 112.631 168.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.8 tt -59.2 -38.25 79.44 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 124.186 0.994 . . . . 1.43 111.337 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 76.9 mt -49.59 -61.71 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 118.742 0.701 . . . . 1.02 110.281 167.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -59.02 -34.95 72.48 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 120.928 -1.108 . . . . 2.1 113.331 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -70.24 -26.34 63.79 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.529 0.732 . . . . 3.31 111.204 177.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -77.4 -32.48 54.82 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 117.569 -1.205 . . . . 2.6 113.596 172.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -70.58 5.59 1.79 Allowed 'General case' 0 N--CA 1.485 1.277 0 CA-C-N 120.288 1.404 . . . . 2.69 112.391 169.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -114.08 -74.48 0.62 Allowed 'General case' 0 CA--C 1.534 0.335 0 O-C-N 120.223 -1.548 . . . . 2.45 110.741 166.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.89 1.47 0.2 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 129.981 3.313 . . . . 4.64 115.759 168.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 28.7 m -165.86 60.15 0.11 Allowed 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 129.173 2.989 . . . . 6.85 107.243 178.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 33.5 m -141.61 22.07 2.16 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 120.249 -1.532 . . . . 9.31 112.751 174.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 47.1 m . . . . . 0 N--CA 1.476 0.846 1 C-N-CA 134.608 5.163 . . . . 10.86 107.127 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 106.512 -1.662 . . . . 10.77 106.512 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.22 -58.45 3.76 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 128.92 2.888 . . . . 10.04 111.199 -176.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 20.2 m 76.99 3.14 3.32 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 127.03 2.132 . . . . 3.58 115.477 163.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 109.21 100.09 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.308 1 C-N-CA 131.911 4.084 . . . . 2.51 106.967 -163.315 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.6 p -67.4 148.3 51.77 Favored 'General case' 0 N--CA 1.481 1.125 0 O-C-N 121.539 -0.726 . . . . 1.01 109.804 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -64.82 -19.26 65.76 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-O 118.015 -0.993 . . . . 2.64 113.251 176.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.39 -53.96 35.68 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 121.439 1.927 . . . . 1.06 109.011 172.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -63.65 -52.91 58.67 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.36 1.064 . . . . 3.28 109.666 -179.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.3 tptt -60.54 -30.64 69.88 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 120.756 -1.215 . . . . 6.05 113.497 174.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.841 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.02 -37.81 78.86 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 119.758 -1.839 . . . . 0.67 113.076 170.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 71.8 t -56.03 -46.76 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 119.688 1.131 . . . . 0.62 110.062 164.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.8 mt -54.14 -52.25 39.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.977 1.262 . . . . 0.8 111.683 172.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.5 t -60.36 -39.16 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 CA-C-N 119.764 1.166 . . . . 0.64 112.262 -177.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mp -68.76 -34.1 75.02 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.328 -0.857 . . . . 1.15 113.058 173.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.3 t -75.25 -42.24 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.156 0.982 . . . . 0.67 111.391 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -63.32 -37.73 88.38 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.893 0.769 . . . . 3.72 111.572 172.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -55.26 -26.73 41.81 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 114.223 1.194 . . . . 1.97 114.223 175.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -87.87 -60.14 2.05 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.292 1.037 . . . . 2.24 112.282 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -60.5 -28.45 68.38 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-O 118.824 -0.608 . . . . 1.72 112.442 -179.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -54.86 -19.67 7.06 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 119.888 -1.758 . . . . 2.74 114.465 172.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -93.31 10.08 33.56 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 114.933 1.457 . . . . 2.36 114.933 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.48 ' CG1' ' H ' ' A' ' 32' ' ' LYS . 30.7 m -113.46 135.03 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 120.482 1.492 . . . . 2.89 109.526 162.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.1 m -75.08 -42.39 56.85 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.984 1.476 . . . . 4.99 114.984 -156.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -174.16 -26.83 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.979 1.712 . . . . 6.62 113.205 -178.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -136.73 142.72 43.08 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.405 1.482 . . . . 10.17 110.643 175.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 65.7 m -120.23 135.58 54.94 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.888 0.875 . . . . 4.52 111.204 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.3 mt -88.89 32.75 0.8 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.402 1.881 . . . . 9.83 112.987 -174.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 160.34 -163.51 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.115 1 C-N-CA 135.316 5.446 . . . . 6.42 105.623 -164.382 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.527 ' HE3' ' HB2' ' A' ' 76' ' ' PHE . 2.5 mmmt -58.75 -44.08 90.46 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 119.738 -1.851 . . . . 16.37 112.479 166.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -151.03 168.31 24.98 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.995 1.725 . . . . 11.98 115.421 -175.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.48 ' H ' ' CG1' ' A' ' 23' ' ' VAL . 32.2 tttm -150.81 44.94 0.84 Allowed 'General case' 0 CA--C 1.549 0.938 0 O-C-N 120.604 -1.31 . . . . 6.42 114.213 175.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 7.0 pt -64.7 173.24 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.722 0.809 . . . . 3.29 111.448 165.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.0 p -111.86 148.99 32.47 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.588 -1.32 . . . . 3.96 113.337 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.419 ' HE3' ' CG ' ' A' ' 70' ' ' HIS . 21.1 mttp -64.3 -32.24 73.76 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.624 -0.672 . . . . 2.49 111.998 174.037 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 p -69.84 -38.84 76.64 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.508 1.123 . . . . 2.3 113.417 179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.4 m -76.23 -34.71 59.22 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 117.831 -1.081 . . . . 1.51 113.064 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -53.97 -52.75 59.69 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.881 1.673 . . . . 2.04 112.448 -177.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -61.42 -25.33 67.13 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.274 0.842 . . . . 2.14 113.274 177.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -89.37 -51.2 5.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 125.419 1.487 . . . . 3.18 110.293 -170.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 11.2 tmm? -48.39 -41.13 28.08 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.352 1.461 . . . . 1.71 111.965 163.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.9 mt -58.54 -32.05 68.52 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.788 1.403 . . . . 1.05 114.788 173.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -92.02 -3.34 55.95 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.587 1.54 . . . . 2.03 113.418 177.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.96 -65.22 0.99 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.356 1.063 . . . . 1.75 111.614 164.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -75.29 -18.53 60.03 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.849 -1.157 . . . . 2.51 112.78 -169.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.93 16.8 19.32 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.906 1.282 . . . . 2.11 113.605 177.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -49.95 -34.49 20.87 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 114.642 1.349 . . . . 1.77 114.642 -175.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.413 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 53.9 m-70 -69.16 -21.17 64.01 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.848 1.425 . . . . 1.56 114.848 -175.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 52.1 mtm -114.44 -15.44 12.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.91 0.884 . . . . 2.07 112.981 169.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 tt -74.61 68.49 1.65 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 123.294 1.521 . . . . 2.7 110.361 163.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.4 t -94.83 -70.5 0.71 Allowed 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 126.052 1.741 . . . . 3.62 108.767 171.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -77.23 138.51 39.47 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.5 0.667 . . . . 7.03 112.019 -165.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.2 m -50.06 -29.61 9.19 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.968 1.307 . . . . 4.19 112.776 175.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.64 -48.2 85.86 Favored Glycine 0 CA--C 1.532 1.101 0 CA-C-O 118.648 -1.084 . . . . 3.05 113.087 175.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -51.31 -60.5 3.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.559 1.143 . . . . 3.79 110.062 172.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -67.1 -37.74 84.47 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 113.57 0.952 . . . . 4.56 113.57 -171.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.74 -40.01 88.15 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 117.581 -1.199 . . . . 4.55 113.541 176.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -53.48 -49.4 67.56 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 127.093 2.746 . . . . 1.33 110.76 174.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.66 -54.45 33.18 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.786 1.634 . . . . 0.95 113.15 171.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.81 -29.0 69.87 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-O 118.493 -0.765 . . . . 2.09 112.799 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt -61.0 -33.26 72.97 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-N 121.113 1.779 . . . . 3.08 112.742 171.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.4 mt -68.78 -38.03 79.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.55 -0.295 . . . . 1.14 110.682 -178.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 23.3 mm -56.44 -53.61 38.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 125.326 1.45 . . . . 1.21 111.76 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -67.34 -37.23 82.94 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.157 0.983 . . . . 1.85 111.678 178.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -63.29 -33.73 76.14 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.025 0.379 . . . . 3.3 112.025 173.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 14.0 tp -78.37 -20.57 50.97 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 120.867 -1.146 . . . . 3.82 112.1 -177.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -56.56 -25.68 52.9 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.922 0.889 . . . . 3.43 113.127 174.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.91 -2.96 49.72 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 115.656 1.724 . . . . 2.64 115.656 172.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -130.03 19.9 5.44 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.956 1.253 . . . . 2.94 114.154 -166.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.419 ' CG ' ' HE3' ' A' ' 35' ' ' LYS . 21.9 t60 -146.25 92.21 2.15 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.235 -1.541 . . . . 6.97 113.643 -157.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -73.54 36.0 0.09 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 127.026 2.13 . . . . 5.07 113.089 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.79 10.2 84.95 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 126.569 2.033 . . . . 2.57 113.672 -169.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.3 mmt180 -107.03 158.88 16.71 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.805 2.442 . . . . 4.73 111.12 -172.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.4 mm -130.95 138.16 54.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 N-CA-C 108.473 -0.936 . . . . 2.22 108.473 161.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 37.2 t -73.46 -129.05 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 127.68 2.392 . . . . 2.87 109.999 170.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.527 ' HB2' ' HE3' ' A' ' 30' ' ' LYS . 84.8 t80 -133.19 -44.15 0.85 Allowed 'General case' 0 CA--C 1.54 0.587 0 O-C-N 120.143 -1.598 . . . . 2.04 110.242 164.347 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -64.76 -20.14 66.19 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.95 1.093 . . . . 4.54 113.95 -176.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -53.2 -56.28 17.65 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.642 1.177 . . . . 3.73 112.043 173.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -58.12 -45.79 86.71 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.283 0.947 . . . . 2.25 112.151 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.5 t-105 -65.3 -40.9 94.41 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.613 0.765 . . . . 0.72 111.981 -178.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.8 m -59.71 -46.02 90.36 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 126.577 1.951 . . . . 1.97 111.676 171.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.5 mt -56.8 -42.82 80.17 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.751 0.705 . . . . 1.03 111.639 176.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.8 mm -52.67 -40.65 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 CA-C-N 119.749 1.159 . . . . 0.64 112.582 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.54 -24.96 72.65 Favored Glycine 0 N--CA 1.476 1.329 0 C-N-CA 124.557 1.075 . . . . 0.59 113.559 177.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -71.34 -23.22 78.31 Favored Glycine 0 CA--C 1.531 1.041 0 O-C-N 121.445 -1.032 . . . . 0.58 113.447 176.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -90.13 -45.04 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 118.616 1.208 . . . . 0.85 110.568 162.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.6 m -85.72 64.67 8.75 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 127.821 2.448 . . . . 1.3 108.883 -172.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -144.02 -60.73 0.02 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.201 1.382 . . . . 1.25 111.742 -177.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -66.21 -72.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.991 3.127 . . . . 1.1 110.647 165.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.4 pp -66.91 -14.11 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.483 1.038 . . . . 1.37 113.666 -170.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.0 -33.94 74.03 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.67 0.989 . . . . 1.13 113.67 -177.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -42.15 95.09 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 120.871 -1.143 . . . . 2.98 112.523 170.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.2 tt -56.52 -39.21 72.95 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 124.456 1.102 . . . . 1.39 110.516 -173.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 22.2 mt -45.39 -62.8 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.675 1.59 . . . . 0.9 111.837 169.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -69.31 -29.38 67.21 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.687 0.795 . . . . 1.76 112.515 -175.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.264 2.5 pt-20 -83.35 -16.89 44.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.112 0.869 . . . . 2.96 112.421 177.155 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 -83.32 -42.11 17.49 Favored 'General case' 0 C--N 1.343 0.285 0 N-CA-C 115.205 1.557 . . . . 2.36 115.205 173.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -69.83 4.28 2.09 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 123.512 1.625 . . . . 2.4 112.028 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -125.09 -70.2 0.76 Allowed 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 127.722 2.409 . . . . 2.65 109.7 176.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 54.33 -6.32 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.13 1 C-N-CA 132.227 4.211 . . . . 3.98 116.055 176.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.6 t -132.04 11.19 4.65 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.936 0.894 . . . . 6.83 113.253 -161.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.0 t -79.31 -42.36 25.92 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.417 0.895 . . . . 8.84 113.417 176.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 17.1 t . . . . . 0 C--O 1.253 1.24 0 C-N-CA 124.298 1.039 . . . . 11.44 112.386 -149.24 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 106.431 -1.692 . . . . 10.93 106.431 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.61 -58.87 3.11 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.493 2.717 . . . . 9.89 111.24 -174.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 15.3 m 75.72 7.82 3.76 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.848 2.059 . . . . 3.65 115.226 163.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.413 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 17.4 m-85 102.64 101.4 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.401 1 C-N-CA 131.869 4.068 . . . . 2.55 107.826 -162.662 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.8 p -70.2 147.62 49.6 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 118.833 0.742 . . . . 1.01 109.478 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -64.8 -18.77 65.39 Favored 'General case' 0 C--O 1.213 -0.831 0 N-CA-C 113.549 0.944 . . . . 2.95 113.549 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.94 -54.36 27.34 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 121.072 1.76 . . . . 1.08 108.843 172.245 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -62.84 -52.15 64.25 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.801 1.241 . . . . 3.22 110.429 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 25.2 tptt -60.79 -29.93 69.74 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.543 0.942 . . . . 6.83 113.543 173.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.841 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.3 -37.5 77.82 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.045 -1.659 . . . . 0.72 112.858 170.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 91.3 t -57.61 -45.37 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-N 119.964 1.256 . . . . 0.67 109.58 166.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 6.9 mt -53.84 -53.86 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.252 0.933 . . . . 0.93 111.455 171.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 18.4 t -58.21 -42.85 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 119.532 1.06 . . . . 0.67 111.864 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 4.4 mp -66.25 -41.82 89.42 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.296 -0.877 . . . . 1.13 112.731 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 50.2 t -67.43 -40.88 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.85 0.86 . . . . 0.76 111.328 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 59.9 tt0 -65.44 -39.79 92.48 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 118.718 0.69 . . . . 3.7 112.42 171.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -60.25 -19.45 54.75 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.173 1.351 . . . . 2.44 114.123 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -91.2 -60.66 1.84 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.989 1.316 . . . . 2.08 112.522 170.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -59.13 -27.5 65.66 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.104 0.866 . . . . 1.8 113.135 -176.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -49.11 -19.37 0.43 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.383 1.623 . . . . 2.7 115.383 177.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -83.55 -13.29 54.79 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 116.077 1.88 . . . . 2.31 116.077 174.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 6.9 m -75.62 131.78 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 121.187 1.812 . . . . 4.23 109.527 174.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 3.0 m -82.47 -32.88 28.66 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.216 1.561 . . . . 5.33 115.216 -158.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? 169.4 -25.77 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 130.778 3.631 . . . . 7.48 112.029 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -135.08 156.59 48.76 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.953 2.101 . . . . 11.03 110.808 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 20.2 m -140.56 128.64 22.15 Favored 'General case' 0 CA--C 1.536 0.439 0 O-C-N 121.782 -0.574 . . . . 4.58 110.723 -165.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 36.1 mt -94.86 4.37 53.9 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.046 1.338 . . . . 9.67 113.788 -171.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 176.42 179.26 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.721 1 C-N-CA 133.015 4.526 . . . . 6.07 106.723 -166.494 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . 0.421 ' HE3' ' HB2' ' B' ' 179' ' ' PHE . 7.0 mmmt -55.04 -38.73 68.36 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 116.868 -1.539 . . . . 16.29 113.891 179.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -148.73 175.09 11.51 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.328 1.451 . . . . 12.21 111.333 166.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 51.7 tttm -154.31 61.55 0.69 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.366 -1.458 . . . . 6.23 112.717 169.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 10.0 pt -76.59 -177.24 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.098 0.559 . . . . 3.07 110.818 167.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 79.5 p -116.42 141.23 48.44 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.012 -1.055 . . . . 3.97 113.08 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 11.9 mttp -53.7 -28.42 33.69 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.133 1.373 . . . . 2.35 112.925 173.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 9.5 p -72.94 -34.3 66.47 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.937 1.295 . . . . 2.6 113.982 176.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 45.4 t -82.43 -43.23 17.55 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 117.799 -1.096 . . . . 2.99 113.335 -169.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.471 ' CE1' HD11 ' B' ' 145' ' ' LEU . 12.3 t80 -54.72 -48.42 72.55 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.939 1.699 . . . . 1.99 112.566 -176.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -60.36 -27.21 67.21 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.504 0.927 . . . . 2.33 113.504 176.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -92.94 -50.28 5.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.836 1.654 . . . . 3.13 111.266 -170.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 10.7 tmm? -51.27 -39.84 57.61 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.724 1.21 . . . . 1.79 111.575 167.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . 0.471 HD11 ' CE1' ' B' ' 141' ' ' PHE . 14.0 mt -54.47 -36.99 64.7 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.481 1.289 . . . . 1.25 114.481 174.024 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.84 -4.8 59.22 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.926 1.239 . . . . 2.01 113.467 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.28 -61.21 1.56 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.227 1.011 . . . . 1.64 111.505 163.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.27 -18.22 46.68 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.878 1.671 . . . . 2.5 112.775 -164.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.25 20.56 13.1 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 126.319 1.848 . . . . 2.1 113.147 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -51.8 -33.04 33.82 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.946 1.462 . . . . 1.66 114.946 -173.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -69.24 -26.34 64.74 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.826 1.047 . . . . 1.47 113.826 -174.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 53.3 mtm -109.71 -14.47 14.33 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.026 0.93 . . . . 2.27 112.702 171.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.09 65.0 1.09 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 122.919 1.342 . . . . 2.71 111.037 163.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 3.5 t -88.63 -67.47 0.83 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.245 -1.343 . . . . 3.5 108.853 170.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -80.79 139.23 36.15 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.61 0.719 . . . . 7.26 112.185 -161.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 51.1 m -49.13 -31.99 9.16 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.867 1.267 . . . . 4.22 112.303 173.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.58 -50.72 64.45 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.855 -0.97 . . . . 3.08 112.802 176.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -49.31 -60.92 2.4 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.539 1.136 . . . . 3.75 110.634 171.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -69.58 -35.74 75.63 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.716 1.006 . . . . 4.45 113.716 -170.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.0 -40.17 90.9 Favored 'General case' 0 CA--C 1.511 -0.542 0 O-C-N 120.454 -1.404 . . . . 4.57 112.946 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -50.47 -51.45 46.9 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 126.593 2.433 . . . . 1.56 110.551 174.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -48.9 -56.43 8.82 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.144 0.978 . . . . 0.71 112.554 173.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.48 -34.61 71.09 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.868 0.867 . . . . 1.9 112.738 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 25.0 mtmt -59.82 -34.13 72.67 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 120.628 1.558 . . . . 3.17 113.231 172.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.2 mt -68.93 -34.0 74.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.35 -0.387 . . . . 0.87 111.55 -178.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 23.3 mm -64.31 -48.7 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 123.515 0.726 . . . . 0.97 110.876 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -68.77 -34.83 76.23 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.413 1.085 . . . . 1.87 112.059 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 28.8 m-20 -62.33 -43.19 99.41 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 120.569 0.223 . . . . 3.18 111.343 169.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 12.4 tp -67.34 -19.97 65.52 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 120.865 -1.147 . . . . 3.52 112.671 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.35 -26.3 64.94 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.77 0.656 . . . . 3.74 112.77 176.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.76 -5.11 56.7 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.318 1.599 . . . . 2.61 115.318 171.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -120.39 12.88 11.76 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.049 1.34 . . . . 3.07 114.103 -167.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -143.35 90.57 2.18 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 120.377 -1.452 . . . . 6.89 114.196 -153.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -72.58 39.39 0.08 Allowed 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 126.446 1.898 . . . . 5.28 113.207 173.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 69.73 6.34 55.07 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 125.99 1.757 . . . . 2.45 114.103 -171.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -96.64 163.23 13.11 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.602 1.961 . . . . 4.46 110.875 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 19.2 mm -129.32 143.82 40.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 107.769 -1.197 . . . . 2.44 107.769 157.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 22.1 t -75.2 -138.18 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.953 2.101 . . . . 2.54 110.728 171.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . 0.421 ' HB2' ' HE3' ' B' ' 133' ' ' LYS . 81.5 t80 -125.14 -46.26 1.81 Allowed 'General case' 0 CA--C 1.535 0.382 0 O-C-N 119.865 -1.772 . . . . 1.99 110.514 161.08 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -62.04 -19.89 63.37 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.44 1.274 . . . . 4.46 114.44 -178.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -52.15 -52.86 49.14 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.275 1.03 . . . . 3.42 111.996 172.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -62.62 -45.53 92.44 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.917 -1.114 . . . . 2.98 111.554 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.0 t-105 -62.43 -44.64 95.94 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.517 0.727 . . . . 0.76 112.306 -179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 58.4 m -55.68 -50.9 69.03 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.778 1.631 . . . . 1.97 110.956 170.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 81.9 mt -60.35 -33.23 72.12 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.194 -0.908 . . . . 0.7 112.967 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 29.3 mm -55.49 -42.47 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 CA-C-N 120.564 1.529 . . . . 0.74 111.807 174.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.37 -24.72 73.68 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.745 1.164 . . . . 0.64 113.651 178.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.02 -19.77 77.38 Favored Glycine 0 CA--C 1.536 1.353 0 O-C-N 121.269 -1.136 . . . . 0.69 113.566 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 5.0 mp -93.74 -47.37 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 118.421 1.111 . . . . 0.8 110.63 160.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.4 m -83.63 62.73 7.02 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 128.425 2.69 . . . . 1.37 109.174 -173.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -142.29 -60.77 0.03 OUTLIER Glycine 0 CA--C 1.528 0.9 0 C-N-CA 125.695 1.617 . . . . 1.23 111.301 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -64.3 -73.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 124.146 3.23 . . . . 1.2 111.048 165.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.4 pp -66.37 -14.58 17.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 119.708 1.14 . . . . 1.34 113.805 -169.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.63 -32.49 73.53 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.639 1.176 . . . . 1.2 114.08 -176.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.93 -44.93 91.43 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.603 -1.311 . . . . 3.08 112.537 168.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.1 tt -57.48 -36.51 71.58 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.414 1.086 . . . . 1.54 111.325 -172.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 29.2 mt -45.44 -63.05 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.872 1.669 . . . . 0.87 110.997 170.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -65.63 -35.4 80.7 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.607 0.763 . . . . 1.81 111.91 -176.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.297 2.2 pt-20 -76.91 -20.25 56.44 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 119.544 1.066 . . . . 3.08 112.51 177.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 5.2 mm100 -80.76 -42.75 21.28 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 115.329 1.604 . . . . 2.47 115.329 174.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -70.44 6.18 1.49 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 123.609 1.671 . . . . 2.5 112.385 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -125.36 -68.44 0.84 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.506 2.322 . . . . 2.48 110.407 176.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.295 11.3 pt20 53.34 -4.41 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.879 1 C-N-CA 131.944 4.097 . . . . 3.87 115.681 -177.79 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 28.0 t -112.79 18.21 18.41 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.508 1.923 . . . . 7.59 112.657 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 3.9 t -70.61 -35.93 73.25 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.955 1.465 . . . . 9.34 114.955 -173.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 36.5 t . . . . . 0 C--O 1.249 1.074 0 C-N-CA 122.569 0.348 . . . . 12.11 110.687 -148.621 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.474 0.769 0 N-CA-C 108.999 -0.741 . . . . 9.59 108.999 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.03 -14.44 1.57 Allowed 'General case' 0 N--CA 1.471 0.618 0 O-C-N 124.841 1.338 . . . . 6.06 113.944 -133.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 73.2 m 72.67 0.98 3.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 127.956 2.503 . . . . 4.75 115.687 168.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -36.5 109.96 0.1 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 127.738 2.415 . . . . 2.47 113.946 -177.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.8 p -73.14 154.23 40.42 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.107 0.563 . . . . 1.29 111.451 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.34 2.11 8.21 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.259 1.023 . . . . 2.62 113.1 169.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.11 -56.33 4.16 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.598 -1.314 . . . . 1.15 109.306 158.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -76.94 -50.51 13.07 Favored 'General case' 0 C--N 1.331 -0.213 0 O-C-N 120.854 -1.154 . . . . 2.73 112.837 -168.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.0 tmtt? -58.38 -24.86 61.17 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.209 -0.932 . . . . 5.23 111.494 169.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -74.31 -43.23 57.58 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 119.662 -1.899 . . . . 0.69 112.721 168.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 77.0 t -55.29 -35.65 37.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 CA-C-N 120.612 1.551 . . . . 0.68 111.258 169.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 38.2 mt -53.88 -58.9 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.026 0.83 . . . . 1.02 111.081 165.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 49.2 t -61.37 -40.16 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 124.28 1.032 . . . . 0.92 113.424 -177.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.7 mp -65.26 -40.06 93.46 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.522 1.056 . . . . 1.04 111.843 177.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.0 t -63.84 -43.8 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-O 118.747 -0.644 . . . . 0.6 110.605 171.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.46 -43.53 75.57 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.695 0.68 . . . . 3.65 111.51 173.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.75 -15.87 63.85 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.979 1.474 . . . . 2.39 114.979 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -86.3 -53.41 5.04 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.109 -0.994 . . . . 2.17 111.306 167.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -60.61 -39.41 88.05 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.804 0.668 . . . . 1.93 112.804 -175.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -19.76 65.06 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 114.981 1.475 . . . . 3.59 114.981 173.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -95.44 -28.98 14.65 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.695 1.198 . . . . 2.68 112.603 172.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.6 t -61.26 -39.13 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 118.974 0.806 . . . . 3.27 110.771 165.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.2 p 153.96 -96.29 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 130.597 3.559 . . . . 5.16 108.727 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -165.78 26.03 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.427 1.091 . . . . 6.89 113.128 -173.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -149.46 -118.03 0.05 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.717 1.207 . . . . 8.84 110.969 -165.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.7 t -173.15 -164.74 0.25 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.521 1.928 . . . . 7.51 108.945 178.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 60.3 mt 66.09 -26.71 0.11 Allowed 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 129.118 2.967 . . . . 6.96 114.396 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 91.6 t 110.57 -59.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.225 -0.211 1 C-N-CA 133.878 4.871 . . . . 5.5 108.698 168.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt 67.83 -21.61 0.12 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 126.934 2.094 . . . . 8.0 115.578 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -140.73 135.62 31.74 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.673 1.189 . . . . 6.35 110.7 177.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -76.74 73.23 3.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.729 0.812 . . . . 9.86 111.67 173.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.4 pt -59.62 128.26 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 O-C-N 121.264 -0.898 . . . . 2.92 108.995 177.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.7 m -60.14 136.64 58.08 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.24 0.829 . . . . 2.48 113.24 -166.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.463 ' HB3' HG23 ' A' ' 63' ' ' ILE . 10.9 mtpp -55.75 -31.85 62.9 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 120.877 -1.14 . . . . 4.72 113.518 176.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.72 -30.86 14.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.774 1.63 . . . . 2.69 113.151 169.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 48.9 m -77.58 -36.29 52.12 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.985 -1.072 . . . . 1.79 112.622 -174.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 12.5 t80 -53.01 -56.19 17.95 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.283 0.947 . . . . 1.88 111.023 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.402 ' HG3' HH11 ' A' ' 39' ' ' ARG . 13.9 ptt85 -61.62 -8.39 4.42 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.844 1.258 . . . . 3.04 113.966 -178.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -117.0 -32.79 4.94 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.943 1.297 . . . . 4.22 113.715 -174.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 5.6 tmm? -50.97 -42.98 60.41 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 118.873 0.76 . . . . 1.42 109.399 150.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.1 mt -62.68 -19.02 63.44 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 115.502 1.668 . . . . 1.3 115.502 169.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -91.57 -35.5 14.23 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 119.714 1.143 . . . . 2.65 112.106 172.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -81.27 -50.98 8.88 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.042 0.837 . . . . 1.88 112.271 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -78.46 -30.58 47.49 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.907 0.776 . . . . 2.68 111.769 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.16 19.41 20.64 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.055 1.342 . . . . 1.57 113.763 -177.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -48.09 -35.38 11.25 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.143 1.777 . . . . 1.43 115.228 -173.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.474 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 7.4 m-70 -65.21 -21.11 66.71 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.437 1.495 . . . . 1.79 114.588 -178.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 39.4 ttm -95.22 10.52 35.71 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.462 1.505 . . . . 2.7 114.325 -169.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.7 mp -81.11 169.81 16.96 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.818 1.247 . . . . 3.54 112.489 178.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.3 m -157.12 36.35 0.29 Allowed 'General case' 0 N--CA 1.476 0.838 0 O-C-N 119.843 -1.786 . . . . 4.36 110.386 -164.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.6 t70 92.71 -175.06 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 129.592 3.157 . . . . 4.06 107.865 -146.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 52.8 p -66.38 -12.76 58.69 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 125.971 1.708 . . . . 2.88 114.764 170.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.46 -30.72 42.12 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 125.668 1.604 . . . . 1.62 114.644 -171.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -69.24 -45.55 69.52 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.483 1.513 . . . . 3.23 110.65 176.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 14.9 ttt-85 -65.74 -47.33 75.66 Favored 'General case' 0 C--N 1.346 0.448 0 O-C-N 121.461 -0.774 . . . . 5.19 110.039 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.8 mmtt -55.94 -29.04 59.51 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.09 0.774 . . . . 4.13 113.09 175.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.86 -39.27 69.79 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 117.759 -1.115 . . . . 1.58 112.305 171.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.62 -44.37 93.48 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.386 1.075 . . . . 1.0 111.969 172.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -53.01 -37.57 61.6 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.376 1.07 . . . . 2.26 112.731 175.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -61.3 -34.53 75.37 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 120.195 -1.565 . . . . 3.67 112.797 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 7.4 mt -74.5 -38.2 62.93 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.04 1.336 . . . . 1.14 111.852 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.463 HG23 ' HB3' ' A' ' 35' ' ' LYS . 17.8 mm -49.56 -59.18 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 CA-C-O 117.726 -1.13 . . . . 1.25 109.595 170.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -62.51 -36.15 81.66 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 119.603 1.092 . . . . 2.89 113.091 -174.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -62.71 -34.48 77.23 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.859 1.263 . . . . 2.67 113.009 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -86.36 -44.85 11.74 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.368 1.067 . . . . 3.29 112.266 176.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -62.43 -38.76 90.97 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.281 1.433 . . . . 2.54 111.724 -168.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.78 -18.72 13.71 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.66 1.184 . . . . 2.32 114.117 171.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -113.43 -0.54 14.44 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.082 1.753 . . . . 3.11 113.099 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -135.24 128.77 32.54 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 120.964 1.711 . . . . 3.91 112.042 -163.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -79.49 46.56 0.76 Allowed 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 122.599 1.19 . . . . 4.82 112.042 -175.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 59.45 2.24 1.5 Allowed Glycine 0 CA--C 1.538 1.489 0 C-N-CA 125.24 1.4 . . . . 4.06 113.043 -157.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -79.06 100.63 7.44 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 120.609 -1.524 . . . . 7.88 110.977 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.5 pt -69.58 166.4 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.965 1.706 . . . . 3.41 112.976 162.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 64.2 m -141.87 169.36 17.74 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.451 1.5 . . . . 2.17 110.973 166.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -52.62 -55.74 20.25 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.31 1.053 . . . . 2.05 111.927 179.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.02 -37.82 64.49 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 128.733 2.813 . . . . 2.98 111.785 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -74.77 -46.98 33.44 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.588 1.155 . . . . 3.68 110.603 -171.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -51.12 -54.09 28.28 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.725 0.693 . . . . 1.83 111.002 167.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 22.6 t-105 -62.78 -46.87 86.01 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 118.375 0.534 . . . . 0.57 111.873 -171.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 39.1 p -61.31 -43.49 98.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 117.785 -1.102 . . . . 2.84 111.549 178.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 23.8 mt -56.44 -36.88 69.51 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.173 -0.918 . . . . 0.99 113.231 175.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.1 mm -51.07 -36.52 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-N 120.127 1.33 . . . . 0.85 111.232 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.49 -19.65 76.42 Favored Glycine 0 CA--C 1.535 1.325 0 C-N-CA 124.479 1.037 . . . . 0.68 114.646 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.11 -11.84 84.96 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 119.083 1.441 . . . . 0.64 113.44 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.8 mp -105.0 -45.71 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.041 1.336 . . . . 0.8 110.263 165.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 3.7 m -80.71 88.18 5.79 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 126.582 1.953 . . . . 1.26 107.782 178.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -172.22 -77.6 0.05 OUTLIER Glycine 0 CA--C 1.528 0.856 0 CA-C-O 118.384 -1.231 . . . . 0.86 112.602 -170.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -59.71 -41.53 54.61 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.417 2.745 . . . . 1.08 112.756 179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.8 pt -77.39 -11.39 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 114.216 1.191 . . . . 1.15 114.216 174.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.16 -32.63 74.07 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 113.936 1.087 . . . . 1.05 113.936 -166.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -43.68 97.57 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.856 -1.153 . . . . 3.41 111.963 169.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.5 tt -61.43 -37.82 84.9 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.892 1.277 . . . . 1.42 110.875 -169.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 97.3 mt -50.06 -67.14 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.29 1.436 . . . . 1.09 110.97 168.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -59.7 -29.83 68.38 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.598 -1.314 . . . . 1.78 112.998 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.24 -29.68 65.41 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.944 0.898 . . . . 2.91 111.781 174.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -77.81 -37.96 47.48 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.782 2.033 . . . . 4.94 110.984 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -63.01 4.1 0.2 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 123.483 1.611 . . . . 2.59 113.331 171.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -115.91 -70.19 0.81 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.301 1.44 . . . . 3.0 110.925 169.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -75.22 -5.23 43.43 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 114.848 -1.069 . . . . 6.23 112.868 -163.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.2 m 58.16 23.93 10.78 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 127.39 2.276 . . . . 8.58 112.621 166.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.3 t 82.64 14.53 0.43 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 128.392 2.677 . . . . 13.09 115.797 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.6 t . . . . . 0 C--O 1.25 1.108 0 CA-C-O 116.987 -1.482 . . . . 10.7 110.977 145.4 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 CA--C 1.505 -0.781 0 N-CA-C 109.16 -0.681 . . . . 9.8 109.16 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -134.54 -14.9 2.18 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 124.781 1.301 . . . . 5.87 113.675 -133.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 73.2 m 70.46 2.25 3.98 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.689 2.396 . . . . 4.27 116.425 165.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -32.19 101.57 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 127.922 2.489 . . . . 2.32 113.555 -177.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 20.7 p -67.98 154.8 40.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 122.608 0.363 . . . . 1.09 110.105 -175.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -57.92 -38.39 75.81 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-O 118.322 -0.846 . . . . 2.49 111.471 174.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.1 -53.52 49.18 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.523 1.056 . . . . 0.79 110.67 173.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 12.1 tm-20 -74.64 -47.4 32.28 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.613 -0.68 . . . . 2.84 111.769 -170.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -60.95 -28.1 68.72 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.873 0.869 . . . . 4.88 111.908 171.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.769 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -70.38 -41.43 73.07 Favored 'General case' 0 C--O 1.222 -0.39 0 O-C-N 119.559 -1.963 . . . . 0.49 112.565 166.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 64.3 t -59.71 -37.04 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 CA-C-N 120.572 1.533 . . . . 0.67 110.698 171.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 26.2 mt -53.41 -59.17 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 118.913 0.778 . . . . 0.83 111.166 164.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 44.3 t -61.45 -40.83 87.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-N 119.342 0.973 . . . . 0.7 113.307 -175.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.7 mp -63.18 -45.47 91.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.593 1.157 . . . . 1.06 111.68 174.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 44.5 t -57.16 -46.45 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-O 118.794 -0.622 . . . . 0.67 110.302 173.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.1 -44.77 75.23 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 118.849 0.749 . . . . 3.46 111.391 173.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . 0.422 HD21 ' HG3' ' B' ' 148' ' ' GLU . 0.3 OUTLIER -67.36 -15.67 63.81 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.933 1.457 . . . . 2.25 114.933 -179.332 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -85.04 -58.19 2.79 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.442 -0.786 . . . . 2.43 111.151 166.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -57.74 -38.47 75.39 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.133 0.79 . . . . 1.88 113.133 -175.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -19.59 65.98 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.534 1.309 . . . . 3.51 114.534 175.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -92.86 -32.58 14.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.509 1.123 . . . . 2.49 112.337 169.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 97.7 t -55.98 -38.47 52.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 CA-C-N 119.348 0.976 . . . . 3.2 111.043 167.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 14.8 p 150.26 -94.43 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 131.0 3.72 . . . . 5.15 108.537 176.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 9.0 tttt -166.25 30.41 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.889 1.676 . . . . 6.34 111.911 -175.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -150.03 -114.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.125 1.37 . . . . 8.55 111.461 -164.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 15.8 t -176.02 -164.26 0.12 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.675 1.99 . . . . 7.83 109.429 -177.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 78.9 mt 65.18 -28.4 0.11 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 129.592 3.157 . . . . 6.94 115.582 176.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 73.3 t 111.53 -65.74 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.182 1 C-N-CA 133.833 4.853 . . . . 5.55 107.835 177.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt 72.35 -38.07 0.41 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.716 2.406 . . . . 8.12 114.542 173.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -121.74 134.48 54.94 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.709 1.603 . . . . 6.37 109.577 172.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -74.7 67.09 1.54 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.067 0.947 . . . . 9.84 112.203 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 3.8 pt -59.55 127.25 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.752 -0.592 . . . . 3.02 109.56 -175.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 2.9 m -59.53 138.86 57.56 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.995 1.109 . . . . 2.23 113.995 -164.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -56.89 -37.75 71.81 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 120.426 -1.421 . . . . 4.7 110.48 169.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 66.0 m -55.94 -13.36 1.82 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.803 2.041 . . . . 3.46 116.093 167.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 74.5 m -88.76 -39.19 14.11 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.42 1.463 . . . . 1.75 111.975 169.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -52.54 -48.23 66.22 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 120.242 1.383 . . . . 2.2 111.819 -179.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 19.6 ptt85 -55.23 -18.76 6.59 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.776 1.399 . . . . 3.35 114.776 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -114.8 -32.12 5.91 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.759 1.223 . . . . 3.4 113.659 -172.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 6.3 tmm? -50.67 -46.46 58.63 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 109.725 -0.472 . . . . 1.48 109.725 153.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 4.4 mt -63.87 -27.63 69.29 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 114.923 1.453 . . . . 1.33 114.923 170.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -77.35 -33.46 55.34 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 120.258 1.39 . . . . 2.53 112.177 175.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -84.77 -55.33 4.15 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.392 0.677 . . . . 1.54 112.801 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.422 ' HG3' HD21 ' B' ' 121' ' ' ASN . 3.8 mm-40 -77.0 -19.52 57.17 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.639 0.654 . . . . 2.71 112.589 -174.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -119.52 20.02 12.51 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.464 1.506 . . . . 1.86 113.294 -177.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -52.13 -26.0 10.24 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 116.159 1.911 . . . . 1.39 116.159 -172.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . 0.403 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 6.6 m-70 -77.47 -25.19 50.29 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.87 -1.144 . . . . 1.84 113.576 -175.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 32.1 ttm -80.01 27.81 0.3 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.338 1.455 . . . . 2.88 113.973 -171.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.6 mp -102.71 173.69 6.22 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.437 1.895 . . . . 4.02 113.289 -171.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 62.5 m -162.22 43.53 0.14 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 126.032 1.733 . . . . 4.56 109.469 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 7.5 t70 82.82 -175.98 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.575 2.35 . . . . 4.49 108.498 -144.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 70.7 p -66.46 -15.82 63.64 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 128.468 2.707 . . . . 2.92 114.87 -178.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.71 -37.27 67.98 Favored Glycine 0 N--CA 1.476 1.309 0 CA-C-N 120.622 1.555 . . . . 1.7 113.328 -173.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -63.97 -39.62 94.55 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.387 1.475 . . . . 3.52 110.79 176.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 43.2 ttt-85 -71.59 -38.81 70.84 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.327 -0.858 . . . . 4.71 112.942 167.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -57.48 -33.44 68.0 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.237 -1.539 . . . . 3.14 111.175 178.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' B' ' 164' ' ' LYS . . . -65.28 -13.95 59.6 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 115.973 1.842 . . . . 1.27 115.973 171.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -82.01 -49.53 10.14 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.822 1.249 . . . . 0.92 110.817 164.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -59.48 -34.53 72.7 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 125.047 1.339 . . . . 2.85 111.686 -176.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . 0.497 ' HG2' ' HA ' ' B' ' 161' ' ' ALA . 1.9 ptmm? -55.55 -31.1 61.86 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 120.861 -1.149 . . . . 3.98 113.684 169.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 23.4 mt -82.8 -37.33 24.65 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.332 -0.855 . . . . 1.16 112.391 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 26.8 mm -47.89 -60.61 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 124.098 0.959 . . . . 0.98 109.299 173.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -58.25 -39.26 78.71 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.37 0.878 . . . . 1.92 113.37 -174.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -62.69 -29.6 70.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.594 1.558 . . . . 2.84 112.637 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -99.69 -47.2 5.16 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.308 1.443 . . . . 3.59 110.839 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -53.61 -48.03 69.67 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 128.863 2.865 . . . . 2.62 111.533 -178.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.52 -15.1 15.76 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 115.009 1.485 . . . . 3.2 115.009 175.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -118.28 5.74 11.89 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.982 1.713 . . . . 4.06 112.852 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.02 134.18 42.12 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 119.749 -1.844 . . . . 4.27 113.627 -164.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -79.83 58.86 2.96 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 122.422 1.106 . . . . 4.64 111.604 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 62.8 19.54 60.96 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.169 1.842 . . . . 4.19 113.451 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -88.67 153.34 21.19 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 122.835 1.302 . . . . 7.78 114.06 -163.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 5.3 pt -132.15 169.65 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 C-N-CA 128.022 2.529 . . . . 3.87 109.784 170.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 58.6 m -142.09 176.66 8.79 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.019 1.328 . . . . 1.71 109.562 165.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -59.15 -52.58 65.11 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 122.371 1.081 . . . . 2.19 110.083 168.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -43.71 87.17 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 129.053 2.941 . . . . 3.06 111.128 -178.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -72.64 -47.43 47.65 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.454 1.102 . . . . 3.6 110.691 -174.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -51.33 -51.53 53.56 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.931 1.241 . . . . 1.92 111.598 168.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 52.4 t-105 -65.25 -41.79 93.94 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.394 0.516 . . . . 0.7 112.394 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 41.7 p -65.5 -37.21 86.13 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 117.908 -1.044 . . . . 2.65 111.777 176.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 76.3 mt -57.33 -39.91 76.88 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.973 0.806 . . . . 0.58 112.549 172.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 42.2 mm -54.07 -44.79 64.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 119.773 1.17 . . . . 0.91 111.596 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -70.15 -5.63 54.3 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 125.081 1.324 . . . . 1.03 114.266 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -93.3 -11.97 57.86 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-O 118.495 -1.169 . . . . 0.67 113.775 170.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.9 mp -95.35 -56.21 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 119.036 1.418 . . . . 1.17 107.895 164.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 42.1 m -74.65 98.01 3.33 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 126.252 1.821 . . . . 1.42 108.119 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -170.45 -80.18 0.05 OUTLIER Glycine 0 CA--C 1.532 1.143 0 C-N-CA 124.985 1.279 . . . . 1.01 112.787 -172.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -62.53 -43.38 22.21 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.126 2.551 . . . . 1.43 112.125 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 10.4 pt -72.49 -10.35 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 114.313 1.227 . . . . 1.38 114.313 173.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . 0.44 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -60.92 -35.18 76.03 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.109 1.152 . . . . 1.23 114.109 -174.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.83 -48.82 80.06 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.471 -1.393 . . . . 3.74 111.734 166.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.14 -37.83 78.21 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.183 1.393 . . . . 1.57 111.917 -174.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . 0.44 HD12 ' HA ' ' B' ' 194' ' ' ALA . 96.5 mt -53.29 -60.7 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.441 1.496 . . . . 1.22 111.935 168.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -63.74 -30.67 71.74 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.381 -0.824 . . . . 1.8 112.094 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -71.72 -27.28 62.9 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.4 -0.812 . . . . 2.96 111.86 175.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -73.98 -39.67 63.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.821 1.248 . . . . 5.35 110.248 179.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.6 1.81 0.53 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 125.408 1.483 . . . . 3.1 112.905 172.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -109.73 -71.35 0.77 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 120.427 -1.42 . . . . 2.9 111.579 167.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -73.35 -7.2 50.64 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 114.92 -1.037 . . . . 5.98 112.414 -164.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 70.2 m 60.55 21.53 11.3 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 127.896 2.478 . . . . 8.74 112.021 165.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 7.3 t 82.42 16.93 0.37 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.955 2.502 . . . . 13.19 116.013 -179.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 32.7 t . . . . . 0 C--O 1.25 1.115 0 CA-C-O 116.604 -1.665 . . . . 10.61 111.146 139.835 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.0 m . . . . . 0 CA--C 1.51 -0.593 0 CA-C-O 118.751 -0.642 . . . . 8.57 109.98 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -71.57 -129.28 0.0 OUTLIER 'General case' 0 CA--C 1.559 1.303 0 O-C-N 125.191 1.557 . . . . 7.19 108.224 139.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 52.5 t -91.96 -41.21 10.69 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.218 1.407 . . . . 4.69 112.714 175.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 75.13 98.79 0.07 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 128.647 2.779 . . . . 2.41 111.22 -169.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 70.5 p -57.53 148.21 24.53 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.84 0.856 . . . . 1.07 109.634 176.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.618 ' HG2' HG21 ' B' ' 117' ' ' VAL . 4.1 tp10 -59.17 -31.42 68.97 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 118.554 0.615 . . . . 2.28 111.445 175.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.87 -41.75 98.23 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.681 -0.637 . . . . 1.11 111.0 177.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -53.09 13.17 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 118.407 -0.806 . . . . 3.37 110.495 175.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -42.32 -43.09 3.36 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.343 1.057 . . . . 4.9 112.5 170.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.17 -42.09 76.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 125.054 1.342 . . . . 0.54 112.668 -178.211 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 54.3 t -56.52 -46.41 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.99 0.814 . . . . 0.9 109.762 167.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 16.3 mt -54.77 -49.15 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-N 118.413 0.551 . . . . 0.9 111.432 174.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.615 HG21 ' HG2' ' B' ' 110' ' ' GLU . 32.7 t -65.07 -41.71 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-N 118.997 0.817 . . . . 0.6 112.341 -177.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.56 -41.38 97.29 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.251 -0.905 . . . . 0.94 111.233 176.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 80.1 t -72.66 -37.33 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.275 1.43 . . . . 0.84 112.486 178.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -55.51 -54.75 40.01 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.312 1.045 . . . . 3.04 110.142 170.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -71.12 -9.57 58.28 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.198 1.184 . . . . 2.74 114.198 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.431 ' HB2' ' CE2' ' A' ' 79' ' ' TYR . 60.0 t80 -79.95 -65.62 0.98 Allowed 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.853 -1.154 . . . . 2.48 112.22 167.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -63.69 -28.63 70.03 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 118.934 -0.555 . . . . 2.25 112.053 -170.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.0 mtpt -46.35 -38.59 9.01 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.354 1.462 . . . . 2.65 114.44 168.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -92.41 -26.09 18.18 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.808 -0.557 . . . . 2.33 111.325 -176.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.8 t -72.32 -55.2 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 126.243 1.817 . . . . 3.07 112.881 176.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.8 p 167.05 -97.77 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 127.284 2.234 . . . . 3.78 112.704 -177.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.405 ' HE3' ' OE1' ' B' ' 202' ' ' GLN . 74.3 tttt -170.12 -12.17 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.551 1.941 . . . . 6.43 113.303 -166.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -167.54 -38.44 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.777 1.631 . . . . 6.75 113.779 -175.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.1 t -115.35 131.24 56.99 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.616 -1.302 . . . . 4.83 114.16 -171.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.04 -61.4 2.06 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.385 1.874 . . . . 8.25 113.22 -177.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . 0.278 6.0 m -85.63 65.08 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-O 124.409 2.052 . . . . 4.19 112.117 -178.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.408 ' HE2' ' HA ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -82.04 -5.0 58.03 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 111.516 -2.583 . . . . 7.53 113.627 162.786 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 36.67 67.3 0.34 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.864 2.466 . . . . 8.93 113.102 -178.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.8 tptt -163.69 -16.33 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.46 1.652 . . . . 9.03 115.46 175.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 5.3 tt -76.65 162.11 4.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 119.746 1.157 . . . . 2.93 108.379 133.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 33.8 m -163.9 163.29 23.71 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 127.081 2.152 . . . . 3.76 109.433 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.4 pttt -47.15 -13.3 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.273 0 N-CA-C 118.011 2.597 . . . . 2.79 118.011 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 7.3 m -78.98 -28.02 43.5 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 119.912 -1.743 . . . . 2.38 114.501 169.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.8 m -77.66 -48.76 16.02 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.624 1.102 . . . . 1.53 111.477 -171.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.431 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 9.8 t80 -49.13 -49.6 41.38 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.166 0.986 . . . . 2.01 112.032 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -58.3 -30.24 66.5 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 118.23 -0.891 . . . . 3.79 113.16 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -96.58 -40.93 8.79 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.172 1.389 . . . . 2.88 113.533 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 43.3 ttp -49.43 -42.1 41.83 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.863 1.665 . . . . 2.59 112.044 163.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.431 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 12.0 mt -55.01 -19.99 8.18 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 114.398 1.258 . . . . 0.97 114.398 170.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -98.75 -11.23 22.09 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.447 1.499 . . . . 2.65 113.009 177.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.28 -59.5 1.77 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.275 1.03 . . . . 1.61 112.118 170.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -76.9 -26.42 54.13 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.708 1.203 . . . . 3.59 113.156 -172.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.15 43.91 2.34 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.006 1.722 . . . . 1.62 111.745 -179.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -84.24 -17.86 38.38 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 116.566 2.061 . . . . 1.34 116.566 -171.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.523 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 10.5 m-70 -80.92 -25.99 37.08 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 120.917 1.69 . . . . 1.7 113.244 -168.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 76.0 mtm -97.59 15.5 23.21 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.182 1.393 . . . . 2.55 113.257 164.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.26 -152.56 0.29 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.194 1.798 . . . . 2.63 110.853 174.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.1 t 69.11 -35.91 0.32 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.849 2.059 . . . . 6.61 113.78 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -35.03 18.26 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 127.3 2.24 . . . . 6.35 113.075 174.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 95.1 m 74.41 -23.45 0.23 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 127.329 2.252 . . . . 2.8 114.123 169.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.26 -48.97 76.15 Favored Glycine 0 CA--C 1.532 1.154 0 CA-C-N 120.549 1.522 . . . . 2.25 110.244 160.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -37.47 -65.2 0.33 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 128.073 2.549 . . . . 4.17 111.254 159.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.9 tpm_? -56.77 -46.52 81.41 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 114.613 1.338 . . . . 5.81 114.613 -175.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.9 mmmt -66.28 -35.86 81.49 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.534 0.733 . . . . 3.02 111.586 178.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.19 -32.87 66.89 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 118.086 -0.959 . . . . 1.12 112.885 -179.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.56 -44.12 95.05 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.422 1.089 . . . . 0.94 112.78 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.99 -22.73 59.5 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 113.172 0.804 . . . . 3.49 113.172 -175.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -54.88 -37.79 66.73 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 121.552 -0.718 . . . . 3.11 112.167 164.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 12.6 mt -74.63 -43.7 54.13 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.159 -0.928 . . . . 1.15 111.175 178.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.0 mm -60.22 -39.04 79.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 118.408 -0.806 . . . . 1.35 111.384 -175.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -72.32 -37.58 68.88 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.889 0.876 . . . . 2.4 113.297 176.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -62.82 -34.9 78.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.902 1.281 . . . . 3.38 112.552 171.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.1 tp -82.27 -36.64 26.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.259 1.424 . . . . 2.58 111.454 178.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -43.71 -57.13 3.37 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 126.8 2.04 . . . . 4.42 113.024 -169.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.42 -16.34 3.56 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.702 2.001 . . . . 2.32 114.844 -177.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -110.89 -1.62 16.4 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.918 1.287 . . . . 2.33 113.059 -173.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 30.6 m80 -138.06 101.21 4.36 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.024 -1.047 . . . . 3.45 112.755 -166.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.13 27.4 0.14 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.942 2.097 . . . . 4.66 114.349 -171.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.77 32.8 58.72 Favored Glycine 0 CA--C 1.533 1.161 0 O-C-N 120.112 -1.618 . . . . 2.43 110.643 -150.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.8 mmt-85 -95.34 159.17 15.13 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.051 1.34 . . . . 5.91 108.615 162.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.4 mm -145.26 140.66 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 C-N-CA 126.454 1.902 . . . . 2.23 107.895 -173.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 t -116.97 173.47 6.63 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.671 0.748 . . . . 1.92 112.15 166.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -78.19 -47.47 17.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.355 1.062 . . . . 2.33 111.988 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -73.3 -23.86 60.33 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.092 2.157 . . . . 2.77 113.372 -178.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -48.07 -61.19 2.1 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.807 2.043 . . . . 3.27 111.075 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.431 ' CE2' ' HB2' ' A' ' 19' ' ' PHE . 6.8 t80 -54.98 -49.29 71.81 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.312 -0.868 . . . . 1.95 111.485 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.486 ' CZ2' HG21 ' B' ' 186' ' ' ILE . 19.6 t-105 -61.0 -48.18 83.01 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.239 0.615 . . . . 1.06 111.881 -178.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.5 t -73.28 -25.15 60.56 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 117.752 -1.118 . . . . 2.11 112.647 -178.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.7 mt -69.45 -36.11 76.3 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.562 1.073 . . . . 0.92 112.274 170.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.449 HG21 ' CZ2' ' B' ' 183' ' ' TRP . 21.4 mm -48.23 -44.11 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 CA-C-N 120.336 1.425 . . . . 0.79 111.408 177.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.45 -15.1 44.72 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 124.159 0.885 . . . . 0.74 114.998 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.86 -19.81 60.71 Favored Glycine 0 CA--C 1.533 1.161 0 CA-C-N 118.741 1.27 . . . . 0.72 114.077 172.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.0 mp -99.13 -52.49 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-N 119.139 1.47 . . . . 0.92 109.24 170.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.1 m -73.91 59.23 0.69 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 128.225 2.61 . . . . 1.45 108.387 167.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -146.11 -69.63 0.01 OUTLIER Glycine 0 CA--C 1.525 0.692 0 C-N-CA 126.711 2.1 . . . . 1.07 109.299 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -58.0 -50.88 9.0 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.273 2.649 . . . . 1.52 112.742 173.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.9 pp -90.8 -11.82 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 113.827 1.047 . . . . 1.46 113.827 -175.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.58 -29.99 70.66 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 120.842 -1.161 . . . . 1.74 113.448 -174.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -37.74 67.42 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.036 -1.04 . . . . 3.63 113.792 168.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.6 tt -56.58 -40.35 75.09 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.829 1.252 . . . . 2.02 110.807 -176.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 57.0 mt -47.92 -62.8 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.059 1.344 . . . . 1.38 110.1 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -73.24 -24.82 60.52 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.966 -1.084 . . . . 1.81 112.794 -174.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -67.65 -27.89 67.24 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-O 118.489 -0.767 . . . . 3.64 110.136 168.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -90.27 -38.59 13.31 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.328 1.851 . . . . 2.32 115.745 178.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -61.37 -2.66 0.74 Allowed 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 121.47 1.941 . . . . 2.2 112.054 167.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -112.0 -88.56 0.53 Allowed 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.129 1.771 . . . . 1.92 111.838 165.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.13 18.91 0.09 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 129.117 2.967 . . . . 3.9 115.24 -176.407 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.1 m -141.27 16.76 2.24 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.778 2.031 . . . . 6.76 110.074 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 9.9 m -178.39 86.09 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 128.361 2.664 . . . . 8.09 105.74 -174.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 67.3 m . . . . . 0 C--O 1.25 1.129 0 C-N-CA 126.341 1.856 . . . . 10.23 109.626 -137.265 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 67.3 m . . . . . 0 N--CA 1.473 0.719 0 CA-C-O 118.319 -0.848 . . . . 8.47 109.343 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -71.75 -128.23 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 107.912 -1.144 . . . . 6.9 107.912 137.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 41.8 t -104.0 -49.13 3.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.065 1.346 . . . . 4.84 111.141 172.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.523 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 85.8 m-85 79.06 120.69 0.05 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 129.059 2.944 . . . . 2.67 110.168 -156.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 81.3 p -64.14 156.8 27.32 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 121.372 -0.83 . . . . 1.22 110.373 171.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . 0.615 ' HG2' HG21 ' A' ' 14' ' ' VAL . 1.5 tp10 -60.38 -19.52 56.08 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.219 0.463 . . . . 2.71 111.49 171.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -44.9 66.07 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.599 1.56 . . . . 1.01 111.369 172.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.37 -44.57 62.38 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 117.69 -1.147 . . . . 2.94 111.634 173.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . 0.407 ' O ' HG23 ' B' ' 117' ' ' VAL . 1.7 mmmp? -43.83 -48.05 8.23 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.621 1.555 . . . . 4.66 111.088 165.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.772 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -66.21 -53.36 38.18 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 118.045 -0.978 . . . . 0.81 113.606 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 42.6 t -52.84 -46.61 52.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 CA-C-N 119.707 1.14 . . . . 0.92 111.131 174.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 93.8 mt -53.16 -52.35 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 124.846 1.258 . . . . 1.38 110.926 170.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . 0.618 HG21 ' HG2' ' A' ' 7' ' ' GLU . 21.8 t -67.62 -37.96 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 CA-C-N 119.97 1.259 . . . . 0.56 112.543 -175.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -61.78 -41.86 98.26 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.062 0.945 . . . . 0.99 111.055 175.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 72.9 t -75.07 -40.44 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.886 1.274 . . . . 0.82 112.302 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -51.93 -56.42 14.24 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.724 1.21 . . . . 3.08 110.086 170.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -69.78 -15.08 63.06 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.811 1.041 . . . . 3.01 113.811 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -83.79 -60.85 1.99 Allowed 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.406 -0.809 . . . . 2.02 113.103 172.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -58.34 -32.9 68.96 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.66 -0.65 . . . . 2.34 112.16 -174.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -41.24 -44.54 2.67 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.102 1.761 . . . . 2.67 114.293 169.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -89.16 -29.52 19.26 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.46 0.704 . . . . 2.26 112.282 -176.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 56.1 t -66.89 -47.4 82.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.217 1.807 . . . . 3.39 111.991 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 63.9 p 153.27 -77.81 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 130.064 3.346 . . . . 3.77 109.836 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 14.9 tttp -179.06 -71.55 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.881 2.072 . . . . 5.26 110.09 -167.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -120.16 -7.98 9.78 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 115.186 1.55 . . . . 6.8 115.186 -169.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 29.0 t -128.83 135.87 49.71 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 119.869 -1.769 . . . . 5.01 112.39 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 85.9 mt -81.18 -53.68 6.17 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.922 1.289 . . . . 8.38 112.998 -172.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . 0.441 HG12 ' H ' ' B' ' 177' ' ' ILE 0.28 29.1 m -85.8 54.17 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 CA-C-O 124.634 2.159 . . . . 4.34 112.574 -178.749 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.18 -2.84 39.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 111.158 -2.746 . . . . 7.48 113.789 166.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 60.5 t30 35.19 64.36 0.45 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.478 2.711 . . . . 8.87 114.197 172.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 20.8 tptt -165.77 -19.04 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.855 1.262 . . . . 8.88 114.373 177.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 11.7 tt -69.68 157.28 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 N-CA-C 107.544 -1.28 . . . . 3.09 107.544 136.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 6.2 m -161.79 162.82 29.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 124.354 1.062 . . . . 3.53 110.273 173.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 30.3 pttt -50.98 -11.06 0.08 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 128.301 2.64 . . . . 2.66 117.066 -179.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.0 m -80.99 -27.9 35.73 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 119.706 -1.872 . . . . 2.13 114.418 166.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 26.8 m -76.86 -46.4 24.81 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.572 -1.33 . . . . 1.32 112.058 -169.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -51.23 -50.16 59.68 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.513 1.125 . . . . 2.42 112.438 175.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -65.01 -12.28 48.57 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.979 1.103 . . . . 3.53 113.979 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -98.37 -43.67 6.83 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 120.171 1.351 . . . . 2.48 111.225 170.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 63.2 ttp -54.04 -41.85 68.54 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.279 1.831 . . . . 2.91 112.479 177.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 11.7 mt -59.86 -29.3 68.2 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.913 -1.117 . . . . 1.53 113.625 172.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -80.48 -9.82 59.76 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.901 1.281 . . . . 2.61 112.885 176.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.99 -64.72 1.01 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.551 1.14 . . . . 1.55 111.366 167.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -75.85 -13.71 60.28 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.557 -1.339 . . . . 3.19 114.279 -172.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.2 18.13 9.12 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.104 1.362 . . . . 1.67 112.748 177.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -53.75 -28.45 34.58 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 115.365 1.617 . . . . 1.26 115.365 -171.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -66.98 -25.89 66.54 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 114.128 1.159 . . . . 1.62 114.128 -169.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 68.1 mtm -105.14 11.59 32.99 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.407 1.083 . . . . 2.5 112.598 171.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . 0.453 HD23 ' H ' ' B' ' 154' ' ' SER . 0.2 OUTLIER -99.21 -163.76 1.07 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.448 1.899 . . . . 2.4 110.398 -178.701 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.453 ' H ' HD23 ' B' ' 153' ' ' LEU . 5.3 t 70.53 -23.16 0.17 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.235 1.814 . . . . 7.09 113.988 -177.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -65.54 16.67 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 128.309 2.644 . . . . 7.01 114.638 177.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 98.8 m 62.41 -65.83 0.09 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 128.853 2.861 . . . . 4.19 113.548 -179.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -54.01 -40.52 66.15 Favored Glycine 0 N--CA 1.468 0.825 0 C-N-CA 125.543 1.544 . . . . 2.44 112.692 -172.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -43.74 -67.5 0.27 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.77 1.628 . . . . 4.16 112.232 168.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 25.0 ttt-85 -73.79 -29.58 62.26 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.105 -0.997 . . . . 5.04 112.528 -173.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -61.19 -42.42 98.55 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.574 -1.328 . . . . 3.14 112.137 171.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.12 -37.61 74.91 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 113.55 0.944 . . . . 1.23 113.55 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -58.02 -47.18 83.84 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.851 1.26 . . . . 0.96 112.856 173.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.06 -23.59 60.58 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.438 -0.789 . . . . 3.4 112.906 -173.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -54.5 -36.64 64.4 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.683 -0.635 . . . . 3.02 112.058 164.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 7.4 mt -73.76 -46.04 48.11 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.523 -0.762 . . . . 1.04 110.712 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 7.1 mm -60.31 -42.73 91.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.691 0.678 . . . . 1.26 112.002 -175.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -68.65 -36.46 78.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.486 1.114 . . . . 1.98 113.223 177.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 54.4 t-20 -70.24 -37.62 75.01 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.06 1.344 . . . . 2.84 111.57 174.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 10.5 tp -74.48 -32.74 62.65 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.62 1.168 . . . . 2.58 111.506 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -46.4 -54.58 8.83 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 125.822 1.649 . . . . 4.03 112.808 -172.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -61.53 -4.95 1.52 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.337 1.855 . . . . 2.27 115.771 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -121.35 -2.76 9.49 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.526 1.13 . . . . 2.27 113.423 -176.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 66.7 m80 -137.15 89.61 2.45 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.889 -1.132 . . . . 3.61 111.978 -167.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.78 29.32 0.09 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 128.581 2.752 . . . . 4.75 114.564 -167.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.35 32.23 58.22 Favored Glycine 0 CA--C 1.534 1.24 0 O-C-N 120.268 -1.52 . . . . 2.57 110.557 -149.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 47.1 mmt-85 -103.23 151.32 22.79 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.231 1.812 . . . . 5.91 107.388 161.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . 0.441 ' H ' HG12 ' B' ' 132' ' ' VAL . 33.2 mm -144.49 140.78 24.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 127.281 2.232 . . . . 2.24 106.713 -172.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.1 t -119.81 171.3 8.51 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.754 0.788 . . . . 1.97 112.559 171.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -77.99 -46.46 21.0 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.062 0.945 . . . . 2.43 112.327 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -71.2 -23.6 62.06 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.473 1.909 . . . . 2.78 113.213 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -48.51 -60.5 2.64 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 127.083 2.153 . . . . 3.18 111.061 175.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -57.17 -46.21 83.01 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.299 -0.876 . . . . 1.95 111.602 -179.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . 0.449 ' CZ2' HG21 ' A' ' 83' ' ' ILE . 19.9 t-105 -61.86 -46.19 90.52 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.366 0.666 . . . . 1.06 112.395 -178.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 6.5 t -69.05 -36.75 78.04 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.803 0.729 . . . . 1.76 111.299 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 81.6 mt -61.18 -37.22 82.15 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.458 1.026 . . . . 0.72 113.288 174.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . 0.486 HG21 ' CZ2' ' A' ' 80' ' ' TRP . 15.3 mm -49.51 -44.85 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 120.049 1.295 . . . . 0.91 110.795 176.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -64.67 -13.13 55.23 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 124.607 1.098 . . . . 0.63 114.601 -177.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -83.41 -20.64 59.95 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-N 118.7 1.25 . . . . 0.79 113.906 170.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 5.1 mp -96.06 -55.56 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 119.429 1.615 . . . . 1.09 108.797 171.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 27.6 m -73.11 59.17 0.52 Allowed 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 128.638 2.775 . . . . 1.48 108.555 169.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -142.84 -72.11 0.03 OUTLIER Glycine 0 CA--C 1.525 0.717 0 C-N-CA 126.882 2.182 . . . . 1.05 108.458 175.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -58.94 -51.27 7.17 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.208 2.605 . . . . 1.44 113.169 174.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.0 pp -87.18 -10.77 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.5 1.046 . . . . 1.58 113.087 -175.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.06 -31.04 70.41 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 120.975 -1.078 . . . . 1.71 113.054 -173.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . 0.411 ' HB2' ' HE3' ' B' ' 195' ' ' LYS . 0.0 OUTLIER -56.59 -36.75 69.72 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 117.815 -1.088 . . . . 3.39 113.048 172.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.7 tt -55.98 -40.15 72.86 Favored 'General case' 0 C--O 1.217 -0.605 0 C-N-CA 124.342 1.057 . . . . 2.41 110.671 -177.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 88.2 mt -48.4 -61.71 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.63 1.172 . . . . 1.25 110.869 171.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -65.54 -34.97 79.5 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 121.595 -0.691 . . . . 1.81 111.729 -176.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -68.49 -21.3 64.62 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 118.728 -0.653 . . . . 3.55 110.769 176.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -91.85 -38.77 12.13 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.063 1.745 . . . . 2.28 114.751 173.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -59.98 -6.69 1.41 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 121.229 1.831 . . . . 2.4 112.208 164.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . 0.405 ' OE1' ' HE3' ' A' ' 25' ' ' LYS . 45.6 mm-40 -104.65 -93.32 0.35 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.453 1.501 . . . . 2.19 112.105 162.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.3 24.09 0.26 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 128.424 2.689 . . . . 3.98 113.934 -172.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 15.1 m -139.94 22.86 2.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 127.853 2.461 . . . . 6.94 109.454 -170.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 21.4 m -175.23 71.42 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.984 2.114 . . . . 8.54 107.916 -175.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 33.2 m . . . . . 0 C--O 1.252 1.2 0 C-N-CA 125.837 1.655 . . . . 10.05 111.197 -150.0 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 N--CA 1.473 0.691 0 N-CA-C 106.294 -1.743 . . . . 10.4 106.294 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -61.76 -116.52 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 107.744 -1.206 . . . . 6.84 107.744 127.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 85.0 m -75.62 -113.52 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.849 0 O-C-N 120.325 -1.485 . . . . 4.36 108.723 159.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.5 m-30 123.97 155.03 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.162 1 C-N-CA 132.886 4.474 . . . . 2.12 111.747 -174.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.8 p -73.68 159.19 33.38 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.807 0.843 . . . . 1.25 110.351 169.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -64.95 -20.52 66.51 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.702 -0.624 . . . . 2.54 111.661 170.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.89 -45.76 77.02 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 118.749 -0.643 . . . . 0.94 109.926 173.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.16 -49.68 66.56 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 117.331 -1.318 . . . . 3.47 112.187 172.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -41.6 -48.46 4.03 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 121.045 1.748 . . . . 5.04 112.273 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.787 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -72.71 -47.31 48.15 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-O 117.306 -1.33 . . . . 0.64 112.727 -177.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.64 -40.42 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 CA-C-N 121.14 1.791 . . . . 0.63 110.619 173.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 88.4 mt -54.17 -58.46 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.207 1.003 . . . . 1.07 110.696 168.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.9 t -61.58 -35.15 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 125.542 1.537 . . . . 0.69 112.964 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.0 mp -69.71 -39.17 77.03 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.85 0.86 . . . . 1.02 110.515 175.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 68.6 t -75.56 -34.41 29.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.024 0.929 . . . . 0.72 111.339 178.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -61.64 -45.5 93.76 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 124.916 1.286 . . . . 3.05 111.262 168.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -58.56 -23.54 58.71 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.612 0.967 . . . . 2.15 113.612 174.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -82.98 -60.87 2.02 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.822 -1.174 . . . . 2.15 112.489 170.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -69.07 -13.74 62.61 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.761 1.023 . . . . 2.0 113.761 -174.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.5 mttp -31.83 -48.24 0.15 Allowed 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 127.872 2.469 . . . . 2.28 112.851 162.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -98.38 6.22 47.48 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.543 1.137 . . . . 2.36 112.664 -171.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.2 t -112.41 131.61 63.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.552 1.141 . . . . 2.89 110.189 -170.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -47.83 -45.71 30.18 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.13 1.372 . . . . 3.49 112.279 -178.171 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.74 -45.9 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.701 1.601 . . . . 5.25 110.669 163.27 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -144.02 -50.89 0.31 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.31 0.644 . . . . 7.47 111.375 174.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.3 m 65.54 -2.33 0.85 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 126.72 2.008 . . . . 4.29 115.091 168.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.1 mt 56.12 -78.74 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 128.986 2.915 . . . . 6.81 111.95 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.8 p -177.63 21.13 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.006 0 C-N-CA 128.747 2.819 . . . . 5.35 111.919 -157.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -77.1 -22.28 52.99 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 119.526 -1.984 . . . . 9.8 115.399 -174.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 164.27 -59.31 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 129.657 3.183 . . . . 8.99 107.237 -168.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 44.8 tttt 67.66 -101.1 0.06 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.918 1.287 . . . . 10.4 111.823 160.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 42.6 pt -133.4 130.82 57.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 CA-C-N 120.764 1.62 . . . . 2.46 110.109 174.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.5 m -66.14 140.66 58.23 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.561 -1.337 . . . . 2.44 111.549 178.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -61.95 -17.74 57.95 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.342 1.238 . . . . 2.8 114.342 -169.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.0 p -54.37 -33.34 58.96 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.802 -1.186 . . . . 2.12 112.231 168.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.1 m -60.05 -25.59 65.47 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.644 -1.285 . . . . 1.55 113.737 174.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 54.7 t80 -65.5 -62.51 1.48 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.308 1.413 . . . . 2.09 111.441 175.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -58.26 -21.92 50.41 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.202 1.001 . . . . 2.25 112.653 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.405 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 25.5 mt-10 -93.23 -44.74 8.18 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 124.662 1.185 . . . . 3.84 113.459 -174.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -32.1 68.04 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.593 1.088 . . . . 1.55 111.137 163.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.6 mt -66.24 -19.23 65.76 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 115.576 1.695 . . . . 1.04 115.576 169.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.41 -24.4 13.48 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.963 1.256 . . . . 3.13 113.475 171.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 1.6 mppt? -86.07 -48.2 8.85 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.78 1.232 . . . . 2.62 110.639 -178.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -86.77 -36.97 18.28 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.235 1.014 . . . . 2.93 112.238 -178.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.3 mt -103.75 50.04 0.81 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.035 0.934 . . . . 2.57 111.883 173.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -68.17 36.3 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 125.575 1.55 . . . . 2.1 113.61 175.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -136.42 -96.03 0.23 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.577 1.951 . . . . 1.94 110.745 -159.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.1 ptp -56.57 -20.23 19.77 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.638 1.563 . . . . 2.63 114.436 174.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.2 mp -80.65 64.23 5.36 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 123.801 1.762 . . . . 3.53 110.25 162.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.1 m -79.83 -10.74 59.82 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 113.036 -1.893 . . . . 3.92 114.425 -158.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -151.96 164.77 36.47 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.659 1.584 . . . . 4.6 109.639 160.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.5 m -34.47 -44.15 0.19 Allowed 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 129.443 3.097 . . . . 2.64 112.805 160.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.34 -32.09 79.62 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 117.653 -1.637 . . . . 2.24 114.39 -179.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -78.6 -47.67 16.67 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.214 1.507 . . . . 2.91 109.679 170.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -48.73 -29.62 4.68 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.421 1.889 . . . . 5.38 115.571 179.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.7 mtmt -48.36 -34.42 10.68 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.933 -1.104 . . . . 4.69 113.838 168.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.59 -16.49 63.41 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.54 1.311 . . . . 1.07 114.54 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.07 -49.01 8.64 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.719 0.808 . . . . 0.89 111.67 168.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.0 -31.5 72.43 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 112.916 0.709 . . . . 2.44 112.916 -179.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -57.31 -28.84 63.42 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.105 -0.997 . . . . 2.58 112.703 174.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 45.9 mt -78.32 -30.52 48.31 Favored 'General case' 0 C--O 1.224 -0.238 0 O-C-N 121.637 -0.664 . . . . 0.91 111.404 -178.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.5 mm -66.25 -49.02 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 123.94 0.896 . . . . 0.91 110.13 -178.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -62.57 -37.22 85.32 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.94 1.296 . . . . 2.99 113.061 175.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -65.88 -25.05 67.0 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.382 1.473 . . . . 2.56 113.979 171.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -87.94 -80.06 0.28 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 117.715 -1.136 . . . . 2.41 109.842 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -50.64 -34.7 27.24 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.437 1.471 . . . . 3.59 114.771 -158.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -54.37 -18.86 4.57 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 115.249 1.574 . . . . 3.75 115.249 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -132.48 5.48 4.04 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.541 1.936 . . . . 3.73 113.866 168.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -141.4 9.79 2.06 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 116.144 1.905 . . . . 4.68 116.144 -164.325 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -51.76 145.34 9.65 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.504 1.521 . . . . 7.18 112.869 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 71.47 -22.91 0.64 Allowed Glycine 0 CA--C 1.535 1.334 0 C-N-CA 126.333 1.92 . . . . 2.64 114.795 -173.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -94.39 135.11 36.17 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.294 1.437 . . . . 5.49 110.893 -178.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.2 mm -147.07 111.98 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 125.975 1.71 . . . . 2.46 107.446 177.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.4 m -85.3 -158.87 0.4 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.302 1.441 . . . . 2.37 111.334 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -109.03 -57.18 2.19 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 119.685 -1.884 . . . . 2.15 109.988 170.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -52.32 -25.77 10.47 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 131.407 3.883 . . . . 3.08 114.269 170.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -51.21 -59.21 4.44 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.422 1.489 . . . . 3.04 111.444 170.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -51.04 -44.71 61.11 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.6 -0.688 . . . . 2.38 111.623 176.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 28.4 t-105 -64.52 -46.8 81.36 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 118.485 -0.769 . . . . 0.58 111.996 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.9 t -74.47 -22.88 58.87 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 117.683 -1.151 . . . . 1.79 113.407 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.41 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 84.5 mt -65.68 -44.83 85.01 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.931 1.241 . . . . 0.62 110.331 169.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 27.4 mm -48.96 -43.87 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 CA-C-N 119.94 1.245 . . . . 0.71 112.667 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.77 -19.51 43.55 Favored Glycine 0 CA--C 1.537 1.449 0 CA-C-N 119.468 1.031 . . . . 0.68 114.07 177.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -68.11 -19.19 71.79 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 118.885 1.342 . . . . 0.64 114.188 172.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -118.41 -43.1 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 CA-C-N 119.117 1.459 . . . . 0.97 110.325 175.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 17.6 m -77.26 52.67 0.94 Allowed 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.223 1.809 . . . . 1.44 109.749 166.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.68 -64.39 0.03 OUTLIER Glycine 0 CA--C 1.528 0.862 0 C-N-CA 126.955 2.216 . . . . 1.13 109.912 179.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -63.28 -59.15 0.24 Allowed 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.204 2.603 . . . . 1.23 112.624 173.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.1 pt -78.04 -17.55 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 114.028 1.121 . . . . 1.18 114.028 -173.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.55 -37.46 75.74 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.308 -0.87 . . . . 1.01 112.505 -173.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.6 ptmt -60.91 -29.42 69.58 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 120.639 -1.288 . . . . 5.1 113.238 176.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.8 tt -77.85 -23.05 49.04 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.444 1.498 . . . . 1.6 112.963 178.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 79.3 mt -51.75 -48.64 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 118.955 0.798 . . . . 0.96 110.466 168.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.41 -33.86 73.1 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 114.194 1.183 . . . . 3.97 114.194 -179.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.83 -55.65 24.37 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.328 1.051 . . . . 5.68 111.71 172.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -56.56 -46.05 80.95 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.865 0.866 . . . . 2.64 113.299 -175.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -80.29 2.41 24.73 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.677 0.791 . . . . 2.91 111.797 -175.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -101.85 -51.03 3.52 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.734 0.813 . . . . 1.95 111.041 162.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -58.06 -22.29 49.53 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.642 0.978 . . . . 4.65 113.642 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.6 t -115.29 22.92 12.87 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.905 1.682 . . . . 8.37 112.72 173.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.1 t -76.64 8.64 3.4 Favored 'General case' 0 CA--C 1.55 0.955 0 O-C-N 120.197 -1.564 . . . . 11.04 115.051 -176.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 C--O 1.254 1.308 0 C-N-CA 129.57 3.148 . . . . 13.81 110.106 -178.952 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 106.298 -1.741 . . . . 10.27 106.298 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -58.42 -118.03 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 108.086 -1.079 . . . . 6.82 108.086 127.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 61.0 m -76.79 -116.17 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.545 1.538 . . . . 4.32 108.753 157.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 132.76 155.77 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.174 1 C-N-CA 132.917 4.487 . . . . 2.21 112.695 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 66.1 p -71.66 150.57 44.45 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.312 0.645 . . . . 1.21 110.006 164.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -53.47 -36.9 62.15 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.312 1.045 . . . . 2.34 111.097 175.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.61 -42.88 93.64 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.719 1.608 . . . . 0.85 111.726 178.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.1 -51.47 24.93 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 121.401 -0.812 . . . . 3.35 110.323 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -55.14 -30.36 59.64 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.423 1.089 . . . . 5.11 112.125 172.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.787 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -72.65 -44.26 62.1 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.563 -1.335 . . . . 0.55 113.221 170.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 54.0 t -59.18 -39.33 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 120.877 1.671 . . . . 0.62 109.834 172.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 63.1 mt -54.77 -57.79 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.853 -1.07 . . . . 0.85 110.824 167.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 5.6 t -56.55 -39.35 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 CA-C-N 120.502 1.501 . . . . 0.65 113.035 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.67 -40.42 84.46 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 121.359 -0.838 . . . . 1.03 111.953 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 68.7 t -72.74 -34.51 47.35 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.635 0 C-N-CA 123.51 0.724 . . . . 0.65 110.987 177.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -65.22 -41.82 94.04 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.523 1.129 . . . . 3.06 112.281 172.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . 0.421 HD21 ' CG ' ' B' ' 144' ' ' MET . 40.0 t30 -58.67 -24.03 60.48 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.961 -1.087 . . . . 2.16 113.603 173.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -84.67 -61.12 1.87 Allowed 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.13 -0.981 . . . . 2.15 112.674 172.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -68.1 -14.67 63.15 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.44 0.904 . . . . 2.07 113.44 -175.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mttp -32.61 -48.14 0.18 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 127.156 2.182 . . . . 2.23 113.349 164.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -97.64 6.78 47.53 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.371 1.468 . . . . 2.19 113.235 -172.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 45.9 t -109.63 135.29 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.238 1.015 . . . . 2.8 109.982 -171.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.3 m -48.7 -44.32 37.92 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.672 1.189 . . . . 3.52 112.286 -178.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.01 -42.42 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.599 1.96 . . . . 5.25 111.235 166.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -145.8 -53.85 0.27 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.871 0.869 . . . . 7.29 111.223 171.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 22.5 m 65.11 -9.44 0.2 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 127.046 2.138 . . . . 4.39 115.667 170.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 77.9 mt 59.25 -73.75 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 129.713 3.205 . . . . 6.74 112.349 179.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 3.8 p -177.06 7.95 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.072 0 C-N-CA 127.835 2.454 . . . . 5.44 113.112 -153.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -72.62 -21.58 61.09 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 119.742 -1.849 . . . . 9.4 115.898 -173.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 169.42 -60.28 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 128.975 2.91 . . . . 8.85 107.713 -170.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 37.9 tttt 65.03 -107.95 0.16 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 117.633 -1.175 . . . . 10.3 110.807 162.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 31.6 pt -131.37 131.76 63.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 CA-C-N 120.717 1.599 . . . . 2.45 109.375 176.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 15.2 m -64.47 140.76 58.9 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.171 -0.956 . . . . 2.4 112.212 178.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -60.71 -16.73 42.73 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.606 1.335 . . . . 2.61 114.606 -169.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 14.3 p -56.76 -33.95 67.11 Favored 'General case' 0 N--CA 1.47 0.538 0 O-C-N 120.583 -1.323 . . . . 2.03 112.48 168.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 63.9 m -57.93 -28.47 64.31 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 120.862 -1.149 . . . . 1.46 113.293 174.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.449 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 73.8 t80 -62.14 -63.15 1.34 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.295 1.407 . . . . 1.98 111.735 175.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -60.1 -20.8 60.02 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.585 0.754 . . . . 2.03 112.02 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . 0.424 ' O ' ' HE2' ' B' ' 147' ' ' LYS . 26.7 mt-10 -90.24 -50.26 6.08 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 117.8 -1.095 . . . . 3.62 112.482 -175.193 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . 0.421 ' CG ' HD21 ' B' ' 121' ' ' ASN . 0.0 OUTLIER -55.06 -32.07 61.63 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.092 0.86 . . . . 1.37 111.54 164.248 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 10.0 mt -61.05 -52.26 65.69 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.247 -0.908 . . . . 1.09 112.039 168.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.03 -18.95 60.78 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.643 1.11 . . . . 3.12 113.242 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' B' ' 143' ' ' GLU . 2.0 mppt? -92.02 -48.66 6.63 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.972 1.309 . . . . 2.46 111.232 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -93.57 -28.39 16.07 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.518 1.508 . . . . 2.99 114.901 -175.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 60.0 mt -104.79 25.07 10.85 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.66 1.184 . . . . 1.94 112.201 172.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -54.51 -10.4 0.41 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.84 2.056 . . . . 1.46 116.319 -173.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.64 -64.39 1.15 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.99 -1.069 . . . . 2.06 110.509 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.7 ptp -59.26 -33.17 70.72 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.063 0.847 . . . . 3.0 113.005 170.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 2.3 mp -86.79 67.78 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 123.445 1.593 . . . . 3.89 110.212 170.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 3.3 m -74.06 -11.16 60.24 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 112.873 -1.967 . . . . 4.14 114.978 -157.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -175.72 164.99 3.05 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.298 2.239 . . . . 5.43 110.301 178.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 9.3 m -29.15 -48.99 0.07 Allowed 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 130.167 3.387 . . . . 3.28 113.861 160.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -63.75 -32.96 85.92 Favored Glycine 0 CA--C 1.531 1.089 0 CA-C-N 119.857 1.208 . . . . 2.52 113.863 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -77.44 -49.16 15.39 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.757 1.223 . . . . 2.77 109.202 170.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 17.4 ttp180 -50.08 -29.36 8.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.078 1.751 . . . . 4.96 114.78 179.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 32.9 mtmt -49.83 -30.68 10.25 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.34 1.427 . . . . 4.53 114.308 170.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.68 -20.86 52.97 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.363 1.246 . . . . 0.94 114.363 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -77.49 -52.5 8.97 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.151 0.887 . . . . 0.72 110.675 162.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -61.98 -34.26 75.81 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.387 0.675 . . . . 2.01 112.759 -175.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.35 -30.27 64.69 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.396 -0.815 . . . . 2.71 112.958 174.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 38.4 mt -74.8 -34.25 62.36 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.649 -0.657 . . . . 0.79 111.244 -178.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 28.7 mm -61.84 -48.73 87.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.247 1.019 . . . . 0.87 110.479 -177.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -64.91 -40.93 95.83 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.773 1.229 . . . . 2.94 112.32 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -61.0 -26.11 67.37 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.053 1.341 . . . . 2.56 113.838 171.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -83.58 -80.13 0.19 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 117.368 -1.301 . . . . 2.51 109.465 169.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -50.08 -33.08 17.33 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 120.513 1.506 . . . . 3.46 114.602 -160.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -53.51 -21.01 5.57 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 115.274 1.583 . . . . 3.52 115.274 173.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -128.83 9.71 5.89 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.033 1.733 . . . . 3.45 113.494 168.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.8 6.3 0.91 Allowed 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 116.397 1.999 . . . . 4.2 116.397 -159.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -50.96 144.42 8.72 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 122.226 1.012 . . . . 7.08 112.7 172.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 71.56 -20.44 0.8 Allowed Glycine 0 CA--C 1.535 1.313 0 C-N-CA 126.211 1.862 . . . . 2.73 114.925 -173.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -99.79 135.11 41.7 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.418 1.487 . . . . 5.31 110.422 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.3 mm -145.22 113.71 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 107.023 -1.473 . . . . 2.84 107.023 177.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 2.4 t -87.19 -173.14 4.27 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.678 1.126 . . . . 1.51 113.14 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -92.89 -56.62 2.93 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.031 -1.668 . . . . 2.12 110.769 172.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 17.8 p-10 -61.33 -23.55 65.81 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 129.048 2.939 . . . . 3.02 113.138 176.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 60.8 tt0 -47.62 -58.92 3.68 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.492 1.517 . . . . 3.15 110.856 167.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -51.99 -45.52 64.53 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 120.931 -1.106 . . . . 2.29 112.372 177.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.3 t-105 -65.82 -47.37 75.25 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 118.65 -0.69 . . . . 0.59 111.875 -178.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 8.2 t -72.7 -24.1 60.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 117.684 -1.15 . . . . 1.72 112.975 177.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.449 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 82.5 mt -65.82 -45.24 83.02 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 119.882 1.219 . . . . 0.69 110.815 170.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 34.9 mm -48.03 -43.42 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 CA-C-N 120.734 1.606 . . . . 0.75 112.51 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -58.59 -19.57 42.55 Favored Glycine 0 CA--C 1.538 1.476 0 CA-C-N 118.57 0.623 . . . . 0.73 114.497 177.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.74 -19.36 79.24 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 118.619 1.209 . . . . 0.77 114.147 174.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -117.1 -47.79 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 118.829 1.314 . . . . 1.17 110.108 177.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 20.7 m -74.23 50.68 0.4 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.679 1.991 . . . . 1.5 109.573 166.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -138.97 -64.48 0.04 OUTLIER Glycine 0 CA--C 1.527 0.815 0 C-N-CA 127.022 2.249 . . . . 1.03 109.481 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -62.0 -54.44 1.5 Allowed 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.198 2.599 . . . . 1.23 112.8 172.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 4.2 pt -84.78 -19.38 8.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 N-CA-C 114.672 1.36 . . . . 1.24 114.672 -175.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -53.33 -43.0 67.31 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.963 0.905 . . . . 1.19 112.498 -174.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -54.45 -27.93 40.77 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.167 1.173 . . . . 4.75 114.167 175.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.22 -19.07 61.78 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.443 1.897 . . . . 1.56 111.735 178.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 98.2 mt -57.68 -43.71 84.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 O-C-N 120.062 -1.649 . . . . 1.51 110.561 166.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -74.89 -0.39 18.38 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 115.145 1.535 . . . . 3.98 115.145 177.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -88.63 -66.09 0.95 Allowed 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.568 1.147 . . . . 4.94 111.2 153.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -54.65 -44.94 73.69 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 114.301 1.223 . . . . 2.38 114.301 -167.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -80.86 10.71 4.66 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 123.026 1.393 . . . . 2.73 111.006 -175.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -114.65 -54.07 2.6 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.432 1.493 . . . . 2.51 109.885 166.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -57.07 -19.11 17.36 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.153 2.181 . . . . 5.08 113.887 178.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 34.4 t -123.97 28.76 6.7 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.324 1.849 . . . . 8.18 112.187 172.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 42.4 t -76.51 3.4 11.39 Favored 'General case' 0 CA--C 1.551 0.988 0 O-C-N 119.885 -1.76 . . . . 11.01 115.044 179.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 38.4 t . . . . . 0 C--O 1.252 1.196 0 C-N-CA 128.097 2.559 . . . . 13.51 111.073 -176.961 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 CA--C 1.504 -0.821 0 N-CA-C 108.889 -0.782 . . . . 9.73 108.889 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -136.88 -15.78 1.52 Allowed 'General case' 0 N--CA 1.472 0.661 0 O-C-N 124.997 1.436 . . . . 6.04 113.585 -134.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 71.4 m 66.39 20.33 10.96 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 127.264 2.226 . . . . 3.63 115.364 164.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -42.0 125.95 3.08 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.394 1.877 . . . . 2.67 114.517 -178.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.5 p -66.4 147.84 52.72 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.187 0.595 . . . . 1.56 109.915 164.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -67.12 -17.8 65.03 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 119.276 -0.392 . . . . 2.28 111.712 170.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.6 -48.94 62.86 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.617 1.098 . . . . 0.9 110.062 173.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -51.39 66.99 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.421 -0.585 . . . . 3.37 109.421 175.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -53.89 -37.1 63.39 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.764 0.653 . . . . 4.19 112.764 176.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.778 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -62.58 -37.95 88.21 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 117.609 -1.186 . . . . 0.84 112.896 172.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 16.8 t -58.52 -44.93 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-N 120.914 1.688 . . . . 0.97 110.516 168.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.8 mt -54.69 -46.93 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 CA-C-N 118.765 0.711 . . . . 0.93 110.663 172.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.477 HG21 ' HG2' ' B' ' 110' ' ' GLU . 42.0 t -69.09 -40.49 80.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 124.057 0.943 . . . . 0.66 112.994 -176.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.7 mp -62.74 -39.85 95.41 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.122 -0.986 . . . . 0.98 111.051 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 84.1 t -74.76 -38.14 43.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.72 0.808 . . . . 0.64 112.582 177.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -51.12 -52.16 46.43 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.015 0.926 . . . . 3.17 109.848 168.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -60.38 -30.66 69.72 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 114.486 1.291 . . . . 2.06 114.486 -175.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -80.81 -54.16 5.85 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.225 -0.922 . . . . 1.92 111.812 175.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -69.63 -23.44 63.5 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.734 1.013 . . . . 2.19 113.734 -174.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 42.2 pttt -60.74 -9.25 3.73 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 115.712 1.745 . . . . 2.31 115.712 175.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -107.03 2.28 24.94 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.877 1.271 . . . . 2.4 114.264 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.2 m -126.28 170.14 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 120.111 1.323 . . . . 2.56 110.987 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -67.47 -30.18 69.82 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 116.024 1.861 . . . . 3.92 116.024 -177.073 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 ttpm? 107.84 -30.65 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 131.297 3.839 . . . . 5.04 111.952 -160.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -143.02 101.7 3.87 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.536 1.534 . . . . 7.77 112.617 -177.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 p -169.59 150.03 4.02 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 127.594 2.358 . . . . 4.52 107.246 157.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 90.0 mt -75.21 -61.0 2.05 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 118.739 0.7 . . . . 7.97 109.125 162.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.9 t -144.39 72.19 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 124.486 1.114 . . . . 5.05 110.273 178.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -124.5 -21.97 4.76 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 118.122 -0.942 . . . . 8.4 113.482 160.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -163.14 61.51 0.18 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.903 1.281 . . . . 7.04 111.116 178.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.46 169.9 14.06 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.505 1.122 . . . . 6.54 111.806 168.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.2 pt -75.59 140.59 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 O-C-N 120.985 -1.072 . . . . 2.79 110.28 163.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.0 m -92.97 152.15 19.5 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.624 -0.672 . . . . 2.97 110.457 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.1 mtpt -52.48 -33.18 43.57 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.324 1.45 . . . . 2.56 114.768 -176.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.3 t -69.59 -23.35 63.52 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.545 1.313 . . . . 2.24 114.545 172.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.1 m -77.19 -44.48 29.99 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.85 1.205 . . . . 1.32 111.385 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -51.49 -54.2 29.63 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.416 1.007 . . . . 1.93 111.85 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -57.88 -27.03 62.9 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.91 1.078 . . . . 2.87 113.91 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -94.98 -48.8 5.83 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.63 1.572 . . . . 2.87 110.74 -171.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -49.5 -40.12 36.47 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.713 2.405 . . . . 1.37 112.24 165.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' A' ' 42' ' ' LEU . 7.1 mt -60.25 -20.27 58.22 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.948 1.462 . . . . 1.11 114.948 176.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -92.82 -14.33 27.93 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.592 1.157 . . . . 2.2 112.428 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.36 -53.54 3.89 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.553 1.141 . . . . 1.51 112.599 172.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -78.34 -16.7 57.43 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.55 -0.719 . . . . 2.45 112.287 -174.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -121.51 24.88 9.66 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 126.427 1.891 . . . . 1.7 111.576 179.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -61.94 -39.09 90.87 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.405 2.002 . . . . 1.62 116.405 -162.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.516 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 0.5 OUTLIER -69.58 -19.8 63.66 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.975 1.262 . . . . 1.75 113.228 -174.036 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 52.0 tpp -77.64 -26.55 50.57 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.233 1.813 . . . . 2.09 113.016 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.0 mp -56.75 111.57 1.05 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.069 0.948 . . . . 2.91 110.399 174.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.2 m -100.73 -3.89 29.24 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.364 1.066 . . . . 3.63 111.769 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -178.75 175.46 1.06 Allowed 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 131.366 3.866 . . . . 3.81 106.768 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -53.99 -26.08 24.21 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 117.021 -1.466 . . . . 3.6 111.78 160.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -51.53 -39.96 46.23 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 127.344 2.402 . . . . 1.96 115.0 -174.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -57.07 -47.63 80.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 117.951 0.875 . . . . 3.72 110.78 170.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 12.2 ttt-85 -70.98 -32.24 69.03 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.392 0.677 . . . . 5.37 112.207 175.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -58.84 -38.01 77.73 Favored 'General case' 0 N--CA 1.481 1.078 0 O-C-N 119.516 -1.99 . . . . 3.43 111.334 173.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.77 -14.22 62.36 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.059 1.503 . . . . 1.23 115.059 172.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.64 -53.83 5.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.389 0.995 . . . . 0.94 110.82 164.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.47 -34.98 69.58 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.965 0.906 . . . . 2.06 112.866 -177.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -61.34 -24.31 66.36 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.682 0.993 . . . . 2.71 113.682 174.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.5 mt -78.63 -37.5 42.03 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.257 -0.902 . . . . 0.85 111.135 174.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.4 mm -58.19 -44.6 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.196 0.998 . . . . 0.87 111.558 -176.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -67.22 -38.8 85.87 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.234 1.813 . . . . 2.27 113.173 176.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -62.56 -27.65 69.33 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.916 -0.49 . . . . 3.42 111.972 172.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.4 mp -86.82 -19.89 28.33 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 113.565 0.95 . . . . 3.43 113.565 174.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.49 -25.21 67.89 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 120.419 1.463 . . . . 3.62 111.507 168.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.2 -10.79 59.79 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.474 1.287 . . . . 2.64 114.474 170.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -136.79 -14.08 1.65 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.805 1.78 . . . . 2.71 115.805 -171.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -155.45 119.02 4.45 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 121.195 1.816 . . . . 3.34 114.036 -159.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.9 40.28 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 130.375 3.47 . . . . 4.44 116.563 -170.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.18 13.4 76.51 Favored Glycine 0 CA--C 1.537 1.415 0 O-C-N 119.502 -1.999 . . . . 4.91 114.283 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -86.38 -171.51 3.59 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.212 1.405 . . . . 7.13 108.303 155.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 41.9 pt -147.94 161.6 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 125.966 1.706 . . . . 4.69 107.911 150.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.8 m -74.08 169.1 18.2 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 112.745 0.646 . . . . 2.32 112.745 164.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -63.1 -52.91 60.79 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.07 -1.019 . . . . 1.97 111.069 169.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.6 -33.76 60.92 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 128.142 2.577 . . . . 3.08 113.224 172.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.83 -38.99 76.7 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 118.44 -0.791 . . . . 4.15 112.622 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -53.09 -47.31 68.67 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.655 1.571 . . . . 1.8 110.393 172.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 28.5 t-105 -64.55 -45.86 85.29 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 118.455 -0.783 . . . . 0.6 111.987 176.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.13 -40.64 98.19 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.549 1.068 . . . . 1.61 112.039 -177.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 91.1 mt -63.88 -34.11 77.2 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.839 -0.6 . . . . 0.62 112.1 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.45 -36.21 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 CA-C-N 119.896 1.225 . . . . 0.64 111.6 179.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.48 -18.02 67.25 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 124.929 1.252 . . . . 0.66 114.41 178.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.47 -29.58 59.66 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-N 119.007 1.404 . . . . 0.85 112.737 176.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.441 HD12 ' H ' ' A' ' 86' ' ' ILE . 2.8 mp -86.95 -45.14 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.264 1.026 . . . . 0.92 109.537 168.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.4 m -82.55 57.28 3.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 127.546 2.338 . . . . 1.26 109.989 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -132.74 -67.56 0.08 OUTLIER Glycine 0 CA--C 1.527 0.793 0 C-N-CA 125.825 1.678 . . . . 0.74 110.093 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -66.02 -51.77 1.11 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.269 2.646 . . . . 1.03 112.576 175.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.6 pt -71.84 -17.83 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 N-CA-C 113.95 1.093 . . . . 1.09 113.95 -175.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -50.36 -55.73 14.38 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.763 0.825 . . . . 0.96 111.994 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -61.84 -32.69 73.04 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 120.569 -1.332 . . . . 3.16 113.168 176.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.0 tt -60.39 -40.79 92.17 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 121.146 1.794 . . . . 1.56 111.024 178.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 74.7 mt -53.84 -54.46 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-O 122.156 0.979 . . . . 1.22 110.429 172.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -67.76 -28.38 67.57 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.228 -0.92 . . . . 1.72 113.279 -177.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -73.88 -29.2 61.96 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.597 1.159 . . . . 3.62 111.356 173.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -74.16 -42.5 59.81 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.288 1.035 . . . . 2.13 111.538 174.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -73.47 17.28 0.15 Allowed 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 123.736 1.731 . . . . 2.96 112.211 172.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -124.5 -67.87 0.89 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.522 1.529 . . . . 2.39 110.398 161.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . 0.317 10.4 pt20 42.36 19.66 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 130.437 3.495 . . . . 4.65 115.141 -171.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 3.3 m -146.94 29.26 1.0 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.977 2.511 . . . . 7.17 109.093 -174.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.1 t -79.61 0.0 31.89 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 120.049 -1.657 . . . . 9.19 114.849 -175.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 45.9 t . . . . . 0 C--O 1.252 1.188 1 C-N-CA 132.249 4.22 . . . . 11.0 107.461 -166.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 20.4 m . . . . . 0 CA--C 1.504 -0.8 0 N-CA-C 108.704 -0.85 . . . . 9.62 108.704 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -135.51 -16.26 1.82 Allowed 'General case' 0 N--CA 1.47 0.568 0 O-C-N 124.935 1.397 . . . . 5.66 113.549 -134.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 94.2 m 54.03 43.77 30.29 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.841 2.056 . . . . 3.88 113.858 168.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -53.07 132.49 38.12 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.327 1.051 . . . . 2.87 112.36 -179.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 8.3 p -62.68 152.3 35.84 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.223 -0.658 . . . . 1.22 109.223 173.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . 0.477 ' HG2' HG21 ' A' ' 14' ' ' VAL . 10.4 tp10 -63.85 -27.54 69.24 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 118.415 -0.802 . . . . 2.52 111.489 170.189 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.56 -46.46 85.8 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.759 1.618 . . . . 0.89 109.83 176.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -50.15 32.2 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.597 -0.69 . . . . 2.93 111.142 -177.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -48.74 -38.66 22.27 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.804 1.241 . . . . 4.9 113.255 167.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.778 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -64.98 -42.9 94.14 Favored 'General case' 0 N--CA 1.453 -0.275 0 O-C-N 120.783 -1.198 . . . . 0.76 113.233 171.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 14.0 t -55.74 -42.58 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 CA-C-N 120.917 1.689 . . . . 1.11 110.666 170.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 59.9 mt -56.4 -51.22 66.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-O 118.638 -0.696 . . . . 1.08 110.189 172.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 36.1 t -65.79 -36.6 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.346 0.975 . . . . 0.55 113.342 -176.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -64.26 -37.97 89.37 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.997 -1.064 . . . . 0.95 111.44 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 89.3 t -83.21 -35.32 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 118.619 -0.705 . . . . 0.91 112.396 -178.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -51.16 -54.98 20.33 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.511 1.125 . . . . 3.33 109.634 165.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -57.78 -37.56 73.92 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 113.207 0.817 . . . . 2.01 113.207 -176.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -76.59 -55.87 5.13 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 122.02 -0.425 . . . . 2.25 110.785 -177.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -68.15 -24.05 64.94 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.675 0.991 . . . . 2.23 113.675 -175.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 38.6 pttt -56.81 -16.21 6.17 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 120.979 1.718 . . . . 2.12 115.137 176.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -90.69 -0.7 57.78 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.824 1.787 . . . . 2.13 115.824 173.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.6 m -128.38 177.24 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 125.075 1.35 . . . . 2.62 109.787 176.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.4 p -69.98 -28.97 65.96 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 116.666 -1.635 . . . . 3.9 115.373 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 4.3 ttpm? 111.62 -26.82 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 130.879 3.672 . . . . 5.09 111.852 -156.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -148.11 105.16 3.62 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.811 1.244 . . . . 7.87 114.094 -173.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 3.8 p -168.63 149.31 4.63 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 127.572 2.349 . . . . 4.71 107.74 155.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 93.8 mt -74.87 -61.77 1.77 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 119.321 0.964 . . . . 7.8 109.731 163.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . 0.418 HG13 ' HD2' ' B' ' 135' ' ' LYS . 21.3 t -147.21 71.22 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.128 1.371 . . . . 5.22 109.002 -177.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -132.79 -15.29 2.7 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.168 1.387 . . . . 8.5 114.266 164.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -159.91 30.22 0.18 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.798 0.839 . . . . 7.19 112.609 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . 0.418 ' HD2' HG13 ' B' ' 132' ' ' VAL . 0.0 OUTLIER -71.83 151.09 43.72 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 120.48 -1.388 . . . . 6.45 111.956 176.071 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 28.5 pt -63.83 151.38 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 120.899 -1.125 . . . . 2.31 111.092 176.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 20.6 m -91.26 155.14 18.77 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 120.396 -1.44 . . . . 2.62 110.737 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -55.48 -30.75 61.16 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.016 0.926 . . . . 2.64 113.118 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 39.3 t -69.18 -20.4 64.0 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 115.31 1.596 . . . . 2.39 115.31 170.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 16.4 m -74.49 -41.46 60.67 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 120.638 1.563 . . . . 1.42 111.444 176.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.463 ' CZ ' HD11 ' B' ' 145' ' ' LEU . 35.9 t80 -56.35 -53.46 57.08 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 118.906 0.776 . . . . 2.04 111.29 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 30.4 ptt180 -57.12 -23.62 48.41 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.109 0.964 . . . . 2.58 113.092 178.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 tm-20 -99.48 -45.11 5.93 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.024 1.33 . . . . 2.93 112.131 -173.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 11.9 tmm? -51.62 -36.44 45.83 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 126.062 1.745 . . . . 1.2 112.175 167.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . 0.463 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 12.4 mt -65.94 -12.4 54.5 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 115.917 1.821 . . . . 1.06 115.917 172.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 11.6 tt0 -86.26 -25.14 25.7 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 123.826 0.85 . . . . 2.28 112.592 169.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.02 -61.39 1.41 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.761 1.624 . . . . 1.62 112.45 -175.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -70.51 -16.12 62.86 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.604 0.761 . . . . 2.64 111.658 -175.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.83 17.12 11.85 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.683 1.993 . . . . 1.73 113.472 177.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -49.49 -37.73 27.49 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.468 1.655 . . . . 1.78 115.468 -171.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . 0.439 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 12.3 m-70 -63.45 -28.46 69.99 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.882 1.273 . . . . 1.94 113.917 -175.548 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 60.1 tpp -81.79 -22.88 36.89 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.177 1.391 . . . . 2.05 113.421 -172.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 11.2 mp -58.13 116.32 3.47 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.251 1.42 . . . . 3.01 111.024 176.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 45.9 m -97.46 -4.85 37.32 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.836 0.854 . . . . 3.8 112.616 172.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 12.4 t70 175.71 179.23 0.16 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 129.939 3.295 . . . . 3.95 106.694 -168.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 12.4 t -55.49 -26.23 41.5 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 116.931 -1.509 . . . . 3.56 112.077 160.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -51.32 -46.1 52.23 Favored Glycine 0 N--CA 1.471 1.023 0 C-N-CA 126.468 1.985 . . . . 2.0 115.46 -171.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -53.81 -45.05 70.68 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.244 1.022 . . . . 3.69 111.173 171.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.7 ttt-85 -74.13 -33.78 63.67 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.516 0.726 . . . . 5.08 111.99 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 60.0 mmtt -56.62 -38.18 71.72 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 120.82 1.645 . . . . 3.34 111.448 172.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -65.49 -14.46 61.06 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 115.089 1.515 . . . . 1.29 115.089 173.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -85.67 -50.62 7.05 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.565 1.075 . . . . 1.0 111.886 165.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.61 -37.63 76.29 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.957 0.903 . . . . 2.14 112.458 -178.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -60.42 -25.29 65.85 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.506 0.928 . . . . 2.7 113.506 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 15.6 mt -76.21 -37.7 57.41 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.13 -0.981 . . . . 0.8 111.123 176.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 28.1 mm -57.13 -43.73 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.076 0.95 . . . . 0.86 111.337 -175.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -69.32 -41.11 77.15 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.505 1.922 . . . . 2.42 113.054 175.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -59.53 -27.18 65.97 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.862 -0.524 . . . . 3.53 112.138 170.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 6.2 mp -86.57 -19.62 29.15 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 114.227 1.195 . . . . 3.29 114.227 174.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -22.71 67.04 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 120.296 1.407 . . . . 3.77 112.026 167.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -74.59 -9.56 58.69 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 114.309 1.225 . . . . 3.01 114.309 168.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -138.0 -14.95 1.35 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 116.455 2.02 . . . . 2.77 116.455 -170.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -154.7 122.06 5.68 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 121.079 1.763 . . . . 3.14 114.187 -159.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -71.75 41.81 0.08 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 128.936 2.894 . . . . 4.43 116.034 -171.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 76.32 0.36 66.26 Favored Glycine 0 CA--C 1.534 1.269 0 O-C-N 119.996 -1.69 . . . . 5.1 114.195 177.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -78.94 -175.47 4.53 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.309 1.444 . . . . 7.12 108.826 160.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 16.6 pt -147.51 155.74 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 128.098 2.559 . . . . 4.42 106.871 158.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 4.2 m -77.65 -177.53 4.86 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.464 0.706 . . . . 2.31 112.687 165.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -69.51 -54.27 15.0 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 122.281 1.038 . . . . 2.12 110.462 169.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.68 -37.35 18.3 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 128.99 2.916 . . . . 3.14 113.7 172.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -66.96 -42.97 84.27 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.14 0.976 . . . . 4.7 112.886 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -53.8 -47.4 70.86 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.362 -1.462 . . . . 1.88 111.176 173.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 28.7 t-105 -63.41 -45.07 92.69 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 118.621 -0.704 . . . . 0.71 111.484 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -63.91 -41.71 97.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.734 0.814 . . . . 1.52 111.569 -179.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.424 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 87.0 mt -64.82 -33.44 76.01 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.399 -0.81 . . . . 0.63 112.446 179.338 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 36.8 mm -56.98 -34.66 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 CA-C-N 120.698 1.59 . . . . 0.6 111.823 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.66 -20.19 69.89 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 124.292 0.949 . . . . 0.66 114.079 176.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -72.78 -27.6 68.74 Favored Glycine 0 CA--C 1.529 0.916 0 CA-C-N 118.282 1.041 . . . . 0.73 113.218 177.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -89.82 -42.75 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.446 1.099 . . . . 0.96 110.127 167.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 6.2 m -83.14 57.34 3.89 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.935 2.094 . . . . 1.31 110.5 -177.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -126.17 -71.64 0.19 Allowed Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.831 1.682 . . . . 0.72 110.57 177.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.5 -44.19 1.15 Allowed 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 123.017 2.478 . . . . 1.06 112.71 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 12.9 pt -72.0 -22.35 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 119.091 0.859 . . . . 1.1 113.128 -173.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -45.41 -62.65 1.19 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.374 1.47 . . . . 1.09 112.988 177.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -64.37 -26.82 68.64 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 120.539 -1.351 . . . . 3.63 113.36 -179.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.47 -41.78 97.76 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.796 1.634 . . . . 1.66 110.621 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 53.4 mt -53.69 -56.06 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-O 121.867 0.842 . . . . 1.4 110.682 170.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 43.4 t60 -63.19 -28.95 70.4 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.09 1.144 . . . . 1.82 114.09 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -74.43 -28.24 60.97 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.796 1.238 . . . . 3.71 111.657 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -74.72 -40.56 61.24 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.501 1.12 . . . . 2.25 111.164 171.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -73.2 19.59 0.09 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 126.662 1.985 . . . . 2.88 112.293 170.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -127.97 -61.68 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 125.238 1.415 . . . . 2.61 109.652 159.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.307 12.2 pt20 41.71 18.66 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 130.127 3.371 . . . . 4.95 115.366 -171.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 1.9 m -146.59 27.49 1.11 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 127.769 2.428 . . . . 7.13 109.607 -174.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 33.4 t -81.74 4.15 23.05 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 119.869 -1.769 . . . . 9.22 114.211 -178.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 48.5 t . . . . . 0 C--O 1.251 1.135 1 C-N-CA 132.527 4.331 . . . . 10.76 107.303 -166.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.0 m . . . . . 0 CA--C 1.508 -0.642 0 CA-C-O 117.14 -1.409 . . . . 11.34 108.51 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 72.43 -53.01 0.7 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.957 2.206 . . . . 9.94 116.957 130.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 21.2 m 136.62 -31.56 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 1 C-N-CA 134.064 4.946 . . . . 3.42 109.304 -173.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.57 142.5 42.72 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.135 1.374 . . . . 2.85 110.476 165.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 60.1 p -65.7 148.87 51.05 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 120.142 1.337 . . . . 1.17 110.138 168.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tp10 -63.71 -36.65 84.56 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.743 -0.598 . . . . 2.09 111.644 -175.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.72 -48.39 80.95 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.273 1.429 . . . . 1.32 110.031 174.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -72.82 -43.52 62.58 Favored 'General case' 0 C--O 1.23 0.072 0 CA-C-N 118.142 0.428 . . . . 3.67 111.442 -173.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -48.51 -42.86 34.34 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.921 1.288 . . . . 5.41 111.432 163.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.416 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -71.96 -30.22 65.07 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 116.762 -1.59 . . . . 0.76 114.511 175.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.7 t -55.59 -33.81 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 CA-C-N 122.447 2.385 . . . . 0.95 111.095 167.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 16.8 mt -56.89 -63.34 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 CA-C-N 119.588 1.085 . . . . 1.38 111.401 162.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.7 t -50.1 -43.31 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.095 1.358 . . . . 0.58 113.279 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.4 mp -66.44 -39.93 89.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.541 1.136 . . . . 1.05 112.245 176.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.3 t -68.61 -45.98 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.906 0.883 . . . . 0.66 110.258 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.3 tt0 -55.88 -44.86 78.54 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.364 0.529 . . . . 3.12 111.027 171.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -69.1 -17.42 63.85 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 115.23 1.567 . . . . 2.4 115.23 -170.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -80.74 -61.48 1.96 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.208 0.603 . . . . 1.96 111.368 161.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -68.12 -22.9 64.86 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.376 0.88 . . . . 1.92 113.376 -164.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -49.1 -24.2 1.53 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 125.018 1.327 . . . . 2.75 113.084 170.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -94.43 -2.76 51.36 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.512 1.525 . . . . 2.16 114.998 178.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.531 HG23 ' H ' ' A' ' 24' ' ' SER . 16.3 m -130.0 -101.07 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 125.593 1.557 . . . . 2.25 112.8 -178.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.531 ' H ' HG23 ' A' ' 23' ' ' VAL . 1.9 p 162.53 159.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 128.905 2.882 . . . . 5.23 114.079 -178.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.488 ' HE3' ' HB2' ' B' ' 199' ' ' GLU . 43.1 tttt -18.34 -64.08 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 129.707 3.203 . . . . 8.42 117.342 -170.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -124.99 27.61 6.66 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 126.215 1.806 . . . . 8.5 112.759 -178.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.5 m -70.31 45.68 0.08 Allowed 'General case' 0 CA--C 1.55 0.944 0 O-C-N 120.242 -1.536 . . . . 4.63 112.555 170.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 71.7 mt -62.17 -23.34 66.54 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 116.573 2.064 . . . . 8.51 116.573 -157.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.414 ' HA ' ' HA ' ' A' ' 75' ' ' SER . 2.4 p -126.82 4.72 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 127.391 2.276 . . . . 5.91 112.345 170.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.21 105.37 16.48 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.497 1.519 . . . . 7.72 112.288 -159.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 t-20 -42.65 126.04 3.52 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.076 1.75 . . . . 8.1 112.645 170.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.5 tmtm? -126.1 8.93 7.36 Favored 'General case' 0 CA--C 1.556 1.177 0 O-C-N 121.13 -0.981 . . . . 9.24 110.566 145.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.9 pt -150.98 146.75 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 131.147 3.779 . . . . 3.13 107.42 175.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.2 m -99.8 168.9 9.6 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 121.69 -0.631 . . . . 2.82 111.302 172.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.02 -35.48 15.54 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 126.835 2.054 . . . . 2.47 112.525 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.6 p -55.44 -19.62 9.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.889 2.076 . . . . 1.97 114.843 173.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m -79.17 -46.44 17.93 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.398 0.999 . . . . 1.54 111.253 175.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -51.47 -51.87 51.36 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.556 1.142 . . . . 1.79 111.768 -177.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -52.67 -26.78 14.77 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.177 1.177 . . . . 3.74 114.177 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -108.04 -40.08 5.32 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.457 1.103 . . . . 3.76 112.792 -172.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -46.32 -46.17 17.97 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.122 0.969 . . . . 1.32 110.577 162.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.3 mt -45.85 -67.1 0.31 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.453 1.501 . . . . 1.6 111.703 165.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -67.27 -12.04 59.06 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 115.544 1.683 . . . . 2.14 115.544 -172.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.81 -43.44 10.64 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.505 0.928 . . . . 1.75 113.505 169.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -104.14 -31.06 9.83 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.761 1.225 . . . . 2.7 113.375 -166.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 50.3 mt -109.34 62.64 0.6 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 127.819 2.448 . . . . 2.6 109.838 164.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -94.65 -12.26 27.7 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 115.147 1.536 . . . . 1.31 115.147 -177.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 -91.14 -36.76 13.79 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 120.425 -1.422 . . . . 1.65 113.014 -173.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 3.2 mmm -81.31 5.14 18.2 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.302 1.441 . . . . 2.34 111.25 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.4 tp -66.88 83.49 0.11 Allowed 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 127.566 2.346 . . . . 3.2 110.952 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.6 t -69.38 59.94 0.13 Allowed 'General case' 0 CA--C 1.549 0.94 0 O-C-N 121.281 -0.887 . . . . 5.06 111.529 165.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.0 t70 51.09 -132.25 1.94 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 129.639 3.176 . . . . 3.97 112.879 171.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.1 m -71.42 -36.85 71.44 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 126.665 1.986 . . . . 4.0 109.951 -172.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.18 -51.35 59.37 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-N 119.518 1.054 . . . . 2.47 111.63 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -60.15 -52.31 65.86 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.28 1.032 . . . . 3.73 112.53 174.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.5 ttt-85 -76.65 -31.66 57.48 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.628 -0.67 . . . . 4.69 112.608 -170.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -68.2 -32.6 72.94 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 120.112 -1.617 . . . . 3.61 112.33 167.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.68 -19.83 59.46 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.392 1.256 . . . . 1.01 114.392 169.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.85 -56.51 4.53 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 119.994 1.27 . . . . 0.64 111.869 162.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.96 -31.44 72.55 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.172 1.175 . . . . 2.09 114.172 -173.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -57.36 -28.4 63.14 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.35 -0.843 . . . . 2.68 113.173 173.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.8 mt -75.37 -43.72 48.89 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.039 0.935 . . . . 1.06 110.802 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 38.0 mm -56.9 -53.65 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 126.066 1.746 . . . . 1.09 110.728 -175.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -58.92 -29.68 67.26 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.997 1.319 . . . . 1.97 113.624 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.5 -24.72 42.1 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.484 1.914 . . . . 2.46 113.524 176.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 mt -124.05 -20.56 5.3 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.672 2.101 . . . . 2.99 116.672 -168.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -61.89 -25.33 67.49 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.627 1.103 . . . . 3.3 110.734 154.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -79.47 -21.29 45.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.53 1.532 . . . . 2.87 114.836 171.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -128.58 17.04 6.43 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 119.939 1.245 . . . . 3.77 114.031 -174.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -153.78 126.99 8.46 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 120.556 -1.34 . . . . 3.85 111.736 173.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.07 59.26 3.22 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 127.284 2.234 . . . . 5.3 114.226 -148.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.65 4.59 26.32 Favored Glycine 0 CA--C 1.534 1.277 0 O-C-N 120.727 -1.233 . . . . 3.02 112.566 -165.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 75.2 mmt-85 -75.29 151.55 38.32 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 127.006 2.122 . . . . 4.95 111.413 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.6 mm -140.06 113.52 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 105.134 -2.173 . . . . 2.91 105.134 166.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 29' ' ' VAL . 1.2 m -79.72 173.68 12.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 118.967 0.803 . . . . 1.97 112.153 168.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -55.03 -50.12 69.86 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.828 0.823 . . . . 2.03 111.403 156.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.76 -26.58 67.79 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 126.492 1.917 . . . . 3.32 113.994 -174.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -58.94 -55.24 37.68 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.938 1.295 . . . . 3.49 110.952 173.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -54.85 -48.36 73.0 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 120.726 -1.234 . . . . 2.33 111.668 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 24.6 t-105 -63.02 -44.03 97.08 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.163 0.801 . . . . 0.58 113.163 -177.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.9 t -67.58 -42.68 82.13 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.288 0.949 . . . . 1.82 110.997 178.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.1 -39.12 93.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 117.975 -1.012 . . . . 0.71 112.337 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 28.7 mm -52.47 -40.58 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 CA-C-N 120.62 1.555 . . . . 0.7 111.5 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -68.19 -22.07 74.22 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 123.843 0.735 . . . . 0.71 113.922 -178.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.38 -30.15 76.1 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-N 118.343 1.072 . . . . 0.68 112.368 174.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -89.03 -47.73 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 124.069 0.947 . . . . 0.87 109.514 167.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.2 m -83.62 59.35 5.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.327 2.251 . . . . 1.51 110.948 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -151.06 -57.35 0.01 OUTLIER Glycine 0 CA--C 1.529 0.95 0 C-N-CA 126.642 2.068 . . . . 0.94 110.974 -178.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.02 -60.46 0.44 Allowed 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.445 2.097 . . . . 1.13 111.569 167.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.2 pt -64.24 -18.32 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 N-CA-C 115.425 1.639 . . . . 1.24 115.425 -175.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.32 -45.52 69.06 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.282 1.433 . . . . 1.1 113.026 -175.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -60.75 -36.76 79.72 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.618 0.767 . . . . 5.23 112.786 178.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 4.3 tt -75.15 -44.59 46.03 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.702 1.601 . . . . 1.09 109.875 -176.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 42.2 mt -52.51 -60.58 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.495 0.718 . . . . 1.11 109.491 168.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -55.52 -40.54 71.94 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 118.42 -0.8 . . . . 2.14 112.99 -176.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.477 ' HB2' ' HE3' ' B' ' 128' ' ' LYS . 11.8 pt-20 -69.66 -36.7 76.27 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 119.672 -0.811 . . . . 3.31 111.638 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -70.82 -34.29 71.57 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 117.708 -1.139 . . . . 3.88 113.879 -174.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -63.33 -12.24 28.32 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.443 1.02 . . . . 2.81 112.396 172.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -111.14 -40.28 4.51 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.613 1.565 . . . . 2.64 112.907 179.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -87.13 -3.66 59.08 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.349 2.26 . . . . 7.59 112.155 -172.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 49.1 m -153.93 28.65 0.47 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.951 1.301 . . . . 7.06 112.813 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.4 m -64.23 -21.66 66.66 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.402 2.001 . . . . 11.15 116.402 -172.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 35.8 m . . . . . 0 C--O 1.253 1.287 0 C-N-CA 129.966 3.307 . . . . 13.86 109.87 -172.743 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 8.5 m . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 118.338 -0.839 . . . . 10.99 110.293 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 87.27 -37.31 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 114.204 1.187 . . . . 9.43 114.204 139.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 1.5 m -177.07 -40.66 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 131.436 3.895 . . . . 3.91 107.231 -178.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.32 105.63 0.95 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 109.966 -0.383 . . . . 2.98 109.966 171.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 10.4 p -59.78 147.94 36.21 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 120.707 0.289 . . . . 0.9 110.642 -165.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.4 tp10 -63.96 -32.52 74.09 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 121.925 -0.484 . . . . 2.3 111.942 -174.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.9 -47.68 76.92 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.427 1.091 . . . . 0.91 110.164 171.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -74.04 -44.98 52.44 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 119.544 1.065 . . . . 3.46 112.748 -172.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 44.6 tttm -42.72 -47.21 5.35 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.368 1.467 . . . . 5.04 112.43 157.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.416 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -70.27 -31.96 69.56 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 117.165 -1.398 . . . . 0.59 114.284 176.186 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 32.8 t -59.72 -33.58 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 121.253 1.842 . . . . 1.02 110.747 171.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 11.8 mt -55.9 -63.59 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 CA-C-N 119.377 0.99 . . . . 1.46 110.58 164.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 83.4 t -55.35 -40.47 57.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.398 1.479 . . . . 0.57 112.936 -173.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 5.9 mp -62.57 -35.01 78.11 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.118 0.967 . . . . 1.1 112.319 175.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 70.5 t -80.86 -41.54 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.538 1.135 . . . . 0.58 110.735 -177.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 64.7 tt0 -56.96 -45.67 82.71 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.363 0.529 . . . . 3.06 111.087 171.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -59.25 -27.94 66.26 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 114.51 1.3 . . . . 2.01 114.51 -177.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -79.46 -60.35 2.4 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.236 0.926 . . . . 1.92 111.296 173.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -65.73 -24.14 66.9 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.1 0.778 . . . . 1.96 113.1 -169.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -51.55 -23.51 4.24 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 114.547 1.314 . . . . 2.89 114.547 175.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -89.55 -11.09 43.79 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 115.045 1.498 . . . . 2.35 115.045 175.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.412 HG23 ' H ' ' B' ' 127' ' ' SER . 27.4 m -127.93 -118.63 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 126.267 1.827 . . . . 2.17 111.864 -169.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . 0.412 ' H ' HG23 ' B' ' 126' ' ' VAL . 24.8 m -162.54 165.56 25.88 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 121.069 1.758 . . . . 5.42 113.459 -176.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.477 ' HE3' ' HB2' ' A' ' 96' ' ' GLU . 59.0 tttt -37.64 -48.43 1.04 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 128.079 2.552 . . . . 7.99 115.802 -171.09 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -126.16 36.61 4.48 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.383 1.873 . . . . 8.31 112.421 -177.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 16.8 m -71.1 67.0 0.42 Allowed 'General case' 0 N--CA 1.478 0.97 0 O-C-N 120.776 -1.202 . . . . 6.12 113.624 175.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 90.9 mt -77.23 -17.75 58.22 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.309 1.226 . . . . 8.82 114.309 -178.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -140.6 -1.74 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 126.337 1.855 . . . . 5.69 112.887 173.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -93.49 108.18 19.91 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 120.793 -1.192 . . . . 7.35 113.696 -169.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -51.72 123.24 9.66 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 114.09 -1.414 . . . . 8.46 109.757 155.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -117.64 -7.02 11.09 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.682 0.793 . . . . 8.3 109.805 147.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 8.8 pt -136.7 153.48 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 128.49 2.716 . . . . 3.22 108.368 167.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 75.7 m -100.06 174.27 6.25 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.259 0.624 . . . . 3.13 110.837 169.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . 0.404 ' HE2' ' HB2' ' B' ' 138' ' ' LYS . 3.0 mppt? -48.12 -30.74 4.81 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 113.767 1.025 . . . . 1.99 113.767 177.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 14.1 p -50.46 -30.36 12.52 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.628 1.344 . . . . 2.13 114.628 172.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 51.0 m -82.4 -32.42 29.14 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.41 1.004 . . . . 1.17 112.754 174.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.424 ' CE1' HD11 ' B' ' 145' ' ' LEU . 29.0 t80 -60.95 -48.57 81.21 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 120.007 1.276 . . . . 1.92 111.38 179.035 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -56.86 -28.63 61.99 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.114 0.783 . . . . 4.07 113.114 174.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.36 -52.09 5.83 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 125.253 1.421 . . . . 2.63 111.81 -173.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 7.0 tmm? -47.24 -41.02 17.77 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.792 1.237 . . . . 1.26 111.402 167.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . 0.424 HD11 ' CE1' ' B' ' 141' ' ' PHE . 30.7 mt -56.52 -70.86 0.1 Allowed 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 123.949 0.899 . . . . 1.46 111.502 167.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -72.37 -1.7 16.52 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.742 1.756 . . . . 2.93 115.742 -171.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.25 -50.84 3.51 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.704 1.602 . . . . 1.65 114.767 166.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -100.28 -26.18 14.0 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.102 1.319 . . . . 2.87 113.468 -172.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 22.2 mt -101.89 65.12 0.98 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.633 1.173 . . . . 2.92 110.3 160.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -96.96 -8.79 29.74 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.636 1.347 . . . . 1.28 114.636 -177.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 36.3 m-70 -93.89 -32.08 14.06 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 120.489 -1.382 . . . . 1.64 113.458 -171.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 3.0 mmm -91.25 -2.39 57.46 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.817 2.047 . . . . 2.37 111.365 173.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.4 tp -71.47 74.45 0.76 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.857 2.063 . . . . 2.36 111.322 -173.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 33.8 t -68.64 72.98 0.24 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.302 1.841 . . . . 4.41 112.635 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 21.8 t70 38.2 -133.43 0.13 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 130.146 3.378 . . . . 4.33 113.258 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 81.8 m -69.76 -40.99 75.76 Favored 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 125.097 1.359 . . . . 4.35 111.19 -165.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.37 -48.17 87.49 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-N 119.562 1.074 . . . . 2.51 111.747 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -72.47 -41.73 65.72 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.108 0.781 . . . . 3.38 113.108 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 1.9 tpt180 -67.12 -40.24 86.8 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 120.256 -1.527 . . . . 4.93 112.124 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 27.5 mmmt -67.23 -31.36 71.67 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 120.617 -1.302 . . . . 3.87 112.401 170.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -64.49 -19.81 65.81 Favored 'General case' 0 CA--C 1.55 0.968 0 N-CA-C 114.651 1.352 . . . . 1.26 114.651 169.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.28 -57.7 3.64 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.808 1.185 . . . . 0.84 111.632 162.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -65.73 -26.37 67.71 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.736 1.013 . . . . 2.25 113.736 -172.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -56.47 -34.07 66.55 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.014 -1.054 . . . . 2.78 112.254 169.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 21.0 mt -75.7 -34.59 60.41 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.803 0.441 . . . . 0.76 111.593 -177.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 38.7 mm -62.47 -55.23 25.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 124.746 1.218 . . . . 1.08 109.744 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -60.73 -33.71 73.31 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.899 0.857 . . . . 1.95 112.88 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -64.48 -24.53 67.65 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.469 1.508 . . . . 2.55 113.308 174.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -125.32 -23.48 4.14 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 115.526 1.676 . . . . 2.65 115.526 -165.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -61.74 -13.61 24.78 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 121.065 -1.022 . . . . 3.3 112.139 153.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.86 -12.53 59.41 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 115.435 1.643 . . . . 2.7 115.435 163.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -134.48 -3.64 2.66 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 116.049 1.87 . . . . 3.18 116.049 -169.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -149.8 90.36 1.69 Allowed 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 120.853 1.66 . . . . 3.74 114.72 -170.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -81.07 116.42 21.0 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.094 1.757 . . . . 6.04 112.894 -178.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 67.02 8.59 50.27 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 115.989 1.156 . . . . 2.63 115.989 165.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 36.2 mmt-85 -112.31 163.57 14.23 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.078 1.751 . . . . 5.22 110.428 173.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 25.8 mm -149.82 129.78 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 126.375 1.87 . . . . 2.62 106.469 161.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 11.3 m -93.25 171.75 8.73 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.216 1.006 . . . . 1.93 111.065 171.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -71.37 -50.36 32.99 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 122.048 0.928 . . . . 2.25 111.956 173.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -70.79 -18.48 62.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.189 2.196 . . . . 3.04 113.621 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -54.38 -55.7 26.02 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.93 1.692 . . . . 3.44 111.569 167.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -55.22 -44.8 75.76 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.662 -1.274 . . . . 2.42 111.824 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 22.9 t-105 -62.93 -45.62 91.64 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.742 -0.647 . . . . 0.74 112.419 -177.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 6.8 t -71.59 -40.09 70.12 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 118.668 -0.682 . . . . 1.72 111.827 178.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 85.9 mt -56.42 -49.31 74.9 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 117.888 -1.053 . . . . 0.56 111.091 173.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 26.7 mm -50.13 -36.97 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-N 120.53 1.514 . . . . 0.65 112.63 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.42 -26.87 66.92 Favored Glycine 0 CA--C 1.53 1.023 0 CA-C-O 119.121 -0.821 . . . . 0.59 113.257 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -73.9 -31.5 60.0 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 118.313 1.056 . . . . 0.88 113.922 178.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . 0.463 ' H ' HD12 ' B' ' 189' ' ' ILE . 1.1 mp -85.99 -36.0 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 118.638 1.219 . . . . 0.84 110.877 173.273 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 62.6 m -71.46 -54.63 9.99 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.17 1.388 . . . . 2.92 111.475 -176.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -46.63 -41.85 13.44 Favored Glycine 0 CA--C 1.539 1.588 0 CA-C-O 117.264 -1.853 . . . . 0.95 116.705 -175.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.92 -51.91 2.02 Favored 'Trans proline' 0 C--N 1.353 0.812 0 CA-C-N 122.173 2.986 . . . . 1.28 112.046 175.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 25.2 pt -81.11 -15.49 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 N-CA-C 114.722 1.379 . . . . 0.92 114.722 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -49.8 -43.76 48.65 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.692 1.597 . . . . 0.97 112.849 -178.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 2.6 ptpp? -59.7 -36.31 76.26 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.962 0.905 . . . . 5.38 113.349 175.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 3.4 tt -77.89 -41.31 37.07 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.894 1.678 . . . . 1.46 110.091 -176.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 24.2 mt -56.22 -60.86 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.413 0.685 . . . . 1.14 109.347 168.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -54.58 -39.36 67.72 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 113.256 0.836 . . . . 2.22 113.256 -177.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . 0.488 ' HB2' ' HE3' ' A' ' 25' ' ' LYS . 12.3 pt-20 -68.89 -38.02 79.39 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 119.745 -0.782 . . . . 3.29 111.627 178.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -70.14 -34.23 72.78 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 117.959 -1.019 . . . . 3.94 113.281 -173.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -63.01 -9.7 11.1 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 119.407 1.003 . . . . 2.76 112.942 171.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -114.15 -39.14 3.96 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.773 1.629 . . . . 2.69 113.33 177.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -87.73 -3.51 58.95 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.185 2.194 . . . . 7.78 112.159 -172.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 48.8 m -153.99 28.35 0.47 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.843 1.257 . . . . 6.75 112.992 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 1.3 m -66.51 -23.99 66.33 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 116.324 1.972 . . . . 10.78 116.324 -172.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 34.4 m . . . . . 0 C--O 1.254 1.291 0 C-N-CA 130.275 3.43 . . . . 13.52 110.071 -173.641 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.511 -0.556 0 CA-C-O 120.314 0.102 . . . . 11.09 110.921 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -63.11 -141.36 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.388 0 O-C-N 124.966 1.416 . . . . 8.37 109.796 146.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 13.6 t -79.85 -4.19 51.15 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.258 1.823 . . . . 4.0 112.982 176.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -66.61 155.19 38.54 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.854 1.262 . . . . 2.58 112.322 169.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.1 p -62.67 144.95 55.76 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 108.006 -1.109 . . . . 1.08 108.006 159.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.41 -43.54 98.57 Favored 'General case' 0 C--O 1.213 -0.834 0 CA-C-O 116.815 -1.564 . . . . 2.55 110.071 176.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -46.89 -48.44 21.18 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 120.3 1.409 . . . . 0.93 110.363 177.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -71.54 -51.21 24.75 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 118.045 -0.979 . . . . 2.94 112.581 -175.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 34.5 tptt -61.84 -23.89 66.55 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 121.456 1.935 . . . . 6.05 114.082 170.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.798 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -71.04 -38.79 72.55 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 125.338 1.455 . . . . 0.88 111.302 167.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.86 -41.09 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 121.04 1.745 . . . . 0.78 110.07 169.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.517 HD13 HG23 ' B' ' 197' ' ' ILE . 16.6 mm -53.07 -50.56 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 119.567 1.076 . . . . 1.36 111.063 167.239 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.7 t -62.43 -38.03 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.823 1.192 . . . . 0.76 111.99 179.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp -70.52 -26.84 63.77 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 120.705 -1.247 . . . . 1.15 112.584 175.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 97.3 t -81.41 -38.3 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 118.932 0.787 . . . . 0.76 111.311 175.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -52.57 -48.66 66.05 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.984 0.914 . . . . 3.36 110.512 165.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.504 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 3.3 t30 -63.98 -15.39 59.18 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.516 1.673 . . . . 2.48 115.516 -171.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -88.86 -60.56 1.92 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.846 0.858 . . . . 2.01 111.886 166.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -68.23 -22.39 64.79 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.383 1.253 . . . . 1.82 114.383 -169.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.504 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 9.1 ptmt -52.54 -19.89 2.58 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 115.707 1.743 . . . . 2.53 115.707 -177.191 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -96.53 -1.43 47.17 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 115.36 1.615 . . . . 3.43 115.36 174.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 19.9 m -137.29 144.46 31.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 CA-C-N 120.704 1.593 . . . . 2.97 112.377 -172.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.1 p -84.55 70.5 10.73 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.376 1.25 . . . . 3.92 114.376 -175.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.9 ttpp 72.81 -43.67 0.57 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 127.687 2.395 . . . . 6.93 115.976 149.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -136.09 117.83 15.05 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.412 -1.43 . . . . 8.9 110.532 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.448 ' HB3' ' HE2' ' A' ' 30' ' ' LYS . 84.5 p -170.98 146.43 2.48 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.484 1.114 . . . . 4.39 113.718 155.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.48 -78.8 0.08 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 107.186 -1.413 . . . . 7.9 107.186 143.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 t -80.1 -109.09 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 125.071 1.349 . . . . 4.82 110.9 175.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.448 ' HE2' ' HB3' ' A' ' 27' ' ' SER . 19.7 mtmt 54.34 -4.53 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 126.394 1.878 . . . . 8.19 115.103 -160.039 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 58.42 154.83 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.306 1.842 . . . . 7.45 113.005 -144.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.4 mtmm -131.75 -157.28 0.81 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.854 1.661 . . . . 9.3 107.931 167.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 37.7 pt -64.23 162.43 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.6 -0.688 . . . . 2.86 111.331 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.0 m -71.05 145.87 49.66 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.646 -0.659 . . . . 2.64 110.578 170.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -59.39 -25.9 64.67 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 119.765 -1.834 . . . . 1.96 113.12 172.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.1 p -72.71 -20.42 61.22 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 114.04 1.126 . . . . 1.67 114.04 169.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 39.6 m -71.54 -21.03 61.95 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 120.748 -1.22 . . . . 1.07 111.527 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.447 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 51.0 t80 -58.98 -59.24 5.78 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.548 1.067 . . . . 2.19 111.206 172.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -61.84 -19.67 62.84 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.878 0.871 . . . . 2.51 113.301 -176.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.41 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 9.6 tt0 -88.82 -49.88 6.56 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 127.175 2.19 . . . . 2.94 110.685 179.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 7.1 tmm? -54.4 -40.13 67.93 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.642 1.577 . . . . 1.29 111.599 173.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.3 mt -49.77 -32.64 14.3 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.252 1.421 . . . . 1.33 113.206 168.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.84 -5.61 50.61 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 120.103 1.32 . . . . 3.25 113.823 -178.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.41 ' HE2' ' O ' ' A' ' 40' ' ' GLU . 0.0 OUTLIER -97.23 -51.58 4.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.676 0.79 . . . . 1.46 111.186 168.074 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -96.06 -21.38 18.0 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.597 0.962 . . . . 2.81 113.597 -167.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.01 34.61 4.84 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.427 1.891 . . . . 1.52 111.616 -176.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.6 p30 -80.42 -15.23 57.3 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 116.727 2.121 . . . . 1.53 116.727 -156.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 15.3 m-70 -79.73 -49.52 11.94 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 121.324 1.875 . . . . 1.62 112.388 -167.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 76.4 mtm -72.13 -19.83 61.71 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.925 1.69 . . . . 1.98 112.861 170.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.7 tp -86.13 50.89 2.07 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.927 1.291 . . . . 3.74 110.061 178.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 2.5 m -71.02 -9.03 57.33 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 115.801 1.778 . . . . 4.22 115.801 -153.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.403 ' CG ' ' N ' ' A' ' 53' ' ' THR . 22.6 t70 -162.28 174.98 12.1 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 126.423 1.889 . . . . 5.4 111.44 173.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.403 ' N ' ' CG ' ' A' ' 52' ' ' ASP . 9.5 m -48.66 -37.0 17.24 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 130.232 3.413 . . . . 3.53 111.943 162.383 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.0 -45.82 91.97 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 119.235 0.925 . . . . 2.4 112.217 172.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -69.47 -42.39 74.93 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.93 0.892 . . . . 4.44 109.975 175.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.75 -30.45 22.7 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.801 1.64 . . . . 5.02 114.114 172.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.5 mtmt -59.96 -22.23 62.23 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.28 1.4 . . . . 3.95 113.293 174.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.48 -15.32 57.01 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 114.866 1.432 . . . . 1.45 114.866 169.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.74 -49.31 10.58 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.402 1.081 . . . . 0.8 110.799 162.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -67.71 -29.46 68.72 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.735 1.214 . . . . 2.06 114.105 -176.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.2 ptmt -50.34 -35.68 28.87 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 119.563 1.074 . . . . 4.06 111.663 165.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.7 mt -78.23 -44.97 24.17 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 123.305 0.642 . . . . 1.04 111.15 178.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 23.0 mm -52.55 -49.53 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 123.734 0.646 . . . . 0.97 110.468 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -65.43 -40.12 92.92 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.503 0.927 . . . . 1.88 113.503 178.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -61.97 -29.66 70.4 Favored 'General case' 0 CA--C 1.554 1.123 0 N-CA-C 113.224 0.824 . . . . 3.31 113.224 172.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.84 -26.15 21.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.745 1.218 . . . . 2.19 112.158 179.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -64.16 -22.21 66.85 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.83 -1.168 . . . . 2.86 113.772 165.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.43 -15.98 60.89 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 114.294 1.22 . . . . 2.27 114.294 164.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -126.56 -13.38 5.98 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 116.887 2.18 . . . . 2.6 116.887 -166.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.14 125.31 27.66 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 121.963 2.165 . . . . 3.45 111.873 174.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -80.1 58.52 3.0 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.933 2.093 . . . . 4.23 111.955 -176.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 76.12 2.5 72.6 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.594 1.093 . . . . 3.21 113.819 -174.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -77.22 163.0 26.93 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.407 1.104 . . . . 6.69 110.855 177.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 36.0 mm -138.61 140.11 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.479 1.511 . . . . 2.46 108.084 171.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 9.9 t -95.24 -146.49 0.27 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 127.05 2.14 . . . . 2.68 112.061 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -112.92 -59.67 1.99 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.03 1.732 . . . . 2.55 109.904 152.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -59.53 -22.63 61.93 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 127.079 2.151 . . . . 3.5 112.943 -170.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -47.57 -59.62 3.13 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 127.335 2.254 . . . . 3.13 111.09 167.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -54.17 -44.21 71.28 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.381 0.992 . . . . 2.42 112.202 -179.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.8 t-105 -63.1 -48.07 80.12 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 118.881 -0.581 . . . . 0.79 111.887 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.9 t -71.22 -26.45 62.93 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.931 0.787 . . . . 1.71 112.304 178.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 51.0 mt -66.15 -46.43 77.47 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 117.448 -1.263 . . . . 0.74 111.338 170.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.7 mm -51.99 -41.4 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 CA-C-N 121.808 2.094 . . . . 0.83 112.038 176.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.57 -21.96 71.17 Favored Glycine 0 CA--C 1.532 1.118 0 O-C-N 121.568 -0.708 . . . . 0.89 113.565 178.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.29 -23.36 68.48 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 118.631 -1.094 . . . . 0.9 114.279 -177.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.494 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.4 OUTLIER -92.04 -42.68 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 125.441 1.496 . . . . 0.96 110.044 166.137 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.2 m -78.77 60.11 2.71 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.528 2.331 . . . . 1.34 110.691 -177.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -130.33 -77.2 0.17 Allowed Glycine 0 CA--C 1.532 1.154 0 C-N-CA 126.206 1.86 . . . . 0.87 111.094 173.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -62.32 -38.0 57.23 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.146 2.564 . . . . 0.98 112.735 -178.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.2 pp -77.82 -14.75 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 112.864 0.69 . . . . 1.18 112.864 174.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.67 -33.02 41.56 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.798 -1.188 . . . . 1.06 113.512 -174.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -59.82 -33.57 71.93 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 120.095 -1.628 . . . . 2.82 111.657 163.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.04 -40.01 90.64 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 118.407 -0.806 . . . . 1.85 111.687 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 92.3 mt -45.71 -62.68 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 123.617 0.767 . . . . 1.03 110.212 164.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -60.43 -42.81 96.86 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.088 -0.505 . . . . 1.79 111.875 -172.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.298 4.1 pt-20 -76.38 -19.97 57.63 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 112.818 0.673 . . . . 3.28 112.818 -176.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -85.11 -37.24 20.49 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.984 1.714 . . . . 2.49 115.297 173.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -73.07 -16.48 61.48 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.178 0.899 . . . . 2.48 110.992 176.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -92.06 -66.4 0.93 Allowed 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.047 1.339 . . . . 2.3 111.085 170.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 53.03 -2.31 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 131.068 3.747 . . . . 4.69 116.238 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 37.4 t -129.16 17.28 6.09 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.555 1.542 . . . . 7.04 112.818 -166.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 23.3 m -113.22 6.02 17.24 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.224 1.41 . . . . 9.01 113.862 -171.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.7 t . . . . . 0 C--O 1.255 1.359 0 C-N-CA 125.159 1.384 . . . . 10.61 109.616 -148.765 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 CA--C 1.52 -0.202 0 N-CA-C 108.392 -0.966 . . . . 10.29 108.392 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -49.23 -154.42 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.592 0 CA-C-O 121.94 0.876 . . . . 7.52 111.72 122.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 12.1 t -71.44 -14.3 62.1 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 119.398 -2.064 . . . . 3.44 112.478 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -63.57 144.5 56.95 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 124.171 0.989 . . . . 2.2 111.552 167.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 11.7 p -57.93 151.35 18.42 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.053 -0.721 . . . . 0.99 109.053 166.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -68.55 -31.44 70.66 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 116.498 -1.715 . . . . 3.2 111.614 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.98 -48.62 70.17 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 121.418 1.917 . . . . 0.94 109.746 171.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -72.25 -51.35 21.35 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.442 -0.789 . . . . 2.9 112.325 -174.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 31.6 tptt -62.29 -24.07 67.08 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 121.324 1.875 . . . . 7.07 114.078 170.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.798 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.43 -43.24 73.78 Favored 'General case' 0 C--O 1.222 -0.376 0 O-C-N 120.233 -1.542 . . . . 0.64 111.461 166.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 37.7 t -56.04 -43.17 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 121.512 1.96 . . . . 0.73 110.69 169.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 22.3 mm -52.93 -55.57 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.045 0.838 . . . . 1.79 111.648 168.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 6.7 t -61.15 -38.71 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.61 1.164 . . . . 0.62 112.32 -177.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.8 mp -66.84 -32.59 73.96 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.237 -0.914 . . . . 1.26 111.848 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 79.4 t -80.01 -38.94 19.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.267 1.027 . . . . 0.68 111.025 177.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -55.05 -46.82 75.38 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.279 1.031 . . . . 3.18 110.5 168.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -59.44 -24.8 63.83 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 115.303 1.594 . . . . 2.37 115.303 -173.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -87.96 -58.4 2.58 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.158 1.383 . . . . 2.3 112.302 171.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -64.79 -26.69 68.46 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 112.582 0.586 . . . . 1.72 112.582 -172.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -53.43 -16.51 1.45 Allowed 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.017 1.488 . . . . 2.34 115.017 174.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -90.24 -5.51 56.27 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 114.744 1.387 . . . . 2.54 114.744 173.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 22.4 m -141.05 148.65 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 CA-C-N 121.271 1.85 . . . . 2.74 112.418 -171.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 12.8 p -83.18 72.0 10.16 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 120.956 -1.09 . . . . 4.01 113.748 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 20.7 ttpt 69.39 -53.27 0.6 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.799 2.44 . . . . 6.66 116.682 153.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -131.69 117.83 19.18 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.52 1.528 . . . . 9.56 112.15 -175.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . 0.431 ' HB3' ' HE2' ' B' ' 133' ' ' LYS . 96.2 p -173.89 148.33 1.41 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.575 1.55 . . . . 4.51 113.35 156.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.95 -69.79 0.42 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 107.92 -1.141 . . . . 8.18 107.92 148.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 2.4 t -85.89 -112.68 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 C-N-CA 124.764 1.225 . . . . 4.79 110.87 175.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . 0.431 ' HE2' ' HB3' ' B' ' 130' ' ' SER . 22.1 mtmt 56.61 -6.33 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 126.669 1.988 . . . . 7.85 114.658 -159.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 42.3 m-20 57.77 159.17 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.306 1.842 . . . . 7.87 112.494 -144.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -138.93 -131.55 0.12 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.662 1.585 . . . . 9.41 108.961 173.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 31.3 pt -86.95 165.66 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 119.682 1.128 . . . . 2.19 112.064 -175.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 69.0 m -85.95 151.17 23.96 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.201 -0.937 . . . . 2.25 111.172 169.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . 0.47 ' HE3' ' HA ' ' B' ' 170' ' ' ASP . 0.0 OUTLIER -58.06 -28.99 65.03 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.238 -1.539 . . . . 2.81 112.667 175.764 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 43.9 p -70.5 -24.51 62.86 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.616 -1.303 . . . . 1.64 114.218 171.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 20.0 m -72.53 -26.3 61.7 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 120.794 -1.191 . . . . 1.2 112.195 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.425 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 69.6 t80 -60.97 -51.25 70.06 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.137 -0.977 . . . . 2.01 112.103 173.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -67.08 -25.93 66.47 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.597 -0.689 . . . . 2.52 112.312 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.92 -52.52 28.49 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 124.314 1.046 . . . . 3.19 110.714 170.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 2.2 ttm -55.39 -39.83 70.63 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.976 1.31 . . . . 1.57 110.696 179.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.7 mt -56.53 -62.1 1.96 Allowed 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 125.825 1.65 . . . . 1.54 112.25 165.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -63.85 -16.76 62.13 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 120.349 1.431 . . . . 3.3 114.779 -176.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.78 -56.8 3.31 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 119.331 0.969 . . . . 1.38 112.019 170.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -93.88 -19.48 20.93 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 113.606 0.965 . . . . 2.83 113.606 -165.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 3.9 mt -122.33 57.21 1.09 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 129.135 2.974 . . . . 1.59 109.739 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -96.2 -16.82 21.23 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.724 1.75 . . . . 1.38 115.724 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -82.72 -27.51 31.1 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 121.087 1.767 . . . . 1.88 114.131 -172.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 65.3 mtm -89.26 6.1 41.85 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.413 1.885 . . . . 2.05 113.207 174.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 2.3 tp -83.36 -167.37 1.67 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 128.148 2.579 . . . . 3.06 111.49 173.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 15.5 m -174.6 -45.63 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 128.524 2.73 . . . . 3.97 109.266 171.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -151.69 179.07 8.72 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-O 123.437 1.589 . . . . 4.96 112.192 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 12.5 m -35.38 -40.99 0.16 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 128.802 2.841 . . . . 3.09 112.673 151.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.96 -47.76 47.43 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 124.923 1.249 . . . . 1.88 113.351 176.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -64.15 -48.17 77.04 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.904 0.881 . . . . 4.53 110.391 173.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -55.86 -33.4 64.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.992 1.717 . . . . 5.22 114.074 -178.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -55.69 -22.95 25.81 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 120.99 -1.069 . . . . 4.82 113.721 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -80.94 -14.89 57.56 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.044 1.498 . . . . 1.56 115.044 172.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -80.15 -52.19 8.06 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.58 1.082 . . . . 0.82 110.485 160.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -66.42 -29.8 70.03 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.775 1.23 . . . . 1.95 113.323 -172.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt -50.13 -35.18 24.78 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 118.911 0.778 . . . . 4.15 112.406 165.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 12.5 mt -81.32 -40.86 22.96 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.64 -0.663 . . . . 1.02 111.322 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.62 -48.98 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 123.23 0.612 . . . . 0.8 111.102 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -65.04 -24.42 67.48 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.002 1.112 . . . . 1.88 114.002 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -82.36 -41.05 20.49 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.293 1.22 . . . . 3.12 114.293 173.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.56 -32.04 20.9 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 121.12 -0.988 . . . . 2.6 112.45 -171.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . 0.47 ' HA ' ' HE3' ' B' ' 138' ' ' LYS . 7.9 t70 -60.26 -44.88 94.91 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.256 -0.902 . . . . 3.0 111.228 174.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.99 -12.0 7.02 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.168 1.787 . . . . 2.05 115.363 174.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -117.11 -4.06 11.48 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.758 1.223 . . . . 2.28 113.628 -177.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -154.96 95.29 1.73 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.697 1.135 . . . . 3.74 110.104 -168.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -76.23 79.94 3.02 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.631 1.572 . . . . 4.21 112.858 -164.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 68.24 -4.67 4.56 Favored Glycine 0 CA--C 1.535 1.304 0 O-C-N 121.03 -1.043 . . . . 2.89 113.114 -166.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 64.3 mmt-85 -68.52 147.95 51.25 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.799 1.24 . . . . 5.96 109.702 174.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 35.6 mm -142.55 137.92 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 C-N-CA 126.464 1.905 . . . . 2.52 107.37 176.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 9.1 t -92.12 -142.87 0.2 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.961 1.704 . . . . 2.61 111.512 177.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -117.82 -56.71 2.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.404 1.881 . . . . 2.59 110.284 158.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -61.68 -27.41 68.67 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 128.508 2.723 . . . . 3.0 114.32 -177.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -43.54 -58.78 2.46 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.336 1.854 . . . . 3.01 111.054 165.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -54.5 -43.88 72.22 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.239 -0.913 . . . . 2.43 111.772 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 35.4 t-105 -62.3 -47.94 82.07 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 122.123 -0.361 . . . . 0.75 111.753 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 13.2 t -71.74 -25.81 62.21 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 118.215 -0.898 . . . . 1.66 112.274 177.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.425 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 62.1 mt -63.96 -48.97 74.37 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 117.28 -1.343 . . . . 0.71 110.737 168.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 38.7 mm -50.27 -41.88 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 CA-C-N 121.348 1.885 . . . . 0.74 112.065 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.55 -25.1 72.69 Favored Glycine 0 CA--C 1.531 1.057 0 O-C-N 121.534 -0.729 . . . . 0.91 113.744 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.94 -21.68 75.83 Favored Glycine 0 CA--C 1.533 1.182 0 CA-C-O 118.672 -1.071 . . . . 1.02 114.438 -176.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . 0.505 ' H ' HD12 ' B' ' 189' ' ' ILE . 0.5 OUTLIER -88.49 -48.4 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 125.12 1.368 . . . . 0.99 109.161 163.457 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 1.5 m -86.44 44.71 1.17 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.621 1.968 . . . . 1.69 111.9 -165.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -118.42 -71.39 0.39 Allowed Glycine 0 CA--C 1.53 1.027 0 C-N-CA 126.603 2.049 . . . . 0.93 111.036 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.14 -30.66 82.54 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 123.471 2.781 . . . . 1.6 114.176 -178.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 7.7 pt -83.88 -13.75 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 119.713 1.142 . . . . 1.29 113.518 172.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -68.95 -34.94 76.17 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.31 1.226 . . . . 0.87 114.31 -169.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -56.78 -36.29 69.69 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.434 -1.416 . . . . 3.2 111.808 168.289 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.02 -40.04 75.44 Favored 'General case' 0 C--O 1.223 -0.331 0 C-N-CA 123.625 0.77 . . . . 2.2 111.369 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . 0.517 HG23 HD13 ' A' ' 13' ' ' ILE . 90.3 mt -47.41 -62.33 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.768 0.827 . . . . 1.13 110.85 166.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -56.35 -46.67 79.87 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.514 0.561 . . . . 1.68 112.514 -178.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.305 2.6 pt-20 -78.6 -13.19 59.95 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.977 0.732 . . . . 2.91 112.977 -173.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -81.45 -25.81 35.81 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 115.058 1.503 . . . . 2.33 115.058 169.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -75.13 -15.63 60.58 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.12 0.968 . . . . 2.23 111.228 170.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -102.49 -61.81 1.35 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.965 1.306 . . . . 2.34 110.876 -179.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . 0.254 7.5 pt20 56.85 -6.11 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.057 1 C-N-CA 132.026 4.13 . . . . 4.79 115.72 171.744 . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 48.4 t -118.26 40.54 3.16 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.789 2.036 . . . . 6.87 110.317 -178.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 20.0 m -144.54 17.55 1.67 Allowed 'General case' 0 N--CA 1.477 0.92 0 O-C-N 119.961 -1.712 . . . . 9.0 114.092 -172.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 C--O 1.256 1.418 0 C-N-CA 125.032 1.333 . . . . 10.92 110.54 -164.507 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.54 ' HA ' ' CE2' ' A' ' 5' ' ' TYR . 42.0 m . . . . . 0 N--CA 1.476 0.838 0 CA-C-O 118.831 -0.604 . . . . 10.57 110.877 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.5 ' CG ' ' H ' ' A' ' 4' ' ' CYS . 2.4 t70 -76.69 -116.09 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 106.708 -1.59 . . . . 7.59 106.708 137.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.5 ' H ' ' CG ' ' A' ' 3' ' ' ASP . 75.7 m -82.96 -60.93 2.0 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.595 1.543 . . . . 3.83 108.86 166.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.54 ' CE2' ' HA ' ' A' ' 2' ' ' SER . 10.1 m-30 70.88 138.07 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.992 2.517 . . . . 2.59 112.34 176.431 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 17.1 p -78.95 166.75 22.03 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 120.795 -1.191 . . . . 0.9 110.953 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -56.58 -34.13 66.85 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.28 0.632 . . . . 2.25 112.47 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -45.7 90.66 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.17 1.388 . . . . 0.83 110.122 175.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -76.23 -47.99 21.93 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.993 0.917 . . . . 2.93 111.423 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 40.2 tttm -44.89 -46.69 11.01 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.248 1.419 . . . . 5.87 113.104 159.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.82 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -63.52 -45.99 88.08 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.563 -1.208 . . . . 0.53 112.896 175.695 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.5 t -57.76 -38.61 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 120.87 1.668 . . . . 0.59 110.377 174.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.4 mt -63.64 -43.37 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 121.634 -0.666 . . . . 1.04 111.277 173.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.8 t -68.28 -39.82 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 124.394 1.077 . . . . 0.49 111.986 179.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.4 mp -59.83 -45.29 92.85 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.75 1.159 . . . . 0.91 110.212 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.6 t -64.66 -42.22 94.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 124.896 1.278 . . . . 0.53 112.32 177.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -56.57 -49.28 75.33 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.408 1.083 . . . . 3.38 111.13 168.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.406 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 0.2 OUTLIER -72.16 -24.62 61.47 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.91 0.707 . . . . 2.59 112.91 -170.115 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -71.2 -63.15 1.16 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.983 0.513 . . . . 1.95 112.185 161.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -63.53 -32.59 74.09 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 118.792 -0.623 . . . . 1.88 112.376 -163.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 18' ' ' ASN . 35.8 pttt -55.57 -23.38 26.66 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.585 1.328 . . . . 2.31 114.585 175.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -78.95 -31.03 44.9 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.623 -1.298 . . . . 2.4 112.607 174.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.1 m -92.92 -170.06 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 CA-C-N 120.824 1.647 . . . . 2.09 111.72 176.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.46 -44.76 61.88 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 120.306 -1.496 . . . . 3.75 114.189 173.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt 132.01 -95.9 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 131.184 3.793 . . . . 4.99 107.744 -156.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -121.1 125.28 46.86 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.938 1.695 . . . . 9.12 111.272 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.4 m -154.68 25.05 0.45 Allowed 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.252 -0.905 . . . . 4.48 111.576 174.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 71.7 mt 59.56 -61.66 0.05 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 128.269 2.628 . . . . 8.33 114.018 -175.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 73.3 t -72.74 -37.85 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 127.489 2.316 . . . . 4.54 111.044 174.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt 70.93 -2.77 2.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 127.927 2.491 . . . . 12.92 116.463 175.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -57.7 139.83 52.84 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 119.269 0.941 . . . . 8.05 111.884 176.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.63 -40.43 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 128.294 2.638 . . . . 10.37 108.069 -169.01 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.0 pt -117.5 171.11 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 127.315 2.246 . . . . 3.25 108.907 158.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 72.1 m -113.92 167.64 10.48 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.606 0.763 . . . . 2.99 109.512 160.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.41 -18.28 4.01 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 115.583 1.697 . . . . 2.36 115.583 176.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.3 p -57.15 -20.73 28.01 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 120.384 -1.447 . . . . 2.18 114.286 165.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.7 m -82.44 -33.01 28.69 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.725 -1.234 . . . . 1.26 113.52 171.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -55.3 -52.38 63.63 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.789 1.177 . . . . 2.37 111.37 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -16.32 8.81 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.688 1.195 . . . . 2.96 113.976 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -106.86 -38.58 6.03 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 124.826 1.251 . . . . 3.04 112.529 -174.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.2 ttm -47.99 -44.58 30.74 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.767 0.827 . . . . 1.6 110.286 156.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.2 mt -62.46 -12.64 23.17 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 116.006 1.854 . . . . 0.96 116.006 170.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -104.96 -15.56 15.09 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 124.761 1.224 . . . . 2.33 113.505 174.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.51 -47.56 3.9 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.326 1.051 . . . . 1.49 112.924 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -94.73 -9.53 34.42 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.223 1.374 . . . . 2.94 113.967 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -120.14 34.11 5.34 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.849 1.66 . . . . 1.48 112.601 171.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -78.65 -21.2 48.69 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 116.209 1.929 . . . . 1.65 116.209 -161.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -94.18 -14.35 25.69 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.237 1.381 . . . . 1.96 112.989 -170.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 50.2 mtm -85.53 -18.1 34.43 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.625 1.17 . . . . 2.12 112.922 162.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.55 125.99 26.93 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 120.643 -1.286 . . . . 3.15 108.618 163.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.6 p -171.81 -57.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.568 -0.707 . . . . 3.5 109.449 -158.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -79.49 147.2 32.32 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.511 0.724 . . . . 5.45 109.25 155.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.3 m -69.15 -30.17 68.35 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.785 0.834 . . . . 2.38 110.473 171.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -55.8 -33.74 60.29 Favored Glycine 0 CA--C 1.53 0.972 0 C-N-CA 124.461 1.029 . . . . 1.74 113.098 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -59.78 -56.0 27.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.319 1.047 . . . . 3.07 111.514 -179.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.6 ttt-85 -73.33 -33.29 65.05 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.148 0.795 . . . . 4.8 113.148 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -55.65 -38.11 69.12 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 119.562 -1.961 . . . . 3.08 112.163 171.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.96 -10.14 55.79 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.571 1.693 . . . . 1.25 115.571 172.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.32 -57.32 3.12 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.585 1.084 . . . . 0.88 111.019 162.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.18 -29.42 70.35 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.49 0.716 . . . . 2.96 112.085 -172.295 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -62.64 -28.07 69.65 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 120.434 -1.416 . . . . 2.57 114.311 172.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.9 mt -78.54 -36.76 44.3 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.315 0.646 . . . . 0.91 110.554 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.4 mm -51.6 -55.48 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 126.271 1.828 . . . . 1.0 109.55 178.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -60.1 -31.15 69.77 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.67 0.989 . . . . 2.25 113.67 -178.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.42 -31.61 65.64 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.405 1.482 . . . . 2.96 112.55 175.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.4 -29.98 21.08 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.335 1.454 . . . . 2.1 111.587 177.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -55.4 -52.01 64.98 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.757 1.623 . . . . 2.99 109.503 164.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.97 -14.69 24.47 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 115.553 1.686 . . . . 2.03 115.553 175.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -118.73 -7.39 10.52 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.152 1.538 . . . . 2.35 115.152 -175.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -147.45 125.28 11.92 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 121.019 1.736 . . . . 3.76 111.051 -179.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -114.88 149.82 36.56 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.632 0.773 . . . . 5.23 110.44 163.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 70.54 -43.67 0.59 Allowed Glycine 0 CA--C 1.53 1.002 0 C-N-CA 126.598 2.047 . . . . 3.0 114.346 -178.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -88.93 140.66 29.21 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.296 1.439 . . . . 5.43 112.342 -173.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 46.7 mm -114.29 129.61 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 N-CA-C 106.357 -1.72 . . . . 2.48 106.357 154.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.2 t -84.9 -171.71 3.79 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.392 0.615 . . . . 1.7 112.489 -179.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -94.51 -57.76 2.39 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 119.253 -2.154 . . . . 1.89 110.404 167.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -51.46 -29.13 15.23 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 130.713 3.605 . . . . 3.33 114.94 170.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -49.72 -58.67 4.87 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.306 1.442 . . . . 3.23 111.306 171.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -52.44 -48.21 65.94 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.211 -0.931 . . . . 1.99 111.652 176.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.4 t-105 -64.54 -45.56 86.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 119.054 -0.498 . . . . 0.54 111.416 -171.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.2 t -71.17 -29.39 65.13 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 117.753 -1.117 . . . . 1.87 112.229 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.89 -35.51 76.95 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.459 1.027 . . . . 0.66 112.207 174.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 37.3 mm -52.26 -38.72 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 CA-C-N 120.322 1.419 . . . . 0.67 111.359 173.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -67.79 -14.02 64.64 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.422 1.487 . . . . 0.58 115.309 177.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.29 -24.94 64.7 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-N 119.394 1.597 . . . . 0.8 112.842 173.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -97.08 -41.99 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 125.305 1.442 . . . . 1.05 109.96 171.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.4 m -80.93 64.12 5.57 Favored 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 127.014 2.126 . . . . 1.33 108.342 173.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -159.87 -55.67 0.01 OUTLIER Glycine 0 CA--C 1.531 1.038 0 C-N-CA 126.04 1.781 . . . . 1.32 110.937 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.09 -73.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.344 2.696 . . . . 1.4 111.341 161.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.5 pt -73.51 -18.33 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 N-CA-C 114.7 1.37 . . . . 1.25 114.7 -170.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.484 ' HA ' HD12 ' A' ' 94' ' ' ILE . . . -55.23 -39.29 69.55 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.227 1.011 . . . . 1.13 112.606 -178.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -63.28 -41.79 99.05 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.5 -0.75 . . . . 5.78 111.863 175.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.5 tt -65.18 -40.89 94.9 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 117.908 -1.044 . . . . 1.18 110.818 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.484 HD12 ' HA ' ' A' ' 91' ' ' ALA . 96.7 mt -45.72 -51.28 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 119.375 0.988 . . . . 1.0 110.726 174.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -63.71 -39.18 93.66 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.605 0.965 . . . . 1.96 113.605 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -85.41 -24.09 27.66 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.18 0.9 . . . . 2.78 112.978 -177.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -66.89 -46.36 75.15 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 125.159 1.383 . . . . 2.45 109.166 164.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -84.16 41.16 0.8 Allowed 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 124.914 2.292 . . . . 3.11 111.002 176.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -125.08 -54.38 1.61 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 111.862 -2.426 . . . . 2.44 107.361 149.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -64.94 -10.05 26.11 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.009 1.724 . . . . 5.7 115.213 -175.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 14.2 p -70.64 -1.45 11.24 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.155 -0.966 . . . . 6.87 113.567 161.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 23.2 t -149.74 -22.36 0.27 Allowed 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 116.432 2.012 . . . . 8.76 116.432 174.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 30.5 t . . . . . 0 N--CA 1.489 1.51 0 C-N-CA 127.008 2.123 . . . . 9.18 114.347 177.841 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 118.778 -0.63 . . . . 9.62 110.937 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' B' ' 107' ' ' CYS . 4.4 t70 -72.8 -116.73 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.232 0 N-CA-C 106.847 -1.538 . . . . 6.82 106.847 138.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . 0.438 ' H ' ' CG ' ' B' ' 106' ' ' ASP . 40.6 t -71.9 -63.48 1.13 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 121.154 1.797 . . . . 3.33 109.208 156.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 74.15 146.3 0.08 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 128.857 2.863 . . . . 2.43 111.976 -176.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 1.3 p -82.74 168.99 16.67 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 121.526 -0.734 . . . . 0.98 110.359 177.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -63.8 -48.78 75.51 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-O 117.022 -1.466 . . . . 2.56 110.509 171.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.25 -47.23 36.11 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 120.2 1.363 . . . . 0.75 111.0 178.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -73.49 -53.91 9.5 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 126.078 1.751 . . . . 2.96 112.503 -173.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 42.6 tttm -47.55 -36.64 10.83 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.125 1.37 . . . . 4.56 113.299 161.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.82 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -73.61 -38.82 64.96 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 120.716 -1.24 . . . . 0.47 112.003 176.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.94 -40.99 79.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 120.914 1.688 . . . . 0.66 110.385 166.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 97.1 mt -58.74 -49.04 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 CA-C-N 118.867 0.758 . . . . 0.9 112.103 171.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 14.8 t -61.38 -43.3 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.98 1.312 . . . . 0.49 112.265 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.1 mp -60.77 -44.01 97.32 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.825 1.193 . . . . 0.94 110.778 174.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 55.5 t -63.38 -42.55 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 124.325 1.05 . . . . 0.52 111.836 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -55.54 -47.75 75.81 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 119.972 1.26 . . . . 3.6 110.514 168.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . 0.407 ' HA ' ' HE2' ' B' ' 124' ' ' LYS . 0.2 OUTLIER -72.9 -24.9 60.89 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 112.694 0.627 . . . . 2.56 112.694 -168.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -74.02 -59.72 2.59 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.898 0.479 . . . . 1.97 112.111 163.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -64.34 -32.68 74.39 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.6 -0.714 . . . . 1.83 112.286 -165.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . 0.407 ' HE2' ' HA ' ' B' ' 121' ' ' ASN . 37.4 pttt -54.84 -24.57 23.67 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.437 1.273 . . . . 2.19 114.437 175.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -77.39 -31.29 54.09 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 117.49 -1.243 . . . . 2.13 112.963 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 27.7 m -95.26 -173.87 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 CA-C-N 120.901 1.682 . . . . 2.06 112.125 -179.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.59 -43.03 73.65 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.605 -1.309 . . . . 3.85 113.645 175.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 22.4 ttpt 126.98 -93.1 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 131.466 3.906 . . . . 4.81 108.161 -156.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -123.69 132.9 53.94 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.881 1.672 . . . . 9.2 112.002 174.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 12.5 m -154.33 26.56 0.46 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.285 1.034 . . . . 4.88 110.997 173.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 67.3 mt 59.01 -62.17 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.193 2.597 . . . . 8.61 112.73 -167.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 54.9 t -74.45 -33.54 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 127.461 2.305 . . . . 4.52 112.204 177.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 29.0 mtmt 69.75 -5.54 1.2 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 127.672 2.389 . . . . 12.9 116.655 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -57.39 138.04 55.41 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 119.012 0.824 . . . . 8.04 111.544 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.83 -38.75 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 128.158 2.583 . . . . 10.34 108.469 -167.206 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 3.2 pt -120.69 173.37 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 127.431 2.293 . . . . 3.35 108.62 158.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 66.3 m -117.17 168.95 9.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.744 0.818 . . . . 2.94 109.457 161.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.6 -16.96 2.77 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 116.02 1.859 . . . . 2.21 116.02 175.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.9 p -59.59 -20.48 56.09 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 119.636 -1.915 . . . . 2.11 114.455 165.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 23.6 m -78.88 -31.68 45.57 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 120.439 -1.413 . . . . 1.21 112.983 170.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.484 ' CE2' HD11 ' B' ' 145' ' ' LEU . 50.1 t80 -61.05 -49.38 77.58 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.592 1.157 . . . . 2.24 112.039 -178.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 1.2 ptt180 -55.58 -15.55 3.02 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.899 1.074 . . . . 2.94 113.899 173.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -106.03 -38.33 6.34 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 125.451 1.5 . . . . 2.73 112.525 -175.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.5 ttm -49.79 -44.39 49.0 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.247 1.019 . . . . 1.57 110.45 159.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . 0.484 HD11 ' CE2' ' B' ' 141' ' ' PHE . 28.7 mt -65.04 -0.6 1.66 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 126.214 1.806 . . . . 1.21 115.644 171.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -120.78 -14.71 8.5 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 125.452 1.501 . . . . 2.35 114.046 174.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.86 -53.23 2.8 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.171 0.988 . . . . 1.54 113.47 175.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -85.69 -34.65 21.23 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 120.585 1.539 . . . . 2.79 112.545 177.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.22 47.38 0.9 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.753 1.221 . . . . 1.83 111.595 179.284 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -89.69 -16.32 30.65 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 115.685 1.735 . . . . 1.6 115.685 -160.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -97.82 -22.72 16.22 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 120.454 1.479 . . . . 1.64 113.278 -167.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 60.2 mtm -79.64 -19.38 49.26 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.672 -1.268 . . . . 2.1 111.947 166.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 5.9 mp -63.28 125.54 24.46 Favored 'General case' 0 C--O 1.222 -0.358 0 O-C-N 121.399 -0.813 . . . . 3.02 108.815 160.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 18.4 p -172.74 -68.72 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.996 -1.113 . . . . 3.34 107.996 -161.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -66.14 139.52 58.15 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.723 0.773 . . . . 5.7 109.392 155.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 37.8 m -68.0 -28.02 67.06 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.003 0.921 . . . . 2.53 110.441 174.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -55.76 -32.02 58.45 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.544 1.069 . . . . 1.77 112.953 174.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -64.78 -55.65 18.42 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.262 1.031 . . . . 3.16 111.522 -175.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 31.0 ttt-85 -71.74 -36.22 70.37 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.441 0.904 . . . . 4.57 113.441 173.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -53.42 -42.88 67.5 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.829 1.65 . . . . 3.47 111.859 172.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.66 -23.3 58.96 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.206 -1.378 . . . . 0.96 114.521 174.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.4 -52.01 11.75 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.818 1.19 . . . . 0.81 111.799 167.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.42 -27.38 68.51 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 124.062 0.945 . . . . 2.58 112.807 -175.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.1 mtmt -63.19 -31.21 72.3 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.345 -1.472 . . . . 3.93 113.742 169.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 7.9 mt -76.25 -36.72 58.34 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.12 0.568 . . . . 0.96 111.209 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 34.8 mm -53.84 -58.81 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.046 1.339 . . . . 1.13 110.099 175.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -59.06 -34.8 72.36 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.328 0.862 . . . . 1.82 113.328 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -63.68 -36.6 84.37 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.54 1.136 . . . . 3.19 112.205 173.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.67 -28.85 24.44 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.343 1.057 . . . . 2.3 111.749 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -55.67 -55.51 31.32 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.252 1.021 . . . . 3.01 110.264 163.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -56.52 -24.76 48.76 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 114.694 1.368 . . . . 1.98 114.694 176.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -103.6 -9.23 19.39 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 114.576 1.324 . . . . 2.38 114.576 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -150.55 122.57 8.22 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 121.394 1.906 . . . . 3.77 112.083 -177.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -100.42 153.1 19.62 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.289 0.635 . . . . 5.01 110.315 153.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.56 -45.54 1.28 Allowed Glycine 0 CA--C 1.53 0.976 0 C-N-CA 126.876 2.179 . . . . 2.79 115.489 168.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 23.6 mmt85 -84.47 154.19 22.9 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.352 1.461 . . . . 5.34 111.89 -176.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.9 mm -131.67 129.2 61.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 126.236 1.814 . . . . 2.47 106.324 159.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 2.8 t -87.11 -174.2 4.79 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 112.779 0.659 . . . . 1.74 112.779 -177.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -89.82 -58.12 2.62 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 119.234 -2.166 . . . . 1.89 110.029 163.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -54.53 -28.51 45.91 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.184 3.394 . . . . 3.16 114.19 176.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -46.87 -59.93 2.76 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.148 1.379 . . . . 3.31 111.287 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -52.0 -46.71 65.01 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.41 -0.806 . . . . 2.09 111.498 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 -65.92 -42.65 89.84 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 119.009 -0.519 . . . . 0.6 111.908 -174.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 11.2 t -70.5 -28.88 65.31 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 117.662 -1.161 . . . . 1.74 112.262 174.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 87.7 mt -69.92 -40.97 75.25 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 119.801 1.182 . . . . 0.68 112.106 172.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.5 mm -53.44 -37.19 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 CA-C-N 121.232 1.833 . . . . 0.63 111.989 179.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -66.22 -13.12 59.59 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 124.917 1.246 . . . . 0.56 115.126 177.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -81.31 -19.61 66.33 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-N 119.535 1.668 . . . . 1.04 113.778 173.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.1 mp -100.39 -44.57 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 124.815 1.246 . . . . 1.22 109.411 168.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.7 m -77.82 58.51 1.89 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.86 2.064 . . . . 1.47 109.24 169.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -158.68 -58.54 0.01 OUTLIER Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.359 1.933 . . . . 1.37 111.141 -172.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -61.66 -71.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 123.373 2.715 . . . . 1.65 111.242 163.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 16.8 pt -76.38 -18.22 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 N-CA-C 115.1 1.519 . . . . 1.25 115.1 -170.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -61.0 -35.26 76.36 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.078 0.77 . . . . 1.26 113.078 -172.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -60.38 -38.49 84.08 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.918 -0.489 . . . . 6.1 111.923 175.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 7.4 tt -71.67 -34.67 69.89 Favored 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 124.343 1.057 . . . . 1.51 111.466 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 91.0 mt -47.16 -50.81 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 CA-C-N 119.83 1.195 . . . . 1.01 110.098 172.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 13.3 t60 -63.86 -25.16 68.04 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.495 1.295 . . . . 1.99 114.495 -176.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -98.35 -27.0 14.3 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.769 1.168 . . . . 2.83 113.17 176.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -72.0 -45.65 60.15 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 124.546 1.139 . . . . 2.26 109.824 173.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -83.26 36.3 0.52 Allowed 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 124.374 2.035 . . . . 3.12 110.969 175.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -117.06 -52.79 2.5 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 112.803 -1.999 . . . . 2.02 108.247 151.369 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -65.7 -7.77 17.26 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.537 1.535 . . . . 5.47 114.814 -176.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 22.0 p -71.25 -0.54 10.17 Favored 'General case' 0 CA--C 1.549 0.909 0 O-C-N 120.884 -1.135 . . . . 7.24 113.6 160.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 27.0 t -150.62 -22.07 0.23 Allowed 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 116.921 2.193 . . . . 9.03 116.921 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 26.4 t . . . . . 0 N--CA 1.492 1.628 0 CA-C-N 121.954 2.161 . . . . 9.13 115.048 179.751 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 N--CA 1.477 0.879 0 CA-C-O 117.553 -1.213 . . . . 8.96 107.983 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -48.69 -104.61 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 118.929 0.786 . . . . 6.22 109.142 111.516 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 86.3 m -91.61 -101.33 0.11 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.514 1.525 . . . . 4.56 109.298 172.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -46.11 127.31 8.45 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 126.171 1.788 . . . . 2.3 113.186 -165.362 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p -71.51 168.12 18.23 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.952 0.901 . . . . 1.25 111.251 -169.874 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -61.2 -59.92 4.57 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-O 118.502 -0.761 . . . . 2.68 109.941 169.287 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -46.64 -41.91 15.48 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.158 1.383 . . . . 0.83 111.243 -178.168 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -70.78 -58.02 4.06 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 125.357 1.463 . . . . 2.69 113.181 179.131 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -54.24 -26.54 29.26 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 120.622 1.556 . . . . 5.72 113.438 168.341 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.869 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -74.75 -42.44 58.22 Favored 'General case' 0 N--CA 1.444 -0.726 0 C-N-CA 125.456 1.502 . . . . 0.49 110.716 174.492 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.5 t -58.9 -38.24 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 120.144 1.338 . . . . 0.7 110.754 165.501 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.5 mt -58.25 -48.78 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-O 117.481 -1.247 . . . . 0.81 111.183 168.664 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 6.8 t -60.77 -35.53 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 CA-C-N 121.029 1.74 . . . . 0.63 113.085 178.39 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp -67.15 -48.66 67.36 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.042 -1.036 . . . . 0.95 111.775 170.384 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.1 t -57.59 -40.92 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 125.319 1.448 . . . . 0.63 111.797 173.59 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -68.33 -47.87 66.38 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 126.991 2.116 . . . . 3.15 111.154 -179.343 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -75.17 -5.27 43.5 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.8 1.037 . . . . 2.67 113.8 -179.851 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -84.08 -60.01 2.23 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.272 -0.893 . . . . 2.39 112.239 162.277 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -64.64 -30.88 71.91 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.075 -1.016 . . . . 1.76 113.575 -175.0 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -48.8 -34.11 11.73 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 114.277 1.214 . . . . 2.69 114.277 167.633 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -95.42 -36.87 11.18 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.865 0.866 . . . . 2.51 110.385 -176.012 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.8 t -70.15 -35.74 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 N-CA-C 114.244 1.201 . . . . 3.03 114.244 175.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.6 p 154.91 -89.4 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 129.983 3.313 . . . . 4.21 111.295 175.276 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -173.19 -64.21 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.792 1.637 . . . . 7.12 111.457 -174.684 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -117.18 -26.99 6.6 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.296 1.038 . . . . 7.7 112.239 -173.298 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.9 p -98.83 102.54 14.31 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.14 1.376 . . . . 4.91 113.099 -171.094 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 79.8 mt -55.5 -41.65 73.36 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.059 0.944 . . . . 7.59 113.458 -176.745 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 39.8 t -134.16 77.21 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 125.754 1.622 . . . . 4.58 110.562 174.289 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -127.47 -10.96 5.7 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.416 1.265 . . . . 8.04 114.416 157.053 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -146.86 -65.21 0.28 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.582 0.753 . . . . 6.83 110.876 163.906 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.403 ' HE3' ' HB2' ' A' ' 32' ' ' LYS . 21.5 mtmt 81.66 -156.96 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 127.357 2.263 . . . . 7.3 111.971 178.014 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 29.7 pt -125.38 166.7 20.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 C-N-CA 126.378 1.871 . . . . 2.31 109.377 175.639 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.4 m -98.77 139.83 33.87 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.011 0.924 . . . . 2.28 109.353 163.143 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 79.1 mttt -54.45 -31.04 54.68 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-O 122.861 1.315 . . . . 2.26 113.28 -177.19 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.2 p -60.77 -24.22 65.6 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.864 1.666 . . . . 1.82 114.615 173.723 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.5 m -80.78 -33.43 34.94 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.08 0.952 . . . . 1.21 112.425 174.691 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.441 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 28.8 t80 -59.98 -49.28 78.28 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.072 -1.018 . . . . 2.14 111.309 178.232 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 24.5 ptt180 -58.97 -25.21 63.36 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.94 0.718 . . . . 2.43 112.94 176.159 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -88.08 -47.54 8.42 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 125.298 1.439 . . . . 2.55 111.276 -178.741 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -45.77 -43.39 13.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.332 1.453 . . . . 1.3 111.43 167.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.441 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 44.5 mt -67.9 -4.26 12.32 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 115.474 1.657 . . . . 1.42 115.474 175.252 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -98.22 -19.25 17.97 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.166 1.787 . . . . 2.74 113.611 166.657 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.47 -57.1 2.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.371 1.468 . . . . 1.56 112.774 -178.669 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -79.2 -15.8 57.51 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.097 -1.002 . . . . 3.67 111.849 -178.085 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -126.66 45.85 2.6 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 127.508 2.323 . . . . 1.93 110.672 176.101 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -87.34 -16.41 35.11 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 116.057 1.873 . . . . 1.37 116.057 -175.314 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 13.9 m-70 -98.57 -17.84 18.46 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 121.402 1.91 . . . . 1.61 112.196 -175.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.0 tpp -77.03 -13.29 59.98 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.874 1.67 . . . . 1.87 112.543 166.423 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.3 tp -72.97 89.85 1.45 Allowed 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 124.142 1.925 . . . . 3.58 112.813 -173.648 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.6 t -82.38 71.94 9.44 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 112.999 -1.909 . . . . 4.13 110.027 163.284 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.1 t70 82.26 159.78 0.14 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 127.627 2.371 . . . . 3.87 116.266 165.114 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 m -28.21 -41.28 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 130.959 3.704 . . . . 2.21 114.475 159.371 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.91 -50.87 62.76 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-N 119.596 1.089 . . . . 1.65 112.36 176.296 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -64.39 -32.21 73.74 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.892 -0.769 . . . . 3.28 112.263 172.795 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -66.33 -50.47 63.49 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 120.104 1.32 . . . . 6.14 112.871 173.506 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.8 mmmt -49.26 -40.84 35.72 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 119.144 0.884 . . . . 5.26 112.283 170.022 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' A' ' 61' ' ' LYS . . . -61.16 -18.72 59.59 Favored 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 115.622 1.712 . . . . 1.19 115.622 177.453 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.418 ' HB2' HG12 ' A' ' 86' ' ' ILE . . . -78.2 -52.87 8.03 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.797 0.839 . . . . 0.81 111.882 163.188 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -60.28 -29.41 68.79 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.888 2.075 . . . . 2.72 113.433 -177.163 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.497 ' HG2' ' HA ' ' A' ' 58' ' ' ALA . 2.1 ptmm? -56.51 -32.03 64.66 Favored 'General case' 0 N--CA 1.482 1.166 0 O-C-N 120.763 -1.21 . . . . 3.58 113.015 167.562 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.9 mt -67.38 -42.15 83.83 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.493 -0.754 . . . . 0.92 111.507 176.406 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.9 mm -57.79 -50.09 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.774 1.23 . . . . 0.94 110.385 -173.013 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -67.31 -36.57 81.76 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 124.373 1.069 . . . . 1.94 112.621 -179.085 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -65.81 -28.44 69.0 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 112.747 0.647 . . . . 3.91 112.747 172.628 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 tt -91.94 -21.72 20.41 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.409 1.083 . . . . 2.41 113.121 -178.366 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -59.21 -19.1 42.56 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.014 1.116 . . . . 2.57 114.014 162.15 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.66 -9.28 59.8 Favored 'General case' 0 CA--C 1.553 1.096 0 N-CA-C 115.26 1.578 . . . . 2.62 115.26 164.849 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -148.13 59.22 1.1 Allowed 'General case' 0 CA--C 1.557 1.235 0 CA-C-N 120.547 1.521 . . . . 3.16 114.048 -166.116 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.9 t60 -168.64 112.93 0.59 Allowed 'General case' 0 N--CA 1.48 1.029 0 O-C-N 120.11 -1.619 . . . . 4.65 113.34 -173.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.93 30.38 0.17 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.276 2.23 . . . . 7.16 113.864 -175.785 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.93 8.06 72.25 Favored Glycine 0 CA--C 1.537 1.424 0 O-C-N 120.07 -1.644 . . . . 3.16 113.468 -169.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 10.8 mmt-85 -98.98 98.7 9.72 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 125.964 1.706 . . . . 4.91 108.909 -178.148 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.5 mm -68.69 113.16 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 N-CA-C 105.729 -1.952 . . . . 2.2 105.729 164.801 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.8 m -80.25 165.64 22.16 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.049 0.841 . . . . 1.42 112.297 167.798 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -59.59 -48.75 80.42 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 122.508 1.147 . . . . 2.05 110.407 161.607 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.1 -22.73 66.04 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.722 2.009 . . . . 2.87 113.482 177.457 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -66.66 -50.13 63.95 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.304 0.957 . . . . 2.81 111.098 174.968 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -56.09 -49.8 72.83 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 120.857 -1.152 . . . . 1.8 111.694 173.314 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 31.1 t-105 -63.64 -47.99 79.1 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 121.69 -0.631 . . . . 0.52 112.206 -176.095 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.7 t -67.04 -26.79 66.93 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.354 -0.831 . . . . 1.58 111.978 -179.945 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.6 mt -72.43 -35.59 68.37 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.306 -1.331 . . . . 0.61 112.921 171.725 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 46.5 mm -57.47 -39.29 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 CA-C-N 121.605 2.002 . . . . 0.69 111.912 178.271 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -70.5 -10.84 67.44 Favored Glycine 0 N--CA 1.475 1.298 0 C-N-CA 124.291 0.948 . . . . 0.74 114.045 175.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -82.99 -17.91 66.34 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.792 1.187 . . . . 0.77 113.562 176.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.418 HG12 ' HB2' ' A' ' 59' ' ' ALA . 0.2 OUTLIER -104.09 -45.7 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 124.667 1.187 . . . . 1.03 109.637 166.999 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 30.7 m -75.02 96.53 3.21 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.103 1.361 . . . . 1.31 109.042 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -168.97 -74.02 0.04 OUTLIER Glycine 0 CA--C 1.532 1.127 0 CA-C-O 118.44 -1.2 . . . . 0.98 113.481 -175.807 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -63.18 -45.81 11.5 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.652 2.235 . . . . 1.2 111.531 179.325 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.1 pt -71.82 -13.53 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 N-CA-C 114.019 1.118 . . . . 1.1 114.019 176.013 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.78 -52.96 63.33 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.148 1.34 . . . . 1.06 112.922 177.916 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -61.01 -33.56 73.45 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.423 -1.423 . . . . 3.08 112.669 173.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.6 -45.55 86.48 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 123.478 0.711 . . . . 1.06 110.865 179.57 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.8 mt -49.77 -58.3 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.273 0.629 . . . . 0.99 110.277 168.363 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -73.16 -20.01 61.0 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.434 0.901 . . . . 2.56 113.434 -169.643 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.287 4.0 pt-20 -88.07 -21.9 24.46 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.586 0.754 . . . . 2.69 111.987 175.055 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -79.96 -38.72 31.7 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 125.057 1.343 . . . . 2.74 114.336 172.23 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.62 9.84 0.58 Allowed 'General case' 0 N--CA 1.487 1.391 0 CA-C-O 123.659 1.695 . . . . 2.56 112.682 177.438 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -124.87 -68.43 0.85 Allowed 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 126.827 2.051 . . . . 2.69 109.965 175.208 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 54.34 4.82 0.07 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 129.16 2.984 . . . . 4.49 115.658 170.029 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.7 m -128.94 16.9 6.24 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.021 1.328 . . . . 7.03 112.338 -168.32 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 24.1 t -104.05 -5.56 22.0 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 114.36 1.245 . . . . 9.03 114.36 -178.993 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.2 m . . . . . 0 C--O 1.25 1.095 0 C-N-CA 127.469 2.307 . . . . 9.73 110.161 -167.906 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 42.8 m . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 118.398 -0.811 . . . . 9.76 110.211 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -74.19 -111.68 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 106.376 -1.713 . . . . 5.95 106.376 136.838 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 90.2 m -68.07 -94.56 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.719 1.608 . . . . 4.49 112.043 166.064 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -27.89 108.48 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 127.076 2.151 . . . . 2.18 114.992 -170.547 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.7 p -65.29 156.29 32.47 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.232 1.013 . . . . 1.01 110.252 -173.494 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -58.25 -33.82 69.78 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 118.555 0.616 . . . . 2.35 112.39 179.767 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 tt -67.57 -44.11 78.99 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.769 1.628 . . . . 0.91 110.605 177.956 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -72.83 -46.01 55.33 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.35 -0.844 . . . . 2.77 111.287 -178.428 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -53.05 -39.23 63.1 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.828 1.651 . . . . 5.31 111.101 165.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.869 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.08 -44.85 78.99 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 120.686 -1.259 . . . . 0.54 112.73 173.269 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 75.7 t -55.4 -41.5 62.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 121.132 1.787 . . . . 0.65 110.608 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 91.1 mt -56.35 -48.33 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 119.322 0.965 . . . . 0.79 111.465 170.583 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 37.7 t -65.01 -36.58 78.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 119.887 1.221 . . . . 0.48 113.3 178.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.7 mp -65.99 -45.83 80.19 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.13 -0.981 . . . . 0.94 110.783 172.602 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 48.2 t -62.49 -40.67 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.105 1.362 . . . . 0.73 111.647 176.116 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -64.67 -49.07 72.4 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.462 1.505 . . . . 3.02 111.347 176.163 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -80.65 14.0 2.3 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.232 1.013 . . . . 2.81 113.672 -179.052 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -108.31 -58.14 2.03 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.271 1.428 . . . . 2.11 111.321 163.963 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -64.35 -27.46 69.04 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 120.71 -1.244 . . . . 1.82 113.506 -175.993 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 17.3 mtpt -45.98 -37.41 6.52 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 114.186 1.18 . . . . 2.4 114.186 164.62 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -90.74 -34.6 15.3 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.956 1.302 . . . . 2.69 111.258 -176.431 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 67.3 t -68.4 -44.27 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 124.93 1.292 . . . . 3.21 113.485 175.233 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 78.0 p 155.65 -94.77 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 130.417 3.487 . . . . 4.2 110.532 -178.206 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -170.63 -66.93 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.568 1.147 . . . . 7.21 112.301 -174.497 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -106.12 -36.16 7.0 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 122.127 0.965 . . . . 7.51 111.851 -177.342 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 13.1 p -90.65 116.03 28.21 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.609 1.164 . . . . 4.81 112.349 -174.585 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 74.0 mt -59.39 -43.79 92.87 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.294 0.638 . . . . 7.76 112.633 177.521 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . 0.448 HG13 ' HD3' ' B' ' 135' ' ' LYS . 87.6 t -134.2 78.31 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.801 1.24 . . . . 4.31 111.129 -177.092 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -134.58 -12.45 2.34 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 115.245 1.572 . . . . 7.65 115.245 165.84 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 44.7 t-20 -143.76 -58.01 0.39 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.305 0.957 . . . . 6.83 110.148 159.288 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . 0.448 ' HD3' HG13 ' B' ' 132' ' ' VAL . 18.7 mtmt 79.24 -177.72 0.09 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.891 2.076 . . . . 7.17 112.351 174.418 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 14.4 pt -87.6 161.59 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.619 0.768 . . . . 2.74 111.993 167.509 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 51.5 m -93.45 138.66 31.54 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 108.621 -0.881 . . . . 2.32 108.621 156.63 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . 0.459 ' HE2' ' CD2' ' B' ' 173' ' ' HIS . 78.5 mttt -55.03 -32.13 61.61 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 119.918 1.235 . . . . 2.2 113.313 -173.762 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 50.1 p -64.82 -17.3 64.11 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.533 1.533 . . . . 1.64 114.798 176.078 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 43.4 m -85.8 -35.94 20.38 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.947 1.249 . . . . 1.21 112.329 -179.608 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.507 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 11.3 t80 -49.92 -54.14 21.59 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.542 1.137 . . . . 2.16 111.047 173.756 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -62.11 -17.83 58.93 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.213 0.82 . . . . 2.26 113.213 179.505 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -94.94 -43.83 7.99 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.671 1.588 . . . . 2.31 112.516 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -49.39 -41.59 39.86 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.926 -1.109 . . . . 1.26 110.483 162.275 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . 0.45 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 17.2 mt -67.49 -8.25 32.11 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 116.389 1.996 . . . . 1.44 116.389 171.073 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -93.88 -23.02 18.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.95 1.3 . . . . 2.62 113.697 164.843 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.13 -60.99 1.43 Allowed 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.841 1.201 . . . . 1.74 113.54 -178.502 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -76.46 -10.68 59.57 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.619 -1.3 . . . . 3.19 112.638 -174.573 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -126.88 31.75 5.24 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 128.012 2.525 . . . . 1.58 111.678 175.142 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -69.16 -29.64 67.69 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 114.967 1.469 . . . . 1.28 114.967 -171.717 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -86.83 -24.98 24.77 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.391 0.996 . . . . 1.55 111.416 -171.786 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 5.0 tpp -61.81 -17.54 56.57 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.189 0.996 . . . . 1.86 112.719 167.869 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 16.8 tp -80.9 88.71 5.87 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 123.258 1.504 . . . . 2.83 112.168 -169.993 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 40.2 t -71.27 65.37 0.41 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 113.825 -1.534 . . . . 4.34 110.63 158.269 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 35.2 t70 95.38 156.09 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 129.37 3.068 . . . . 3.85 115.936 166.761 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.6 m -34.16 -38.6 0.06 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 130.878 3.671 . . . . 2.48 114.496 158.94 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -57.89 -43.49 94.79 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 120.1 1.318 . . . . 1.66 111.748 176.131 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -68.93 -21.36 64.21 Favored 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 113.413 0.894 . . . . 3.53 113.413 172.857 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -75.06 -45.45 41.41 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 121.182 1.81 . . . . 6.56 112.741 167.617 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -53.18 -40.61 64.49 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.548 0.613 . . . . 4.04 111.419 175.367 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -51.85 -45.28 63.96 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.388 0.884 . . . . 1.56 113.388 171.698 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -63.49 -38.65 91.96 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.175 0.99 . . . . 0.85 113.176 177.011 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -32.77 74.5 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.694 0.998 . . . . 2.41 113.694 175.537 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 39.3 mtmt -53.63 -40.95 66.23 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.423 1.01 . . . . 3.3 111.795 173.138 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.38 -39.87 92.25 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.149 -0.932 . . . . 0.8 111.416 179.202 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 24.8 mm -61.58 -46.92 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 123.887 0.875 . . . . 0.91 110.967 -178.107 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -69.29 -37.48 77.85 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.036 0.446 . . . . 2.36 112.184 177.579 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 -64.61 -26.73 68.53 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 112.646 0.61 . . . . 3.63 112.646 176.706 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.55 -28.12 18.7 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.613 0.765 . . . . 2.45 113.02 179.616 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.42 -37.95 40.55 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.715 0.806 . . . . 2.98 112.663 164.11 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -63.89 -10.67 22.14 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 115.5 1.667 . . . . 2.99 115.5 173.681 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -131.46 6.54 4.45 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.86 1.43 . . . . 3.1 114.86 -173.069 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . 0.463 ' CD2' ' H ' ' B' ' 175' ' ' GLY . 8.2 t60 -156.99 114.92 3.2 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 116.121 1.897 . . . . 3.49 116.121 -158.459 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.35 6.74 9.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 128.328 2.651 . . . . 5.48 114.977 -170.137 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . 0.463 ' H ' ' CD2' ' B' ' 173' ' ' HIS . . . 92.04 10.94 60.66 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 125.689 1.614 . . . . 2.66 112.952 -166.395 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -76.03 67.56 2.39 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.301 1.84 . . . . 5.8 110.877 170.11 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 41.4 mm -52.7 133.65 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 124.431 1.092 . . . . 2.35 110.483 175.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.74 164.99 16.49 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.094 1.758 . . . . 1.74 110.678 -179.496 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -66.22 -43.21 87.34 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 122.171 0.986 . . . . 2.23 111.534 169.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.15 -25.56 67.09 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.815 2.446 . . . . 3.06 113.391 177.251 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -62.75 -59.68 4.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 118.76 0.709 . . . . 3.68 110.269 175.525 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -52.82 -49.03 66.48 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.612 -0.68 . . . . 2.05 110.653 178.327 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 21.0 t-105 -61.84 -48.48 80.38 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.447 0.536 . . . . 0.61 112.447 -177.185 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.5 t -70.72 -27.15 63.76 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.078 -0.963 . . . . 1.55 112.075 -179.279 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.507 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 53.2 mt -72.99 -38.98 66.43 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 116.895 -1.526 . . . . 0.64 112.656 171.775 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 25.9 mm -52.96 -42.66 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 CA-C-N 121.683 2.038 . . . . 0.6 111.579 178.775 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -67.65 -14.32 64.79 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.556 1.074 . . . . 0.65 114.688 177.305 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -79.27 -20.33 69.86 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 118.493 1.147 . . . . 0.75 112.916 176.289 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . 0.407 ' H ' HD12 ' B' ' 189' ' ' ILE . 0.4 OUTLIER -101.36 -40.78 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 CA-C-N 118.317 1.058 . . . . 1.1 110.046 167.019 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 14.0 m -79.17 86.74 4.94 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.606 1.562 . . . . 1.39 109.0 -178.724 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -164.21 -72.91 0.03 OUTLIER Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.39 1.472 . . . . 0.85 113.204 -174.491 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -62.4 -45.69 14.16 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.999 2.466 . . . . 1.01 111.913 178.902 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 21.0 pt -68.92 -17.7 22.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 N-CA-C 113.889 1.07 . . . . 0.93 113.889 174.42 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -55.11 -56.23 22.24 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.216 1.371 . . . . 0.98 113.629 -178.849 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -60.81 -35.02 75.44 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.685 -1.259 . . . . 3.32 112.439 175.701 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 5.4 tt -61.48 -47.16 86.95 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 124.189 0.996 . . . . 1.4 110.249 178.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 45.9 mt -51.17 -59.83 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 124.386 1.074 . . . . 1.03 110.835 171.545 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -71.13 -18.28 62.52 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.423 0.897 . . . . 2.53 113.423 -174.264 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.328 5.0 pt-20 -85.39 -28.12 25.35 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.868 0.758 . . . . 2.82 112.462 173.262 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -80.02 -35.43 37.31 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.059 1.344 . . . . 2.84 114.579 174.407 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -72.6 8.75 1.31 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-O 123.527 1.632 . . . . 2.34 112.266 176.325 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -125.41 -67.64 0.88 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 126.661 1.985 . . . . 2.88 110.089 174.42 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 54.67 5.32 0.09 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 128.839 2.855 . . . . 4.52 115.349 171.53 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 3.8 m -133.75 17.11 3.91 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.909 1.284 . . . . 6.6 111.956 -166.372 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 29.4 t -99.4 -10.95 21.6 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 114.293 1.219 . . . . 8.72 114.293 179.391 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 C--O 1.253 1.242 0 C-N-CA 126.674 1.99 . . . . 9.46 110.365 -162.63 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 CA--C 1.501 -0.921 0 N-CA-C 108.501 -0.926 . . . . 11.97 108.501 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -132.76 -5.33 3.2 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 117.985 -1.486 . . . . 6.6 114.709 -130.047 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 21.6 m -70.41 23.28 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 127.513 2.325 . . . . 3.94 115.127 -176.027 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -22.37 97.15 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 127.929 2.492 . . . . 2.6 114.489 -169.321 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 p -73.2 150.93 41.69 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.212 0.605 . . . . 1.17 110.362 -161.973 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -59.62 -34.19 72.45 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.59 1.086 . . . . 2.93 113.507 -176.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.62 -56.86 13.9 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.161 -0.681 . . . . 1.36 109.161 172.066 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -62.58 -61.36 2.48 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 124.13 0.972 . . . . 3.04 110.318 -172.132 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -20.93 66.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.035 0.534 . . . . 5.33 110.761 -172.597 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.458 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -75.13 -23.64 57.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 120.195 -1.566 . . . . 0.78 113.541 172.679 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 48.8 t -57.09 -32.76 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.674 1.579 . . . . 0.68 110.784 168.306 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.7 mt -56.08 -57.74 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 CA-C-N 118.661 0.664 . . . . 0.85 109.869 167.542 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.1 t -55.7 -39.72 56.83 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 125.301 1.44 . . . . 0.79 112.377 -178.483 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 mp -67.13 -24.32 65.9 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.676 1.19 . . . . 0.95 113.425 176.323 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 77.0 t -89.33 -45.9 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.824 0.738 . . . . 0.88 111.537 175.692 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -45.94 -55.76 6.35 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.215 1.406 . . . . 3.38 111.843 -178.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -47.5 -43.29 24.47 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.968 1.707 . . . . 3.1 114.515 178.705 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -81.83 -21.55 37.53 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.127 0.971 . . . . 2.16 113.209 -174.742 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -85.77 -32.06 22.03 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 121.154 -0.966 . . . . 2.2 112.454 165.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.8 tttp -50.39 -38.63 43.75 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.585 1.954 . . . . 4.26 113.843 178.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -85.5 8.95 17.26 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.321 1.449 . . . . 2.37 114.212 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.8 m -141.14 -174.37 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.541 1.536 . . . . 2.29 110.37 178.006 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.4 p -172.09 -77.21 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.288 -0.882 . . . . 4.52 111.779 178.2 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? 177.86 -27.12 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 129.644 3.178 . . . . 12.17 110.925 -165.233 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -89.26 70.75 8.25 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.684 1.194 . . . . 11.49 111.192 -179.521 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.5 m -173.73 158.52 3.31 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.024 1.73 . . . . 8.34 110.779 179.008 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.8 mt -61.95 0.54 0.37 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 126.974 2.11 . . . . 14.59 115.898 -172.408 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.7 t -147.97 136.94 15.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 128.59 2.756 . . . . 5.21 105.29 169.794 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.35 -36.09 52.78 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.372 1.069 . . . . 9.85 113.773 -174.72 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -131.14 124.16 30.13 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.547 1.939 . . . . 10.98 108.852 165.762 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -170.88 112.0 0.38 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.197 1.399 . . . . 6.92 111.242 171.481 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.8 pt -75.33 -176.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.549 0.74 . . . . 2.48 110.01 164.735 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.8 t -81.48 137.61 35.59 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.457 -1.402 . . . . 2.55 108.285 157.026 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.1 ttpt -58.47 -32.5 68.81 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.917 -1.114 . . . . 2.25 110.986 170.219 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.9 m -66.26 -18.68 65.5 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.849 1.659 . . . . 2.09 114.182 170.052 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 53.2 m -69.21 -41.94 76.4 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.742 1.61 . . . . 1.1 111.386 173.057 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -50.46 -50.42 52.41 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.664 1.186 . . . . 2.09 113.009 -171.459 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -59.7 -25.66 64.96 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.835 1.654 . . . . 3.99 113.757 178.586 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -98.96 -44.44 6.32 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 124.991 1.316 . . . . 2.76 111.851 -175.641 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 17.9 ptm -57.42 -32.43 66.86 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.66 -1.275 . . . . 2.85 111.848 169.514 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.3 mt -61.14 -14.1 22.4 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.388 1.625 . . . . 1.06 115.388 166.109 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -109.44 -5.35 15.82 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 120.322 1.419 . . . . 2.18 114.175 169.082 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.76 -74.72 0.5 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.74 1.155 . . . . 1.51 109.824 166.445 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -59.1 -34.52 72.1 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.555 1.142 . . . . 3.38 113.823 -177.284 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.18 9.47 34.12 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 115.243 1.572 . . . . 1.63 115.243 -173.583 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -48.16 -34.58 10.19 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.518 1.673 . . . . 1.34 115.518 -172.181 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.402 ' CD2' ' HA ' ' B' ' 108' ' ' TYR . 73.5 m-70 -62.01 -34.98 77.2 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.965 -1.085 . . . . 1.68 112.931 -177.333 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.9 tpp -85.0 -3.04 58.63 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.949 1.7 . . . . 1.95 112.871 -178.467 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.2 mp -96.61 112.32 24.12 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.182 1.393 . . . . 2.72 111.351 -178.813 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 t -75.56 62.96 1.47 Allowed 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.418 -0.801 . . . . 4.27 109.376 152.565 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.6 t70 38.29 -109.61 0.08 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.234 2.214 . . . . 7.15 111.802 -166.661 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.84 -14.44 36.92 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 126.481 1.913 . . . . 2.33 114.213 -173.896 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -63.85 -30.86 78.92 Favored Glycine 0 CA--C 1.533 1.166 0 CA-C-N 120.732 1.606 . . . . 3.16 111.175 168.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -78.46 -75.65 0.22 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.16 0.584 . . . . 3.63 110.464 157.793 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.0 ttp-105 -51.91 -28.75 17.39 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 117.837 2.532 . . . . 5.31 117.837 -161.816 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -53.69 -35.85 61.54 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 121.122 1.783 . . . . 3.64 112.684 170.311 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.33 -26.37 68.4 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.796 1.406 . . . . 1.18 114.796 172.888 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.33 -42.59 68.38 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.561 1.073 . . . . 0.88 111.366 171.224 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -68.31 -29.67 68.49 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.747 1.219 . . . . 1.97 112.991 -175.778 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -48.69 -40.05 26.8 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.013 0.911 . . . . 3.51 113.042 165.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 5.9 mt -78.55 -36.65 44.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.729 -1.123 . . . . 1.08 111.672 -176.596 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.9 mm -54.68 -53.69 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 122.99 0.516 . . . . 1.13 110.386 175.41 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -65.45 -34.42 78.25 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.284 0.846 . . . . 2.08 113.284 -179.508 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -62.59 -29.22 70.44 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.312 1.045 . . . . 2.63 112.584 176.201 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -88.56 -37.23 15.86 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.246 1.018 . . . . 2.71 111.669 170.865 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.84 -24.43 67.74 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.914 -1.116 . . . . 3.38 113.945 177.618 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.86 -11.99 21.9 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.927 1.455 . . . . 3.11 114.927 169.823 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -160.31 -17.89 0.06 Allowed 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 118.609 2.818 . . . . 2.91 118.609 -171.747 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -96.47 114.68 26.37 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 121.511 1.959 . . . . 4.36 111.149 175.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -63.54 -18.27 63.67 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.943 2.497 . . . . 4.05 115.631 -172.207 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 118.0 2.03 16.49 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.943 -0.921 . . . . 2.75 113.269 -160.736 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -66.18 145.49 55.73 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.726 1.263 . . . . 4.18 110.057 137.731 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 13.6 mt -128.33 149.57 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 127.227 2.211 . . . . 2.66 106.02 167.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.7 t -123.75 159.98 28.29 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 114.0 1.111 . . . . 1.47 114.0 -174.372 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -73.74 -30.56 62.89 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 120.49 -1.381 . . . . 2.36 113.647 -173.177 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -70.3 -25.61 63.41 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.169 1.388 . . . . 3.94 112.739 168.882 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.5 tt0 -58.01 -58.19 9.5 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.276 1.03 . . . . 3.35 111.33 -175.523 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -56.14 -46.86 79.09 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.963 -1.086 . . . . 2.23 112.403 -176.287 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.8 t-105 -61.46 -45.94 92.16 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 118.856 -0.592 . . . . 0.64 111.278 178.223 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -38.22 90.11 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.595 0.758 . . . . 1.58 111.61 178.504 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 86.2 mt -60.75 -46.05 91.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 118.269 -0.872 . . . . 0.77 111.754 174.782 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 31.0 mm -51.35 -40.56 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 CA-C-N 120.485 1.493 . . . . 0.7 112.872 -178.726 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.86 -16.81 57.35 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.079 0.847 . . . . 0.68 114.452 177.151 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.4 -19.61 76.19 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 121.124 -1.221 . . . . 0.89 113.358 172.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.8 mp -103.02 -48.67 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 118.695 1.248 . . . . 0.91 109.879 171.083 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.6 m -72.44 53.76 0.31 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.587 2.355 . . . . 1.34 110.077 163.634 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -127.46 -71.46 0.17 Allowed Glycine 0 CA--C 1.528 0.886 0 C-N-CA 128.422 2.915 . . . . 0.76 107.998 172.111 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -66.9 -52.3 0.7 Allowed 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.441 2.76 . . . . 0.97 113.484 175.844 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -72.29 -18.95 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 119.632 1.105 . . . . 1.11 113.716 -173.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -51.15 -59.63 3.98 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.191 1.397 . . . . 0.88 112.325 -178.522 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -56.09 -45.29 79.43 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.477 0.547 . . . . 2.64 112.477 175.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -56.97 -42.65 80.54 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 125.094 1.358 . . . . 1.27 111.286 -174.704 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 21.2 mt -54.95 -55.92 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.776 0.83 . . . . 1.64 110.756 176.374 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -63.43 -37.39 87.09 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.446 -0.784 . . . . 2.13 112.189 -179.568 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -66.37 -32.57 74.04 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.004 0.921 . . . . 3.05 110.932 177.117 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -69.97 -40.44 75.37 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 117.496 -1.24 . . . . 2.71 113.414 170.456 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -59.33 -41.5 89.29 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.2 1.364 . . . . 2.74 111.432 177.578 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.02 -40.85 97.24 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.456 -0.778 . . . . 2.98 111.01 179.194 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -72.95 -15.0 61.57 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 114.381 -1.282 . . . . 5.74 112.905 178.037 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.5 t 60.64 27.92 17.62 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.977 2.111 . . . . 7.65 113.064 177.696 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.9 t -124.41 50.77 1.65 Allowed 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.411 1.263 . . . . 12.69 114.411 -153.343 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 26.3 t . . . . . 0 N--CA 1.484 1.228 0 N-CA-C 113.534 0.938 . . . . 16.5 113.534 160.226 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 CA--C 1.502 -0.887 0 N-CA-C 108.684 -0.858 . . . . 12.0 108.684 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -132.07 -6.2 3.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 118.453 -1.299 . . . . 6.34 114.343 -130.943 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 41.0 m -72.78 35.22 0.07 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.911 2.084 . . . . 3.81 113.63 177.845 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.402 ' HA ' ' CD2' ' A' ' 48' ' ' HIS . 15.2 m-85 -32.44 102.65 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.65 2.38 . . . . 2.48 112.501 -174.194 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 3.1 p -74.3 152.08 39.71 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.434 0.294 . . . . 1.2 111.059 -160.06 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -60.1 -21.96 62.16 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.218 1.192 . . . . 2.38 114.218 -177.61 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 1.2 tt -80.56 -48.04 13.31 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.767 0.827 . . . . 1.66 110.183 171.614 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -67.36 -58.48 4.7 Favored 'General case' 0 C--N 1.333 -0.131 0 C-N-CA 123.404 0.682 . . . . 2.92 111.036 -175.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -20.1 56.75 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.152 0.981 . . . . 4.89 112.072 -176.689 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.458 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.3 -34.33 74.52 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.321 -1.487 . . . . 0.61 113.425 170.183 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 58.6 t -58.02 -32.9 44.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.254 0.934 . . . . 0.62 110.905 175.703 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 44.0 mt -55.92 -57.66 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 109.079 -0.711 . . . . 1.0 109.079 168.735 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 72.3 t -60.74 -36.54 71.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 125.756 1.622 . . . . 0.79 112.932 -176.251 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.65 -38.57 84.02 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.641 -0.662 . . . . 1.0 112.135 175.121 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 60.2 t -76.32 -39.05 34.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-N 118.503 0.592 . . . . 0.78 110.955 178.464 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -51.93 -45.88 64.48 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.868 1.667 . . . . 2.8 111.36 175.562 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -58.97 -33.77 71.04 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.362 1.465 . . . . 3.33 114.405 175.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -80.82 -43.78 19.51 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.656 0.662 . . . . 2.05 112.311 -179.541 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -72.3 -27.31 62.37 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.406 -0.809 . . . . 2.16 112.654 176.452 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -42.2 -43.74 3.49 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.179 1.792 . . . . 3.34 114.128 171.432 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 20.2 m-30 -97.77 18.67 15.18 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.132 1.373 . . . . 2.45 113.732 -172.159 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 34.9 m -146.27 -176.51 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 126.152 1.781 . . . . 2.22 110.278 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 16.6 p -173.05 -74.12 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.057 -1.027 . . . . 4.63 111.797 174.272 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? 172.85 -26.4 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 130.3 3.44 . . . . 11.87 110.538 -163.301 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -89.71 70.09 7.73 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.096 1.358 . . . . 11.2 111.157 179.764 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 2.5 m -175.03 159.5 2.64 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.222 1.809 . . . . 8.27 110.791 -178.72 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 28.1 mt -62.05 0.97 0.33 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 126.825 2.05 . . . . 14.54 115.705 -173.745 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 21.2 t -149.41 138.2 15.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 128.659 2.784 . . . . 5.25 105.453 172.597 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.73 -37.41 59.18 Favored 'General case' 0 CA--C 1.55 0.958 0 N-CA-C 113.351 0.871 . . . . 9.83 113.351 -177.176 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -131.27 131.94 44.22 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.285 1.834 . . . . 11.0 108.493 165.268 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 3.5 tmmm? -177.75 113.17 0.08 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.528 1.931 . . . . 6.85 110.613 171.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 43.3 pt -76.38 -175.69 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 122.988 0.515 . . . . 2.59 110.325 165.271 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 33.7 t -85.52 136.55 33.37 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.595 -1.316 . . . . 2.44 108.703 157.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 17.5 ttpt -59.47 -30.72 68.73 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.97 -1.081 . . . . 2.32 111.628 174.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 1.7 m -67.62 -18.59 65.02 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.918 1.687 . . . . 1.99 113.879 171.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.6 m -70.59 -40.78 73.05 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 120.29 1.405 . . . . 1.09 112.316 175.168 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.427 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 64.7 t80 -51.21 -53.55 34.04 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.646 1.179 . . . . 2.18 113.12 -173.409 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -54.75 -22.43 14.09 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.074 1.75 . . . . 4.21 114.076 178.254 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -106.46 -38.24 6.25 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.999 1.32 . . . . 3.26 113.064 -176.268 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -47.31 -43.16 22.4 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.778 1.231 . . . . 1.46 110.847 161.613 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 25.5 mt -63.26 -12.1 26.48 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 116.174 1.916 . . . . 1.31 116.174 171.578 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -113.98 -8.13 13.09 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 115.106 1.521 . . . . 2.38 115.106 167.672 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.89 -76.41 0.44 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.363 0.983 . . . . 1.46 110.015 167.225 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -58.92 -36.3 74.52 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.525 1.511 . . . . 3.58 114.4 -178.856 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.25 9.5 43.26 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 115.359 1.614 . . . . 1.69 115.359 -174.35 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -47.17 -33.62 5.43 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.197 1.925 . . . . 1.39 116.197 -170.522 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -65.07 -35.38 80.98 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.942 1.246 . . . . 1.73 113.341 -175.5 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 18.3 tpp -78.99 -8.76 59.2 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.304 1.442 . . . . 1.93 113.142 -177.09 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.5 mp -92.34 114.43 26.98 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 120.58 -1.325 . . . . 2.72 112.522 -172.185 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 29.8 t -73.93 60.75 0.76 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 115.784 -0.644 . . . . 4.26 109.533 154.059 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 35.3 t70 36.86 -107.64 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.832 2.053 . . . . 6.77 112.007 -165.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.04 -17.92 26.91 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 126.805 2.042 . . . . 2.47 113.853 -174.189 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -62.55 -29.33 73.23 Favored Glycine 0 N--CA 1.473 1.164 0 CA-C-N 120.908 1.685 . . . . 3.24 111.259 169.614 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -81.18 -74.57 0.32 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.896 0.878 . . . . 3.34 110.95 160.492 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 25.8 ttp-105 -53.69 -27.86 30.29 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 117.67 2.47 . . . . 5.32 117.67 -164.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 8.3 mmtp -54.12 -37.46 64.37 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 121.344 1.884 . . . . 3.66 112.454 171.905 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -58.63 -26.54 63.83 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.747 1.388 . . . . 1.18 114.747 172.329 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -75.44 -43.24 50.72 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.895 1.278 . . . . 0.9 111.37 174.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.64 -28.35 67.65 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.678 1.191 . . . . 1.89 112.354 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -50.24 -39.47 44.77 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-O 122.068 0.937 . . . . 3.29 112.923 165.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 9.5 mt -77.21 -35.49 55.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.755 -1.111 . . . . 1.03 111.819 -174.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 37.7 mm -56.09 -52.14 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 122.781 0.432 . . . . 1.0 110.208 176.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -65.42 -34.12 77.55 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.14 0.793 . . . . 2.04 113.14 -179.633 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -62.3 -29.25 70.3 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.05 0.94 . . . . 2.59 112.455 176.419 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -90.04 -34.76 15.83 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.513 1.125 . . . . 2.91 111.654 171.606 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.28 -22.4 66.94 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.517 -1.364 . . . . 3.42 114.135 175.319 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -65.34 -11.59 43.49 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.031 1.493 . . . . 3.01 115.031 168.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -162.05 -15.27 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.19 0 N-CA-C 119.097 2.999 . . . . 3.0 119.097 -170.648 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -101.23 116.2 32.26 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.986 2.175 . . . . 4.5 110.935 175.601 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -68.51 -11.5 59.94 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 128.406 2.682 . . . . 3.92 116.732 -166.546 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 110.89 0.15 28.72 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-O 118.694 -1.059 . . . . 2.75 113.283 -160.396 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 23.1 mmt85 -67.15 144.76 55.85 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 119.199 1.499 . . . . 4.33 109.612 136.916 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 13.3 mt -129.89 146.16 34.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 C-N-CA 126.666 1.986 . . . . 3.0 106.137 167.126 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 5.4 t -106.32 177.74 4.77 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.293 1.037 . . . . 1.52 113.658 -176.895 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -80.81 -48.94 11.73 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.029 -1.045 . . . . 2.0 111.954 171.53 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -64.35 -27.58 69.12 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.734 1.613 . . . . 3.71 112.451 176.726 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -54.4 -54.11 45.06 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.363 0.665 . . . . 3.33 110.938 173.62 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -62.61 -47.16 84.99 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.801 -1.187 . . . . 2.49 112.324 -175.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 49.0 t-105 -60.58 -46.99 88.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 119.182 -0.437 . . . . 0.6 111.228 178.236 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.99 -31.94 69.88 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 118.725 -0.655 . . . . 1.64 112.105 -178.469 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.427 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 28.2 mt -60.46 -47.86 84.27 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.129 0.877 . . . . 0.58 111.459 171.164 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.9 mm -53.15 -37.71 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 120.188 1.358 . . . . 0.81 112.592 179.27 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -59.42 -19.86 48.94 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-N 118.925 0.784 . . . . 0.67 113.898 175.216 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.33 -19.96 79.17 Favored Glycine 0 CA--C 1.534 1.239 0 CA-C-N 118.545 1.173 . . . . 0.87 113.846 173.239 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 1.8 mp -106.06 -35.43 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.484 1.642 . . . . 1.04 110.977 173.495 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 40.7 m -72.75 65.35 0.7 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.537 1.935 . . . . 1.44 109.445 167.155 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -150.51 -78.87 0.02 OUTLIER Glycine 0 CA--C 1.529 0.929 0 C-N-CA 126.088 1.804 . . . . 0.9 111.329 -174.711 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -63.26 -46.51 9.79 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.129 2.553 . . . . 1.16 112.446 179.288 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 5.8 pt -75.93 -23.34 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 N-CA-C 113.447 0.906 . . . . 1.29 113.447 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -53.73 -56.67 15.36 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.475 1.11 . . . . 0.86 112.173 -173.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -57.62 -46.5 84.02 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.88 0.696 . . . . 2.88 112.88 174.61 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.4 tt -57.78 -40.35 79.62 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 125.351 1.461 . . . . 1.49 111.304 -173.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 20.1 mt -56.21 -57.81 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.269 1.028 . . . . 1.77 110.345 175.924 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -60.76 -36.83 79.93 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.522 -0.736 . . . . 2.12 112.088 179.947 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -67.33 -33.49 75.36 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.7 0.8 . . . . 3.01 110.766 177.688 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -68.72 -40.72 79.79 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.123 1.369 . . . . 2.8 113.019 171.873 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -61.23 -37.34 82.68 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 120.256 1.389 . . . . 2.67 111.644 178.396 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.44 -41.8 84.15 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.624 -0.672 . . . . 2.7 110.889 178.021 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -71.32 -15.34 62.4 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.545 -1.207 . . . . 5.79 112.616 177.082 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 32.1 t 61.04 26.36 16.31 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 127.214 2.206 . . . . 7.58 113.109 177.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 48.2 t -121.36 47.27 1.88 Allowed 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.335 1.235 . . . . 12.52 114.335 -154.479 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 28.6 t . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 118.139 -0.934 . . . . 16.32 111.844 156.139 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.476 0.867 0 CA-C-O 118.592 -0.718 . . . . 10.15 110.737 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 80.4 -22.09 0.29 Allowed 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 117.261 2.319 . . . . 8.92 117.261 137.255 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.6 t -74.11 67.78 1.36 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.867 1.267 . . . . 5.78 111.276 174.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 95.81 168.01 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 131.381 3.872 . . . . 2.27 110.096 -175.854 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.8 p -106.6 162.04 14.1 Favored 'General case' 0 N--CA 1.485 1.32 0 O-C-N 121.284 -0.885 . . . . 1.02 111.089 167.762 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -70.27 -23.37 62.87 Favored 'General case' 0 C--O 1.22 -0.458 0 O-C-N 121.47 -0.769 . . . . 2.91 112.98 172.876 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -40.79 97.76 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.903 1.683 . . . . 0.92 108.788 172.374 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -67.98 -63.85 0.98 Allowed 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 125.151 1.38 . . . . 2.6 111.641 178.016 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -50.81 -27.75 7.94 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.012 1.733 . . . . 5.63 114.05 170.827 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.708 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -70.34 -45.08 66.87 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 119.938 -1.726 . . . . 0.72 113.204 167.789 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 67.3 t -59.24 -32.81 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-N 121.046 1.748 . . . . 0.77 110.86 170.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.6 mt -59.0 -60.14 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 117.362 -1.304 . . . . 0.78 110.503 165.086 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.5 t -56.08 -33.9 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 126.218 1.807 . . . . 0.63 113.056 -176.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.75 -39.56 91.2 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.32 -0.863 . . . . 1.07 111.605 171.068 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 71.1 t -73.23 -40.35 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.657 1.183 . . . . 0.8 111.545 174.198 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -54.85 -46.01 74.61 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.184 1.356 . . . . 5.67 109.977 171.426 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -76.41 -24.05 54.04 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.143 1.164 . . . . 2.04 114.143 -177.193 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -75.32 -45.75 37.63 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.144 -1.598 . . . . 2.57 110.921 167.62 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -71.52 -21.17 61.95 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.718 1.007 . . . . 2.82 113.718 -172.795 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -48.64 -20.08 0.42 Allowed 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 114.512 1.301 . . . . 3.84 114.512 169.172 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -100.56 -6.23 25.66 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.935 1.694 . . . . 2.92 115.336 -179.364 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.8 m -120.41 -172.36 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 119.804 1.184 . . . . 2.97 111.93 -175.316 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.8 p -121.36 -87.52 0.64 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.813 0.845 . . . . 4.27 111.226 171.766 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.4 ttpt -160.9 -49.5 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.497 1.044 . . . . 6.49 111.42 178.578 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -85.67 74.42 10.26 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.393 -0.817 . . . . 9.39 112.793 -178.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.3 t 93.43 139.05 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 128.437 2.695 . . . . 6.65 114.144 164.143 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.6 mt -71.06 -48.33 53.31 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.877 0.871 . . . . 8.32 111.536 -174.134 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 p -61.67 -30.69 48.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 124.668 1.187 . . . . 4.23 112.976 177.511 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.4 ' HB3' ' HE3' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -62.93 -17.3 61.65 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.491 1.116 . . . . 7.26 111.831 172.071 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -128.33 5.2 5.74 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.454 -1.404 . . . . 7.19 114.413 -175.317 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.6 132.1 51.27 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.644 0.979 . . . . 6.6 113.644 -164.155 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 12.1 pt -82.35 -141.85 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.479 1.111 . . . . 2.81 112.063 -178.263 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.5 m -121.71 135.66 54.95 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.2 -0.938 . . . . 2.65 111.037 -179.728 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -62.8 -32.73 73.97 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.078 -1.014 . . . . 2.58 111.947 -178.771 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.8 m -57.34 -19.42 22.58 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.418 1.887 . . . . 2.38 115.109 169.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.7 m -82.81 -30.18 28.98 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.177 0.899 . . . . 1.52 112.905 178.119 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.464 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 36.6 t80 -57.22 -47.88 80.21 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.533 1.515 . . . . 2.07 112.317 -176.831 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -57.8 -23.09 50.84 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.086 1.354 . . . . 2.32 114.215 174.435 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -100.18 -37.18 9.04 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.264 1.425 . . . . 3.24 112.259 -175.474 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 3.5 ttm -48.32 -44.76 34.4 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 120.355 -1.466 . . . . 1.28 110.283 157.539 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.447 HD11 ' CE1' ' A' ' 38' ' ' PHE . 26.3 mt -64.82 -33.33 75.74 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 114.827 1.417 . . . . 1.07 114.827 175.656 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -87.68 -11.55 48.02 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 120.358 1.436 . . . . 2.4 114.028 -178.769 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.89 -64.2 1.08 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 126.388 1.875 . . . . 2.69 111.691 173.514 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -74.52 -22.56 58.98 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 118.099 -0.953 . . . . 3.79 113.489 -173.377 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 24.2 mt -113.63 31.82 6.24 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.73 1.212 . . . . 2.13 112.707 165.771 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -55.69 -31.1 62.14 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.348 -1.47 . . . . 1.6 114.247 -175.404 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -78.55 -49.45 13.3 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.666 0.786 . . . . 1.58 109.893 -168.703 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.4 mtm -79.35 -18.68 51.97 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.939 1.088 . . . . 2.29 113.939 174.842 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mp -65.25 -48.99 71.35 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 120.208 1.367 . . . . 2.97 110.355 161.45 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.6 m 73.81 -40.71 0.47 Allowed 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.684 1.994 . . . . 4.35 114.623 168.427 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -157.47 161.49 38.88 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 123.845 1.783 . . . . 4.2 112.614 -179.031 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.8 m -33.05 -44.77 0.12 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 130.605 3.562 . . . . 2.59 114.445 163.194 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -67.46 -47.22 64.08 Favored Glycine 0 N--CA 1.468 0.777 0 C-N-CA 124.657 1.122 . . . . 2.18 112.469 -174.943 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -65.22 -38.93 91.97 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 117.58 0.69 . . . . 2.73 111.334 173.26 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.7 ttt-85 -58.28 -24.35 59.2 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.981 -1.074 . . . . 4.68 113.392 177.77 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -57.16 -35.65 69.8 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 120.793 -1.192 . . . . 3.41 112.927 170.648 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.42 -14.66 63.16 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 114.524 1.305 . . . . 1.24 114.524 176.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.66 -54.14 4.91 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.698 1.199 . . . . 0.99 111.872 165.288 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.14 -32.15 73.61 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.167 0.587 . . . . 2.02 112.402 -176.498 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -57.21 -30.14 64.3 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.223 -0.923 . . . . 2.67 112.905 172.746 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 16.6 mt -75.41 -37.24 60.57 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 121.857 -0.527 . . . . 1.1 111.517 177.254 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.9 mm -56.54 -50.54 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 123.378 0.671 . . . . 1.16 110.495 -177.764 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -64.28 -41.78 96.73 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.364 1.066 . . . . 1.97 112.969 179.039 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -59.5 -32.5 70.35 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.107 1.363 . . . . 2.32 112.6 174.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.42 -31.29 20.13 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.792 1.237 . . . . 2.29 110.961 175.601 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -63.18 -35.3 79.85 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.702 1.601 . . . . 3.83 114.528 -177.55 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.39 -10.6 3.31 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 114.432 1.271 . . . . 2.91 114.432 171.357 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -131.14 -10.91 3.73 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.98 1.844 . . . . 3.31 115.98 -167.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.84 134.89 11.11 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 121.803 2.092 . . . . 3.67 114.674 -160.049 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -74.41 12.65 0.72 Allowed 'General case' 0 N--CA 1.479 0.976 0 O-C-N 120.172 -1.58 . . . . 4.87 112.817 167.974 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.84 49.8 16.13 Favored Glycine 0 C--N 1.339 0.706 0 C-N-CA 124.474 1.035 . . . . 4.58 111.07 -172.5 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.1 mmt85 -65.88 85.25 0.08 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 105.65 -1.982 . . . . 6.08 105.65 159.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 9.3 mm -69.85 86.91 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 108.384 -0.969 . . . . 2.85 108.384 -173.021 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.4 m -66.61 159.26 27.9 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 124.141 0.976 . . . . 2.28 110.315 171.776 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -51.76 -42.87 62.7 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-O 122.276 1.036 . . . . 2.65 110.873 171.939 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -74.98 -20.22 59.76 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 131.288 3.835 . . . . 3.62 114.872 173.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -68.27 -55.04 13.56 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 122.003 2.183 . . . . 3.79 107.243 167.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -57.92 -52.45 65.43 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.049 -1.032 . . . . 1.71 112.712 176.657 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -64.25 -41.24 97.05 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.266 -0.897 . . . . 0.85 113.065 -176.697 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.59 -37.37 73.9 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.19 0.904 . . . . 1.86 111.054 177.652 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.464 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 64.6 mt -66.03 -40.32 90.95 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 117.947 -1.025 . . . . 0.9 112.289 177.325 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 36.7 mm -56.46 -34.27 40.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-N 121.417 1.917 . . . . 0.73 112.303 177.502 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -73.81 -1.88 59.84 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.247 1.403 . . . . 1.15 114.917 176.178 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.72 -28.21 19.58 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-N 118.715 1.257 . . . . 0.67 114.211 173.086 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.504 HD12 ' H ' ' A' ' 86' ' ' ILE . 0.5 OUTLIER -93.68 -40.23 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-N 118.417 1.109 . . . . 0.94 110.104 172.724 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 11.5 m -75.65 124.58 27.48 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.357 1.463 . . . . 1.72 108.415 176.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 139.25 -70.66 0.46 Allowed Glycine 0 N--CA 1.472 1.047 0 CA-C-O 117.918 -1.49 . . . . 1.08 113.21 -176.023 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -59.87 -45.58 23.88 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.021 2.481 . . . . 1.04 111.677 178.276 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.6 pp -84.97 -5.46 9.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 113.403 0.89 . . . . 1.3 113.403 175.225 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.05 81.9 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.815 1.188 . . . . 1.06 112.711 -174.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -65.91 -36.62 83.9 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.106 -0.996 . . . . 3.58 113.564 174.131 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.9 tt -60.5 -38.64 84.96 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 117.87 -1.062 . . . . 1.83 110.385 177.061 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.7 mt -49.25 -65.52 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 123.63 0.772 . . . . 1.38 111.133 170.247 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -61.72 -33.59 74.29 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.903 -0.498 . . . . 2.37 111.994 -175.115 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.308 2.8 pt-20 -86.97 -9.91 54.46 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 119.029 -0.51 . . . . 3.23 112.244 -176.048 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -78.05 -36.11 48.79 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.025 1.73 . . . . 3.03 113.16 163.525 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -71.08 8.11 1.04 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 124.026 1.869 . . . . 2.45 112.208 174.326 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -130.03 -66.89 0.77 Allowed 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 127.007 2.123 . . . . 3.0 109.515 176.501 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . 0.255 10.0 pt20 53.42 -0.37 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 131.063 3.745 . . . . 5.37 115.612 178.732 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.2 t -150.13 33.63 0.66 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.652 1.981 . . . . 5.96 110.653 -170.9 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.2 t -156.16 80.2 0.98 Allowed 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.973 -1.08 . . . . 7.46 110.626 -177.335 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.0 t . . . . . 0 C--O 1.255 1.378 0 CA-C-O 114.023 -2.894 . . . . 10.19 112.907 179.146 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 24.6 m . . . . . 0 N--CA 1.476 0.861 0 CA-C-O 118.807 -0.616 . . . . 9.93 110.571 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 82.62 -19.18 0.42 Allowed 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 117.156 2.28 . . . . 8.44 117.156 136.662 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 49.7 t -70.98 73.56 0.61 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.018 1.327 . . . . 6.39 111.968 175.793 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 95.48 164.17 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 131.68 3.992 . . . . 2.35 110.49 -178.759 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 6.2 p -104.93 158.44 16.54 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.968 0.907 . . . . 1.05 110.662 169.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -68.54 -25.27 64.84 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 118.945 0.793 . . . . 3.15 112.366 175.544 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.03 -40.9 99.12 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 120.48 1.491 . . . . 0.76 108.895 172.784 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -67.58 -63.04 1.14 Allowed 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 124.788 1.235 . . . . 2.62 111.781 177.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 36.7 tptt -49.9 -28.97 7.35 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 121.022 1.737 . . . . 6.4 114.104 169.472 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.708 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -69.41 -46.46 66.81 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 119.69 -1.881 . . . . 0.8 113.237 167.536 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 85.9 t -56.9 -33.95 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 CA-C-N 121.626 2.012 . . . . 0.88 110.868 170.37 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 17.7 mt -59.01 -61.08 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-O 117.684 -1.151 . . . . 0.88 110.91 166.111 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 10.6 t -55.75 -35.83 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 126.444 1.898 . . . . 0.75 112.519 -176.088 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.2 mp -63.35 -36.71 84.59 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.441 -0.787 . . . . 1.1 111.323 173.088 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 39.8 t -80.3 -37.95 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 125.344 1.458 . . . . 1.02 111.768 176.083 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -53.4 -45.85 69.47 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.104 1.32 . . . . 5.56 110.399 169.634 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -72.36 -18.24 61.77 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.088 1.144 . . . . 2.01 114.088 -178.624 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -80.71 -48.13 13.0 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 120.338 -1.476 . . . . 2.16 111.146 167.26 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -71.34 -20.76 62.13 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.262 0.838 . . . . 2.49 113.262 -167.497 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -46.73 -19.71 0.1 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.49 1.516 . . . . 3.79 114.504 164.169 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -107.52 5.73 27.39 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.384 1.874 . . . . 2.8 115.429 -178.513 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 28.2 m -139.24 -169.22 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 119.972 1.26 . . . . 2.34 111.291 179.287 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 30.9 p -120.43 -84.32 0.66 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.734 1.152 . . . . 4.3 113.697 177.394 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -165.07 -54.48 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.461 1.028 . . . . 6.14 111.166 -178.517 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -80.75 68.71 7.09 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.901 0.88 . . . . 9.85 112.493 176.016 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 8.9 t 93.54 146.59 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 128.212 2.605 . . . . 6.37 114.238 170.857 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 73.5 mt -72.24 -48.3 43.83 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.527 1.131 . . . . 8.63 111.74 -176.624 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.77 -19.84 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.821 1.248 . . . . 4.19 113.184 177.672 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -21.31 66.8 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.823 0.849 . . . . 7.38 112.852 173.104 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -137.5 -1.58 2.06 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 115.283 1.586 . . . . 7.67 115.283 -178.756 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.07 134.8 0.17 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.577 1.951 . . . . 6.37 115.384 -177.732 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 9.7 pt -83.93 -123.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.864 0.866 . . . . 3.11 113.058 -178.48 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 42.8 t -135.56 132.99 37.88 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.83 1.652 . . . . 2.93 109.384 175.303 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -62.12 -18.38 60.67 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.217 1.007 . . . . 2.23 112.999 177.352 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.4 m -70.69 -17.99 62.83 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.797 1.639 . . . . 2.36 114.333 170.298 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 9.1 m -89.9 -19.51 24.48 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.957 1.095 . . . . 2.33 113.957 177.556 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.459 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 59.5 t80 -53.89 -52.55 60.14 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 120.888 1.676 . . . . 2.26 111.072 177.811 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 33.8 ptt180 -57.48 -24.65 57.05 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.722 1.609 . . . . 2.37 114.468 174.283 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -100.95 -38.36 8.24 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.931 1.692 . . . . 3.53 111.722 -168.813 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 6.3 tmm? -47.88 -43.93 29.04 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.393 -1.442 . . . . 1.18 110.969 152.726 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . 0.448 HD11 ' CZ ' ' B' ' 141' ' ' PHE . 93.9 mt -74.34 -24.75 59.24 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.769 1.396 . . . . 1.17 114.769 178.095 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -83.64 -16.82 43.72 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.827 1.649 . . . . 2.71 113.518 173.579 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -100.84 -63.61 1.12 Allowed 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.928 1.691 . . . . 2.72 113.131 176.066 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -74.66 -17.08 60.74 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 119.434 1.015 . . . . 3.73 113.552 -173.252 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 46.0 mt -117.2 30.55 7.25 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.827 1.651 . . . . 2.01 112.441 165.447 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -57.25 -28.72 63.19 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 120.231 -1.543 . . . . 1.66 113.525 -176.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -76.95 -51.59 10.91 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.446 -0.784 . . . . 1.62 109.374 -168.819 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 24.4 mtm -76.65 -17.32 59.22 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.943 1.09 . . . . 2.36 113.943 174.391 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 4.3 mp -66.7 -51.14 59.43 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.172 1.351 . . . . 2.96 110.396 162.315 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 14.2 m 73.63 -48.92 0.68 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.754 2.022 . . . . 4.4 113.733 171.436 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -145.01 162.75 36.16 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 123.884 1.802 . . . . 4.43 113.409 175.69 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -32.79 -42.88 0.08 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 131.094 3.758 . . . . 2.81 114.32 161.064 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -66.82 -34.1 86.19 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 124.399 1.0 . . . . 2.26 113.336 -179.198 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -76.98 -41.83 41.38 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 117.818 0.809 . . . . 2.69 111.068 172.708 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 10.2 ttt180 -51.15 -30.1 15.65 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 120.604 -1.31 . . . . 4.94 114.017 174.156 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -50.86 -37.54 43.93 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.633 -1.292 . . . . 3.9 112.5 173.014 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -71.78 -14.24 61.93 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 114.979 1.474 . . . . 1.36 114.979 178.451 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -84.06 -52.73 6.06 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.374 0.988 . . . . 0.97 111.214 163.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.14 -30.81 70.9 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.508 0.723 . . . . 1.96 111.858 -172.501 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -54.06 -33.01 56.34 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.297 -0.877 . . . . 2.71 112.875 169.579 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 18.0 mt -77.21 -36.26 54.93 Favored 'General case' 0 N--CA 1.463 0.221 0 O-C-N 121.733 -0.604 . . . . 1.04 111.339 -177.721 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 40.8 mm -55.51 -55.84 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 124.079 0.952 . . . . 1.18 109.486 177.864 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -62.3 -34.99 77.66 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.183 0.808 . . . . 2.06 113.183 -178.19 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -38.61 91.5 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.045 1.338 . . . . 2.7 113.044 172.975 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.43 -35.89 18.02 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.431 1.093 . . . . 2.34 110.674 -175.345 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -55.95 -40.75 73.65 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.85 1.26 . . . . 3.23 114.33 -175.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -59.61 -11.57 5.1 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 114.833 1.419 . . . . 2.27 114.833 173.212 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -130.04 3.99 4.85 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 114.734 1.383 . . . . 3.03 114.734 -168.91 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -152.14 102.52 2.8 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.216 -1.552 . . . . 3.31 111.707 -167.882 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -78.8 69.59 5.0 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.707 2.003 . . . . 3.81 112.952 -167.163 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 78.45 -11.43 24.97 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 125.946 1.736 . . . . 4.07 114.588 175.066 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.51 162.84 3.51 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.231 1.812 . . . . 6.03 111.297 176.631 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 17.8 mm -133.49 129.5 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.773 1.629 . . . . 3.36 106.671 164.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.7 m -127.92 157.38 40.71 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.09 1.356 . . . . 3.36 112.856 -170.033 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -68.35 -46.49 70.01 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 121.266 -0.897 . . . . 2.49 113.176 -171.562 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -73.65 -35.18 65.23 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.59 2.356 . . . . 3.8 111.739 178.087 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -55.55 -58.55 7.32 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.361 1.064 . . . . 3.06 110.272 167.258 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -49.6 -51.03 40.26 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.569 -0.707 . . . . 2.22 111.565 177.112 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 40.0 t-105 -66.88 -46.42 75.0 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.621 -0.674 . . . . 0.94 112.775 -177.767 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -69.04 -35.23 76.36 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.177 0.991 . . . . 1.84 111.27 -176.267 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.459 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 87.1 mt -64.05 -37.87 89.0 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 118.152 -0.928 . . . . 0.8 112.194 173.594 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 41.6 mm -57.08 -35.75 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 121.425 1.921 . . . . 0.73 111.953 174.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -72.17 1.12 35.4 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 124.974 1.273 . . . . 1.13 114.48 174.46 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -96.81 -30.27 7.65 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.289 1.424 . . . . 0.72 114.654 173.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . 0.459 ' H ' HD12 ' B' ' 189' ' ' ILE . 0.6 OUTLIER -87.51 -44.23 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 CA-C-N 118.925 1.363 . . . . 0.93 109.777 170.289 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.72 145.0 45.5 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.977 1.311 . . . . 2.11 108.861 175.497 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . 122.55 -72.61 0.39 Allowed Glycine 0 CA--C 1.531 1.039 0 CA-C-O 117.791 -1.561 . . . . 1.21 112.074 -176.395 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -62.19 -45.02 16.85 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.621 2.214 . . . . 1.01 111.524 179.935 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.5 pp -82.8 -5.83 9.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 N-CA-C 113.397 0.888 . . . . 1.27 113.397 174.257 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -62.16 -35.63 79.36 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.697 1.135 . . . . 1.16 112.99 -175.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -65.19 -36.46 84.26 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 113.46 0.911 . . . . 4.11 113.46 175.763 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.2 tt -61.8 -39.07 90.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.914 -1.041 . . . . 2.25 110.408 177.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 32.6 mt -49.21 -65.54 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-O 121.632 0.729 . . . . 1.58 111.231 171.56 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 64.9 t60 -63.13 -33.31 75.18 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.827 -0.545 . . . . 2.64 111.467 -174.541 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.297 2.9 pt-20 -85.88 -10.04 55.98 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 112.523 0.564 . . . . 3.35 112.523 -176.355 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.67 -36.37 51.41 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 126.197 1.799 . . . . 3.19 113.278 164.408 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.09 7.6 1.19 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 126.673 1.989 . . . . 2.59 112.064 174.215 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -128.92 -66.94 0.8 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 127.005 2.122 . . . . 3.18 109.319 176.209 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 53.04 2.83 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 130.572 3.549 . . . . 5.46 115.379 177.862 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 45.0 t -154.76 30.57 0.41 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.821 1.648 . . . . 5.98 110.873 -168.034 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 28.0 t -155.65 79.72 1.01 Allowed 'General case' 0 N--CA 1.47 0.531 0 O-C-N 120.862 -1.149 . . . . 7.38 110.426 -176.341 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 18.9 t . . . . . 0 C--O 1.251 1.163 0 CA-C-O 114.469 -2.681 . . . . 10.0 111.831 176.52 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.9 m . . . . . 0 CA--C 1.502 -0.881 0 N-CA-C 108.848 -0.797 . . . . 10.59 108.848 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -131.01 -11.96 3.7 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 118.714 -1.194 . . . . 7.52 113.577 -132.021 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.7 t 76.86 -8.17 1.73 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.265 2.226 . . . . 5.25 115.613 162.35 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -26.61 95.8 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 128.083 2.553 . . . . 2.73 112.902 -175.998 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 56.3 p -76.11 167.43 21.87 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.767 0.827 . . . . 1.29 111.759 -165.588 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -55.5 -49.82 71.56 Favored 'General case' 0 C--O 1.217 -0.651 0 CA-C-O 117.833 -1.08 . . . . 3.0 109.877 168.536 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.01 -48.74 61.37 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.44 1.018 . . . . 1.01 110.538 178.494 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -68.39 -58.74 3.89 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 118.455 -0.784 . . . . 3.42 111.252 -178.362 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -52.74 -27.49 17.93 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 120.194 1.361 . . . . 6.06 112.751 173.333 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.846 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -75.29 -41.76 56.32 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 120.586 -1.321 . . . . 0.6 112.702 172.949 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 53.4 t -56.08 -47.05 80.99 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 CA-C-N 120.503 1.502 . . . . 0.59 109.877 165.844 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.1 mt -53.08 -47.48 54.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 124.438 1.095 . . . . 0.87 111.007 171.564 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.6 t -68.72 -33.73 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 120.099 1.318 . . . . 0.7 113.055 178.329 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -68.84 -35.64 77.19 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 120.266 -1.521 . . . . 0.95 110.836 171.707 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 t -69.3 -39.44 79.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 125.517 1.527 . . . . 0.61 110.999 174.138 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -62.2 -51.25 68.54 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.956 0.902 . . . . 3.17 110.552 169.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.519 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 2.8 t30 -61.1 -18.37 57.59 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 114.104 1.15 . . . . 2.2 114.104 -179.5 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -80.82 -68.47 0.68 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.402 0.681 . . . . 1.96 111.974 162.949 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -64.23 -25.96 68.3 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.873 1.064 . . . . 1.77 113.873 -163.659 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.519 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 7.4 ptmt -51.54 -26.34 8.39 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 120.054 1.297 . . . . 2.2 113.056 172.282 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -98.53 5.19 48.11 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.373 1.469 . . . . 2.11 114.907 -175.763 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 18.0 m -137.7 153.55 28.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.374 1.069 . . . . 2.25 110.217 172.131 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.5 m -80.12 56.2 2.36 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 116.145 1.906 . . . . 4.12 116.145 -170.742 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.3 tttp 78.61 -45.64 0.4 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 126.627 1.971 . . . . 5.14 115.787 150.108 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -116.8 150.28 38.59 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.981 1.713 . . . . 6.46 111.336 -173.114 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.7 m -55.0 -18.1 4.66 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.954 1.835 . . . . 8.28 115.954 -173.908 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.8 mt -64.52 -31.13 72.21 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.423 -0.798 . . . . 8.54 112.203 171.62 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.5 t 53.22 80.82 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 127.104 2.162 . . . . 5.39 111.828 -176.617 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -58.27 -29.9 66.18 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.283 1.033 . . . . 9.06 113.507 176.483 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -168.08 150.6 5.53 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 128.043 2.537 . . . . 6.59 109.026 -178.875 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.47 154.43 35.5 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 126.562 1.945 . . . . 6.56 110.235 -177.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 18.5 pt -62.24 155.14 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 N-CA-C 113.702 1.001 . . . . 3.49 113.702 -179.437 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.4 m -76.28 139.82 41.27 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.198 -0.939 . . . . 2.58 110.109 162.909 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -50.71 -28.63 9.44 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.318 1.447 . . . . 2.93 114.405 -178.033 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.1 p -60.17 -21.93 62.28 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.952 1.464 . . . . 1.98 114.952 172.937 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 62.1 m -71.85 -49.62 36.7 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 118.539 -0.743 . . . . 1.66 112.377 176.082 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -49.52 -52.48 29.34 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.611 1.165 . . . . 2.14 112.107 -178.027 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -57.54 -12.43 2.72 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.007 1.114 . . . . 2.45 114.007 178.708 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -116.9 -23.38 8.08 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 114.841 1.423 . . . . 4.89 114.841 174.284 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.1 tmm? -53.37 -39.23 64.04 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 120.197 1.362 . . . . 1.44 110.47 158.723 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 mt -59.72 -22.89 62.66 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 114.317 1.229 . . . . 1.33 114.317 169.426 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -98.26 -16.27 19.48 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.88 1.272 . . . . 3.35 113.056 -179.231 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -97.66 -70.76 0.71 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.817 0.847 . . . . 1.96 110.721 169.324 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -62.19 -34.38 76.33 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 119.815 1.189 . . . . 3.65 113.347 -177.109 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.8 19.38 20.56 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 114.33 1.233 . . . . 1.81 114.33 -178.939 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -51.46 -34.26 34.58 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 115.057 1.503 . . . . 1.45 115.057 -171.823 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.533 ' CD2' ' H ' ' A' ' 48' ' ' HIS . 9.0 m-70 -57.68 -27.64 63.08 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.834 2.054 . . . . 1.66 113.988 -175.879 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 28.2 tpp -107.93 1.35 22.57 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.578 1.551 . . . . 2.16 113.433 -169.21 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.1 mp -70.38 168.23 16.49 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.96 1.304 . . . . 2.88 112.004 175.11 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -164.34 102.28 0.84 Allowed 'General case' 0 N--CA 1.474 0.728 0 O-C-N 120.02 -1.675 . . . . 3.9 108.96 -168.535 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 17.6 t70 53.84 -166.83 0.08 Allowed 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 122.285 1.04 . . . . 4.5 110.648 -160.587 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.6 p -71.91 -27.65 62.97 Favored 'General case' 0 CA--C 1.518 -0.269 0 O-C-N 120.381 -1.449 . . . . 2.89 112.653 154.226 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.02 -42.12 53.85 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 124.617 1.104 . . . . 1.86 112.817 -175.289 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -55.25 -55.69 28.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.464 1.106 . . . . 3.22 111.62 169.167 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -55.65 -47.72 76.2 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.522 1.055 . . . . 5.0 112.391 178.34 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -63.39 -19.12 64.39 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 120.758 -1.214 . . . . 3.33 113.66 -175.114 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.14 -38.87 74.14 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.17 0.896 . . . . 1.77 112.023 166.522 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.93 -43.15 99.58 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.594 0.758 . . . . 0.94 112.093 179.761 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.73 -30.72 70.15 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.742 1.217 . . . . 2.79 113.792 175.317 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.2 mtmt -61.96 -34.82 76.82 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.851 -1.156 . . . . 3.9 111.762 170.714 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.0 mt -70.93 -40.04 72.32 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.466 0.706 . . . . 0.9 111.954 175.368 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.8 mm -52.16 -53.28 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.55 0.74 . . . . 0.94 110.612 177.933 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -71.35 -38.32 71.63 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 124.65 1.219 . . . . 2.21 112.679 -176.753 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.4 t30 -54.83 -35.88 64.42 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.533 0.682 . . . . 2.6 111.629 168.402 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.4 tp -86.23 -19.82 29.42 Favored 'General case' 0 C--O 1.224 -0.277 0 O-C-N 120.826 -1.171 . . . . 2.4 113.319 -178.287 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -62.18 -22.7 66.11 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.281 0.845 . . . . 3.04 113.281 173.508 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.18 -6.24 41.39 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 114.506 1.299 . . . . 2.67 114.506 168.285 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -139.99 14.63 2.46 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 125.152 1.381 . . . . 2.65 114.416 -168.313 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -128.35 88.56 2.77 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.471 -1.393 . . . . 6.12 113.13 -163.226 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -67.84 32.35 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 128.049 2.54 . . . . 5.84 114.623 178.643 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 73.49 -8.44 9.99 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 126.085 1.802 . . . . 2.5 115.6 175.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.0 mmt-85 -78.84 -170.59 2.22 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.898 1.349 . . . . 6.59 111.085 168.359 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 4.8 mm -137.7 135.75 45.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 104.872 -2.269 . . . . 2.46 104.872 164.597 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.2 m -96.94 167.12 11.27 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.927 0.891 . . . . 1.92 110.403 165.62 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -66.08 -58.75 4.78 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 120.655 -1.278 . . . . 2.08 111.74 -178.883 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -69.3 -14.62 63.04 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.682 1.593 . . . . 2.64 112.848 -173.586 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -53.69 -54.12 42.33 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.59 1.556 . . . . 3.22 111.028 171.147 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -65.09 -42.37 94.1 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.086 -1.634 . . . . 3.07 112.819 175.316 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 36.6 t-105 -60.79 -43.67 97.8 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.756 -0.59 . . . . 0.61 111.305 -179.021 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 3.5 t -73.57 -26.98 61.08 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 117.306 -1.331 . . . . 1.74 111.939 176.91 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 22.2 mt -65.69 -43.0 90.57 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 120.39 1.45 . . . . 0.7 112.582 169.568 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 38.0 mm -52.48 -36.47 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-N 120.801 1.637 . . . . 0.65 112.018 176.066 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.24 -29.51 68.85 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-O 119.07 -0.85 . . . . 0.69 113.573 175.185 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.09 -26.84 65.49 Favored Glycine 0 CA--C 1.534 1.25 0 CA-C-N 119.182 1.491 . . . . 0.57 114.427 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.0 mp -92.85 -35.6 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 CA-C-N 119.351 1.576 . . . . 0.83 111.162 169.737 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.4 m -72.08 -37.46 69.59 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 125.194 1.398 . . . . 2.77 112.652 -177.598 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -53.84 -47.09 66.56 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 125.412 1.482 . . . . 1.11 114.877 -177.543 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.74 -42.5 6.62 Favored 'Trans proline' 0 C--N 1.352 0.757 0 CA-C-N 120.976 2.388 . . . . 1.33 112.898 174.307 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.5 pt -84.58 -31.3 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 115.193 1.553 . . . . 1.17 115.193 -171.28 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.08 -35.25 71.12 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 120.13 1.332 . . . . 1.24 113.579 -168.43 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -62.59 -23.38 67.0 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 113.403 0.89 . . . . 6.21 113.403 175.578 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.61 -30.75 24.7 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.919 1.288 . . . . 2.04 111.073 174.033 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.5 mt -51.68 -55.53 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.328 0.967 . . . . 1.11 111.004 174.27 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -52.69 -41.43 63.88 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.664 1.12 . . . . 3.91 113.495 178.1 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.418 ' CD ' ' HZ2' ' B' ' 128' ' ' LYS . 14.1 mm-40 -72.64 -8.36 54.91 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.014 0.925 . . . . 4.74 112.488 -179.13 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -97.71 -35.01 10.7 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.594 1.958 . . . . 2.97 112.941 165.195 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -62.37 -5.33 2.37 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 120.358 1.435 . . . . 2.42 112.586 163.97 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -110.3 -63.17 1.42 Allowed 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.894 1.678 . . . . 2.4 111.039 171.927 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 54.35 7.46 0.14 Allowed 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 128.827 2.851 . . . . 5.39 115.791 177.95 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.7 m -158.14 44.8 0.32 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 127.147 2.179 . . . . 6.89 108.785 177.81 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.5 t -82.29 5.59 19.61 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.069 -1.019 . . . . 9.1 113.301 171.0 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 42.4 t . . . . . 0 C--O 1.25 1.117 1 C-N-CA 132.286 4.234 . . . . 10.81 108.368 -169.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 CA--C 1.503 -0.828 0 N-CA-C 109.518 -0.549 . . . . 10.48 109.518 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -135.27 -25.18 1.36 Allowed 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.713 1.258 . . . . 6.54 111.619 -135.018 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 11.3 t 70.04 -0.36 2.79 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.975 2.11 . . . . 4.76 116.111 162.406 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -31.52 112.49 0.1 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 127.664 2.385 . . . . 2.34 113.514 -176.385 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 71.7 p -83.64 155.0 23.41 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.194 0.998 . . . . 1.27 111.191 -177.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -53.69 -33.17 54.57 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.712 1.005 . . . . 2.46 113.712 178.894 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.82 -47.41 69.13 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.005 0.522 . . . . 1.68 111.083 177.427 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -72.02 -52.7 15.71 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.53 -0.544 . . . . 3.01 109.53 -177.211 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.6 tmtt? -54.0 -29.62 44.05 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.193 0.997 . . . . 5.11 111.899 174.465 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.846 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -70.01 -32.79 71.14 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 119.697 -1.877 . . . . 0.58 113.687 171.489 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 48.8 t -55.01 -43.5 69.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 120.613 1.551 . . . . 1.05 109.673 174.195 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 48.2 mt -51.24 -55.49 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.197 0.599 . . . . 1.18 110.32 171.924 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.53 -40.13 88.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 123.908 0.883 . . . . 0.61 113.084 -177.11 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.3 -31.12 70.34 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.077 -1.014 . . . . 1.36 111.541 176.752 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 41.5 t -73.56 -42.68 55.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.928 1.691 . . . . 0.78 111.241 172.544 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . 0.444 ' CD ' ' HZ2' ' B' ' 124' ' ' LYS . 14.5 tm-20 -57.07 -50.48 72.64 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.606 1.162 . . . . 3.55 111.66 173.939 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . 0.506 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 3.0 t30 -65.9 -10.77 41.61 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 114.162 1.171 . . . . 2.51 114.162 -173.838 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -87.82 -63.91 1.23 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.386 1.474 . . . . 1.97 112.146 164.418 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -61.23 -29.94 70.14 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.693 0.997 . . . . 1.73 113.693 -165.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . 0.506 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 8.4 ptmt -50.67 -26.9 6.0 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 119.43 1.013 . . . . 1.95 113.508 173.697 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -93.35 5.57 51.11 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.23 1.812 . . . . 2.06 114.726 -179.517 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 13.2 m -138.76 150.89 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.97 1.259 . . . . 2.17 110.971 173.977 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 16.2 m -78.66 42.81 0.46 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 115.488 1.662 . . . . 4.05 115.488 -177.31 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.418 ' HZ2' ' CD ' ' A' ' 96' ' ' GLU . 5.3 ttpt 83.84 -52.01 0.14 Allowed 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.561 1.319 . . . . 4.98 114.561 142.883 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -95.63 145.23 25.41 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.521 1.528 . . . . 6.39 110.916 177.615 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 5.8 m -55.55 -16.71 4.24 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 116.063 1.875 . . . . 8.04 116.063 -177.948 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 91.5 mt -63.53 -33.98 76.78 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 118.947 0.794 . . . . 8.66 111.792 169.494 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 22.3 t 57.58 86.79 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 127.264 2.225 . . . . 5.55 111.933 -178.195 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -60.81 -28.99 69.2 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.837 0.855 . . . . 9.21 113.135 171.88 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -171.46 151.89 3.13 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.154 2.581 . . . . 6.71 109.657 -178.482 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.21 152.44 29.35 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.412 2.285 . . . . 6.51 110.692 -178.632 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 14.4 pt -63.05 152.67 7.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 N-CA-C 114.14 1.163 . . . . 3.66 114.14 -178.369 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 73.5 m -74.63 139.7 43.79 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.378 -0.826 . . . . 2.6 110.934 163.831 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -51.79 -24.78 6.44 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.59 1.556 . . . . 2.92 114.736 -174.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 62.1 p -58.19 -23.65 56.32 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.735 1.383 . . . . 2.09 114.735 171.649 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 61.1 m -74.35 -46.15 42.54 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.256 0.935 . . . . 1.69 113.002 -179.407 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -53.23 -52.47 58.83 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 119.784 1.175 . . . . 2.07 112.263 179.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 -57.37 -10.65 1.45 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.714 1.005 . . . . 2.52 113.714 177.535 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -117.83 -27.6 6.17 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 120.182 1.355 . . . . 4.31 114.387 177.584 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.7 tmm? -53.01 -35.83 59.83 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 119.704 1.138 . . . . 1.39 111.375 161.732 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.29 -26.59 68.49 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.053 1.131 . . . . 1.46 114.053 170.307 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -92.14 -24.17 19.18 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 121.208 -0.932 . . . . 3.0 112.951 179.494 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.72 -67.37 0.83 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.17 0.895 . . . . 1.49 111.573 172.261 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -69.06 -29.17 67.24 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.378 1.251 . . . . 3.53 114.378 -175.551 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.59 19.36 19.32 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 125.064 1.346 . . . . 1.71 113.762 -179.693 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -45.07 -38.31 4.89 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 117.647 2.462 . . . . 1.65 117.647 -165.467 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . 0.487 ' CD2' ' H ' ' B' ' 151' ' ' HIS . 0.0 OUTLIER -61.92 -28.57 69.62 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.118 2.167 . . . . 2.29 113.342 -178.407 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 40.6 tpp -77.94 -4.75 48.46 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.119 1.768 . . . . 1.91 113.776 -174.11 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.79 177.21 7.07 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.136 1.375 . . . . 3.06 112.95 -175.385 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 6.4 m -176.76 110.47 0.08 Allowed 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.567 2.347 . . . . 3.79 107.956 -176.668 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . 0.474 ' CB ' ' H ' ' B' ' 157' ' ' GLY . 21.1 t0 48.39 -175.57 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.299 0 CA-C-O 123.844 1.783 . . . . 4.96 109.992 -147.597 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 65.4 p -56.9 -14.88 3.9 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 120.097 -1.627 . . . . 3.74 112.836 142.144 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . 0.474 ' H ' ' CB ' ' B' ' 155' ' ' ASP . . . -51.92 -38.43 46.35 Favored Glycine 0 N--CA 1.476 1.324 0 C-N-CA 126.906 2.193 . . . . 2.09 113.547 -177.179 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -62.8 -58.85 5.98 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.89 1.276 . . . . 3.23 111.547 169.283 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -50.85 -43.79 59.37 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.698 1.599 . . . . 5.04 114.561 174.597 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . 0.454 ' HE2' ' HA2' ' B' ' 157' ' ' GLY . 34.1 mtmt -60.22 -19.01 52.56 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.681 1.992 . . . . 4.62 115.281 178.745 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -66.33 -41.42 89.64 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.392 1.077 . . . . 1.71 112.041 167.777 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -61.25 -40.56 94.5 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.106 0.962 . . . . 0.9 111.159 176.503 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -56.88 -39.71 74.87 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.73 1.212 . . . . 2.21 113.054 173.775 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -59.53 -34.25 72.4 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.332 -0.855 . . . . 3.94 111.962 174.995 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 8.8 mt -69.8 -42.99 73.01 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 118.656 -0.688 . . . . 0.85 112.03 174.07 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 35.3 mm -50.04 -53.86 9.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.889 0.768 . . . . 0.87 110.391 177.47 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -71.1 -38.22 72.38 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.059 1.344 . . . . 2.23 112.961 -176.313 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -54.02 -33.86 58.37 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.559 0.695 . . . . 2.61 111.862 167.462 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 9.2 tp -93.59 -14.21 26.78 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 120.63 -1.294 . . . . 2.26 113.964 -179.439 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -65.02 -16.59 63.62 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.573 0.749 . . . . 3.1 112.978 171.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.23 -6.92 58.66 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.464 1.283 . . . . 2.48 114.464 165.086 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -142.97 27.56 1.62 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 125.182 1.393 . . . . 2.67 114.294 -164.93 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -143.56 93.81 2.52 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 120.049 -1.657 . . . . 5.88 111.621 -170.406 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -68.68 31.23 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 128.258 2.623 . . . . 5.76 114.009 179.041 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.63 -11.93 6.59 Favored Glycine 0 CA--C 1.534 1.223 0 O-C-N 119.802 -1.811 . . . . 2.49 114.999 178.905 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 35.2 mmt-85 -83.75 144.81 29.09 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.539 1.67 . . . . 6.78 109.745 163.247 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 7.4 mm -93.79 135.29 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 106.97 -1.493 . . . . 2.77 106.97 163.653 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 18.5 m -98.18 159.07 15.17 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.256 1.422 . . . . 2.05 110.941 166.685 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -62.97 -54.38 39.28 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.33 -1.482 . . . . 1.83 112.311 -174.651 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -68.63 -14.02 62.74 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.64 1.976 . . . . 2.97 113.301 -176.215 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -56.69 -54.06 50.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.159 1.784 . . . . 3.22 111.168 174.137 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -57.19 -44.7 83.85 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 120.624 -1.297 . . . . 2.25 112.311 173.068 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -62.66 -43.25 99.28 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 121.985 -0.447 . . . . 0.6 111.845 -178.028 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.9 t -75.3 -26.07 58.42 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 117.409 -1.281 . . . . 1.65 112.496 175.927 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 54.0 mt -68.8 -41.12 79.14 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.677 1.58 . . . . 0.54 112.395 171.948 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 21.9 mm -51.58 -36.72 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 CA-C-N 120.509 1.504 . . . . 0.62 112.417 177.612 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -57.28 -32.3 63.56 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 118.505 0.593 . . . . 0.65 113.688 173.77 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -73.13 -19.24 79.56 Favored Glycine 0 CA--C 1.533 1.219 0 CA-C-N 118.793 1.296 . . . . 0.63 114.903 -179.785 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -98.21 -35.62 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 CA-C-N 119.019 1.409 . . . . 0.79 111.147 167.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 68.6 m -75.1 -41.88 57.74 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.913 1.685 . . . . 2.78 113.177 -173.724 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -54.48 -42.58 76.01 Favored Glycine 0 CA--C 1.537 1.461 0 CA-C-O 118.086 -1.397 . . . . 1.12 115.74 -174.672 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.09 -44.29 7.53 Favored 'Trans proline' 0 C--N 1.354 0.832 0 CA-C-N 121.0 2.4 . . . . 1.14 112.444 174.374 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 35.0 pt -90.38 -24.7 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 115.607 1.706 . . . . 1.13 115.607 -168.271 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -56.35 -36.16 68.46 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.767 1.227 . . . . 1.03 113.834 -171.072 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 4.0 ptpp? -57.62 -31.67 66.47 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.735 1.214 . . . . 5.63 113.107 173.175 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.66 -30.11 25.12 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.454 1.502 . . . . 2.09 110.947 179.115 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 65.0 mt -52.36 -52.81 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 124.183 0.993 . . . . 0.92 110.508 172.207 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -46.79 -50.26 18.57 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 118.761 0.709 . . . . 3.58 112.786 173.132 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -68.32 -12.99 61.94 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.813 1.245 . . . . 4.55 113.657 -177.018 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -98.57 -30.34 12.55 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.461 1.504 . . . . 2.41 113.58 170.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -68.18 -17.44 64.33 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 120.552 1.524 . . . . 2.32 111.555 165.901 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -93.87 -54.87 3.44 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.18 -0.95 . . . . 2.0 111.787 174.084 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 55.82 6.22 0.2 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 129.115 2.966 . . . . 6.11 116.043 176.583 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 74.5 m -162.49 44.04 0.13 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 127.122 2.169 . . . . 6.1 109.608 -178.561 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 20.1 t -86.78 5.44 36.44 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.162 1.171 . . . . 8.29 114.162 176.459 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.25 1.128 0 C-N-CA 130.824 3.649 . . . . 10.05 109.938 -171.259 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.9 t . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 104.928 -2.249 . . . . 9.08 104.928 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.409 ' CG ' ' H ' ' A' ' 4' ' ' CYS . 37.8 t70 -63.41 -132.18 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.415 0 N-CA-C 109.217 -0.66 . . . . 6.99 109.217 117.324 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.409 ' H ' ' CG ' ' A' ' 3' ' ' ASP . 35.3 t -80.81 -93.84 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 O-C-N 119.736 -1.852 . . . . 3.83 110.288 170.25 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 95.87 124.1 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.766 1 C-N-CA 131.79 4.036 . . . . 2.15 108.586 -163.404 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 31.5 p -76.23 154.68 35.06 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.566 0.747 . . . . 0.98 110.15 174.194 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -62.33 -31.76 72.42 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-O 118.818 -0.61 . . . . 2.46 111.897 178.14 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.68 -42.52 88.69 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 120.065 1.302 . . . . 0.79 110.224 176.508 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -62.91 1.25 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.822 1.249 . . . . 2.84 110.443 179.295 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -52.39 -33.87 45.44 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 114.404 1.261 . . . . 5.9 114.404 172.971 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.88 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -67.24 -49.01 66.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 119.938 1.245 . . . . 0.49 111.808 173.008 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 52.8 t -57.22 -35.08 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 120.017 1.28 . . . . 0.83 110.439 173.641 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.6 mt -59.65 -47.64 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 O-C-N 121.483 -0.761 . . . . 1.08 112.305 168.209 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.3 t -64.61 -34.65 71.17 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 CA-C-N 120.279 1.399 . . . . 0.78 113.414 175.006 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -63.23 -41.81 99.15 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 120.636 -1.29 . . . . 0.93 111.04 171.643 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.2 t -62.56 -40.19 87.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 123.774 0.83 . . . . 0.58 110.881 173.689 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -66.04 -36.64 83.8 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.644 1.111 . . . . 3.13 113.129 173.609 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.428 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 36.1 t30 -62.11 -23.07 66.32 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 119.756 1.162 . . . . 2.01 113.556 -177.883 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -81.91 -50.19 9.46 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.037 1.335 . . . . 1.95 112.797 171.213 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.5 m-85 -75.74 -16.44 60.14 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.667 1.358 . . . . 2.27 114.667 -174.019 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 18' ' ' ASN . 5.4 ptmt -66.87 -25.66 66.51 Favored 'General case' 0 CA--C 1.553 1.059 0 O-C-N 120.218 -1.552 . . . . 2.69 112.116 161.075 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -97.89 -36.25 10.23 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 115.277 1.584 . . . . 3.1 115.277 -178.018 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.1 p -130.29 159.57 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 CA-C-N 120.509 1.504 . . . . 3.93 112.238 172.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.9 t 87.78 -163.43 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 127.872 2.469 . . . . 6.05 112.713 174.145 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt 51.84 -71.09 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 130.462 3.505 . . . . 6.6 114.621 168.758 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -61.68 -17.56 56.02 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.614 2.366 . . . . 11.58 112.729 169.887 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.6 m -159.66 151.26 20.12 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.181 1.793 . . . . 7.42 111.409 171.821 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 93.8 mt -72.59 -69.33 0.41 Allowed 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.35 -0.611 . . . . 8.15 109.35 159.035 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.7 t -143.34 93.13 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.697 1.199 . . . . 5.39 109.405 -177.836 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -139.47 39.82 2.05 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 127.255 2.222 . . . . 9.5 112.077 169.773 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 55.49 36.31 26.88 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.209 1.404 . . . . 8.89 113.711 -179.295 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.66 -24.0 65.24 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 120.887 -1.133 . . . . 9.78 112.034 -175.339 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 10.0 tt -127.7 164.08 29.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 126.503 1.921 . . . . 3.44 109.296 167.415 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.2 m -143.04 168.6 19.34 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.507 -1.371 . . . . 2.62 109.245 159.08 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -59.26 -34.95 72.86 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.274 -1.516 . . . . 2.56 112.048 -173.237 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.5 p -57.21 -21.28 32.42 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.358 1.863 . . . . 1.84 114.57 171.823 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 m -74.65 -39.8 61.84 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.19 -0.944 . . . . 1.71 112.395 171.275 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.421 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 71.7 t80 -58.27 -49.72 76.12 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.742 1.155 . . . . 2.12 113.066 -175.36 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -53.18 -23.02 7.43 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.001 0.92 . . . . 2.84 112.874 172.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -99.68 -45.82 5.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.931 1.693 . . . . 3.54 113.244 -170.271 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 16.7 ptm -52.53 -37.16 56.99 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.979 0.809 . . . . 3.4 110.444 161.154 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.8 mt -58.72 -64.17 1.03 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.954 0.902 . . . . 1.43 111.865 167.306 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -70.0 -12.17 61.42 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.585 1.538 . . . . 3.05 115.12 -173.458 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.1 -49.21 6.32 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.506 1.048 . . . . 1.75 112.419 170.616 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -80.97 -36.48 30.78 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 120.06 1.3 . . . . 2.72 112.529 -175.091 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.8 mt -103.81 27.32 7.65 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.957 1.303 . . . . 2.11 112.666 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -58.5 -16.77 16.76 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 115.766 1.765 . . . . 1.54 115.766 -169.407 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.12 -36.15 15.0 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 119.517 1.053 . . . . 1.79 113.089 174.858 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.8 ttm -71.31 -22.27 61.95 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.909 1.284 . . . . 3.04 112.292 176.316 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.9 mp -61.9 90.35 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 123.528 1.632 . . . . 2.49 111.046 171.114 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.6 m -74.39 75.77 1.9 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 113.535 -1.666 . . . . 4.55 109.701 173.818 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.9 t70 71.77 169.89 0.32 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 128.312 2.645 . . . . 4.04 112.999 -176.064 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m -30.77 -45.86 0.07 Allowed 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 127.376 2.27 . . . . 2.34 111.989 150.062 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.56 -50.17 54.43 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.433 1.492 . . . . 1.69 113.654 177.223 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -62.65 -41.67 99.18 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.794 1.297 . . . . 3.5 112.001 172.208 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 44.2 ttt-85 -57.01 -40.49 76.74 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.735 0.698 . . . . 5.26 112.521 173.729 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.29 -19.06 64.25 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 120.443 1.474 . . . . 3.59 113.609 176.164 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.494 ' HA ' ' HG2' ' A' ' 61' ' ' LYS . . . -79.09 -17.61 54.84 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 114.127 1.158 . . . . 1.05 114.127 170.999 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.29 -53.11 9.31 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.481 1.112 . . . . 0.78 110.525 160.559 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -57.01 -35.77 69.63 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.086 0.954 . . . . 2.3 112.923 -176.451 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.494 ' HG2' ' HA ' ' A' ' 58' ' ' ALA . 2.9 ptmm? -57.59 -23.83 52.98 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 120.377 -1.452 . . . . 3.94 114.763 171.654 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.2 mt -82.84 -37.05 24.92 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.465 -0.772 . . . . 1.56 112.308 174.676 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.2 mm -52.53 -51.56 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.766 1.226 . . . . 0.98 110.823 -178.326 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -55.14 -48.93 73.0 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 122.176 0.988 . . . . 3.06 112.359 177.426 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 -66.01 -21.19 66.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.744 1.218 . . . . 3.11 113.316 -178.691 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.47 -34.9 14.63 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.849 0.75 . . . . 2.13 112.533 178.428 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -61.88 -25.36 67.5 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.3 -0.875 . . . . 3.23 112.511 164.695 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.67 -14.01 62.3 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 114.484 1.29 . . . . 2.06 114.484 167.251 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -123.91 -19.47 5.68 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 116.119 1.896 . . . . 2.59 116.119 -173.411 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.93 127.02 22.49 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.08 1.763 . . . . 3.64 112.435 -171.488 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -85.91 -7.66 58.54 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.804 1.409 . . . . 4.66 114.804 -169.353 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 130.8 -13.65 5.55 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 124.762 1.172 . . . . 2.52 113.628 -163.116 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.5 mmt-85 -76.61 147.03 37.86 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.244 1.522 . . . . 4.91 109.467 153.273 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 37.4 mm -133.22 146.2 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 127.458 2.303 . . . . 2.31 107.317 -178.307 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 10.6 m -109.44 151.52 26.58 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 118.977 0.808 . . . . 1.7 110.289 173.809 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -55.72 -40.46 72.46 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-O 122.658 1.218 . . . . 2.06 111.137 172.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.8 -32.2 65.45 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 129.772 3.229 . . . . 3.05 112.782 178.688 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -54.76 9.76 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.395 1.478 . . . . 3.25 110.0 -170.4 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -52.77 -43.46 65.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.092 0.557 . . . . 1.93 112.028 174.169 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.7 t-105 -63.26 -48.14 79.44 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.709 -0.62 . . . . 0.87 111.375 177.532 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 88.5 m -58.37 -37.45 75.24 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.501 1.921 . . . . 2.28 111.694 176.453 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.421 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 75.2 mt -62.14 -50.5 71.64 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 118.25 -0.881 . . . . 1.02 111.955 174.114 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 29.0 mm -52.62 -41.84 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 CA-C-N 120.215 1.37 . . . . 0.95 113.441 -173.591 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.28 -19.46 59.66 Favored Glycine 0 N--CA 1.475 1.282 0 C-N-CA 123.637 0.637 . . . . 0.98 113.499 177.993 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.0 -11.63 85.4 Favored Glycine 0 CA--C 1.534 1.252 0 CA-C-O 117.85 -1.528 . . . . 1.14 114.993 173.979 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.5 mp -115.3 -45.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 119.796 1.798 . . . . 1.39 111.036 175.939 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 40.6 m -76.28 87.19 3.09 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 105.997 -1.853 . . . . 1.43 105.997 172.688 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -160.4 -77.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.916 0 CA-C-O 118.038 -1.423 . . . . 0.98 112.549 -167.762 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -61.57 -33.37 87.27 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 122.856 2.371 . . . . 1.14 112.311 175.263 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.3 pt -75.85 -16.9 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 114.047 1.128 . . . . 1.19 114.047 173.885 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.12 -65.05 0.63 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.997 1.271 . . . . 1.76 112.958 -169.47 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp -55.2 -40.75 71.13 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.349 -0.845 . . . . 3.34 113.185 178.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.69 -38.27 74.89 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.648 0.779 . . . . 1.39 111.216 179.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 51.2 mt -54.93 -62.43 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-N 118.973 0.806 . . . . 1.38 111.111 171.117 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -57.11 -27.98 62.26 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.299 0.852 . . . . 1.7 113.299 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -81.36 -25.89 35.98 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.048 -1.033 . . . . 2.9 112.261 177.605 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -74.96 -33.49 61.92 Favored 'General case' 0 C--O 1.227 -0.086 0 N-CA-C 113.776 1.028 . . . . 2.18 113.776 178.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -70.47 6.69 1.29 Allowed 'General case' 0 N--CA 1.48 1.049 0 CA-C-O 123.305 1.526 . . . . 2.34 112.031 172.151 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -115.52 -56.51 2.34 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 126.416 1.887 . . . . 2.32 110.306 170.599 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -62.06 -13.45 26.38 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.376 1.25 . . . . 5.01 114.376 178.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 32.4 t -121.26 25.12 9.69 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.115 1.366 . . . . 8.55 112.177 169.153 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.9 t -75.59 1.52 14.17 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.874 1.435 . . . . 11.05 114.874 -179.403 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 30.8 m . . . . . 0 C--O 1.254 1.312 0 C-N-CA 130.036 3.334 . . . . 13.12 109.913 178.491 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 107.372 -1.344 . . . . 9.7 107.372 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -31.46 176.83 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.579 0 N-CA-C 115.147 1.536 . . . . 6.28 115.147 111.824 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 44.4 t -51.86 -57.19 10.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.52 2.728 . . . . 4.23 113.128 174.865 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 65.37 -179.69 0.19 Allowed 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.561 1.945 . . . . 2.31 114.238 -175.201 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.4 p -85.27 159.79 19.99 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.575 -0.703 . . . . 1.07 109.311 160.42 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -59.61 -45.06 93.05 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 118.599 -0.715 . . . . 2.79 111.657 174.505 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.59 -43.04 75.63 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.581 1.082 . . . . 1.03 111.211 -174.46 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -56.75 7.6 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.993 0.517 . . . . 2.77 110.239 -177.381 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -50.2 -37.61 36.05 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.755 1.222 . . . . 5.24 112.268 172.103 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.88 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.35 -44.67 74.76 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 120.37 -1.456 . . . . 0.51 113.51 172.588 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 79.6 t -61.72 -34.53 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 CA-C-N 121.009 1.731 . . . . 0.77 111.017 172.399 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 44.4 mt -56.03 -52.48 49.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.681 1.128 . . . . 0.76 110.913 165.154 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 9.3 t -58.03 -41.37 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 119.407 1.003 . . . . 0.57 112.657 178.569 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.37 -39.36 94.31 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.02 0.928 . . . . 0.99 112.298 175.007 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 99.2 t -70.93 -44.86 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-O 118.455 -0.783 . . . . 0.57 110.895 177.873 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -61.24 -39.2 89.44 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.552 1.069 . . . . 4.2 112.042 178.625 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . 0.515 HD21 ' HG3' ' B' ' 148' ' ' GLU . 6.9 t30 -67.51 -14.85 63.3 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.523 1.305 . . . . 2.35 114.523 -177.469 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -102.11 -40.18 6.94 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.55 1.54 . . . . 2.42 113.155 174.881 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -68.69 -26.08 65.11 Favored 'General case' 0 CA--C 1.55 0.961 0 O-C-N 120.862 -1.149 . . . . 2.08 112.827 175.874 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 42.2 pttt -59.23 -34.78 72.61 Favored 'General case' 0 CA--C 1.551 0.994 0 O-C-N 119.444 -2.035 . . . . 2.44 112.248 164.298 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -81.86 -33.46 30.6 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 116.993 -1.479 . . . . 2.56 114.876 178.95 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 9.6 p -138.52 138.89 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 CA-C-N 120.573 1.533 . . . . 3.88 113.162 176.576 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 1.7 t 103.51 -168.03 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 129.904 3.282 . . . . 5.9 111.919 174.634 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt 54.83 -69.67 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 130.227 3.411 . . . . 6.07 114.756 165.492 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -59.79 -21.69 61.15 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.329 1.852 . . . . 11.17 112.353 173.197 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 40.9 m -166.16 135.11 3.09 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 127.529 2.331 . . . . 8.07 109.121 164.16 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -68.31 -64.5 0.85 Allowed 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 110.039 -0.356 . . . . 8.06 110.039 172.245 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 50.1 t -140.88 89.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 C-N-CA 124.407 1.083 . . . . 5.72 109.463 176.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -129.88 17.98 5.65 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.195 1.798 . . . . 9.84 111.547 157.548 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 68.43 61.53 0.37 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.437 1.895 . . . . 8.63 110.422 -167.36 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.29 -15.56 63.33 Favored 'General case' 0 CA--C 1.552 1.055 0 O-C-N 120.851 -1.156 . . . . 9.91 112.482 179.2 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 5.3 tt -143.92 171.77 7.3 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 128.417 2.687 . . . . 3.27 109.334 175.022 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 74.2 m -142.55 163.53 32.59 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.049 1.74 . . . . 2.67 108.722 155.992 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 38.4 mmtm -56.15 -32.6 64.44 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 120.523 -1.36 . . . . 2.87 112.699 -174.219 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 9.1 p -56.7 -23.0 39.14 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.032 1.733 . . . . 1.92 113.854 174.497 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 6.0 m -76.56 -26.61 55.29 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.882 -1.137 . . . . 1.41 113.159 173.518 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -65.17 -53.51 43.82 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.73 1.605 . . . . 1.92 111.656 -179.212 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 6.3 ptt180 -52.14 -25.26 8.51 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.581 1.152 . . . . 2.55 112.622 176.128 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.27 -45.08 7.31 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.269 1.827 . . . . 3.48 112.077 -173.115 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 4.3 tmm? -49.95 -44.08 50.41 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.13 0.972 . . . . 1.6 110.232 162.283 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.9 mt -55.01 -63.62 1.1 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.666 1.587 . . . . 1.49 111.967 166.945 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -68.56 -15.16 63.44 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 115.338 1.607 . . . . 2.96 115.338 -174.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.92 -48.12 7.43 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.462 1.028 . . . . 1.69 112.331 172.362 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.515 ' HG3' HD21 ' B' ' 121' ' ' ASN . 50.6 mm-40 -87.36 -33.88 19.0 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.68 1.127 . . . . 2.79 113.043 -172.861 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 16.5 mt -101.62 27.38 6.42 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.899 1.28 . . . . 2.2 112.317 176.22 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -60.76 -12.59 11.1 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 116.166 1.913 . . . . 1.44 116.166 -169.662 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -92.1 -59.77 2.02 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.606 1.162 . . . . 1.43 111.587 -175.281 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 27.7 ttp -61.44 -13.58 21.56 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 114.917 1.451 . . . . 1.79 114.917 169.315 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 10.9 tp -58.39 91.44 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.726 1.61 . . . . 2.43 110.185 176.306 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 63.7 m -82.92 70.22 9.88 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.489 1.116 . . . . 4.57 110.879 -167.571 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 25.9 t70 74.62 167.22 0.29 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 128.316 2.646 . . . . 4.15 112.695 -175.159 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 2.7 m -27.6 -47.34 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.4 0 C-N-CA 127.792 2.437 . . . . 2.61 112.697 151.549 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.06 -52.42 52.94 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-N 120.232 1.378 . . . . 1.9 113.756 -178.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.19 -38.8 80.74 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.913 0.885 . . . . 3.1 111.325 173.818 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.2 ttt-85 -62.06 -45.87 91.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.719 0.808 . . . . 4.6 113.099 172.444 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -21.72 66.05 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 120.024 -1.672 . . . . 3.76 113.182 -177.709 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -61.3 -28.79 69.45 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 117.325 -1.322 . . . . 1.36 113.476 167.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.27 73.18 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.199 1.0 . . . . 1.12 111.484 167.089 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -62.88 -32.78 74.1 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.656 0.783 . . . . 2.12 111.944 -175.057 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt -47.17 -42.25 19.34 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 122.402 1.096 . . . . 2.56 113.663 166.845 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . 0.441 HD11 ' HA3' ' B' ' 188' ' ' GLY . 5.5 mt -78.67 -42.2 29.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 113.973 -1.467 . . . . 1.14 110.551 -174.41 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 27.9 mm -46.48 -56.85 1.13 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.302 1.441 . . . . 1.3 111.67 175.08 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -58.76 -40.73 84.74 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.592 1.187 . . . . 3.08 112.47 -177.145 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -77.24 -18.46 57.62 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.131 1.372 . . . . 3.47 112.455 -175.776 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.57 -36.24 15.43 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.781 0.833 . . . . 2.42 112.329 173.288 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -58.88 -35.99 73.91 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.3 0.955 . . . . 3.77 111.946 166.761 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -60.1 -15.97 27.95 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 114.846 1.424 . . . . 2.27 114.846 169.906 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -120.5 -14.53 8.66 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 115.573 1.694 . . . . 2.69 115.573 -176.254 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -138.89 108.13 6.09 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 120.777 1.626 . . . . 3.85 112.407 -166.73 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -76.77 56.15 1.14 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 128.357 2.663 . . . . 4.29 112.484 -169.501 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 67.87 -14.14 0.61 Allowed Glycine 0 N--CA 1.479 1.563 0 O-C-N 119.854 -1.779 . . . . 2.49 114.145 -171.388 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.9 mmt-85 -73.1 141.89 47.54 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.83 1.652 . . . . 5.05 107.726 164.797 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 40.6 mm -126.32 141.81 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.078 1.351 . . . . 2.32 108.812 -168.879 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 70.8 m -99.74 155.13 17.79 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 117.891 0.314 . . . . 1.81 111.68 173.839 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -63.32 -50.47 69.9 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 120.943 -1.098 . . . . 2.41 110.509 172.585 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -70.19 -6.45 34.56 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.668 1.187 . . . . 4.46 113.203 -178.066 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -59.3 -57.78 11.53 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.196 0.998 . . . . 3.15 109.937 171.551 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -52.11 -48.79 64.61 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.545 0.738 . . . . 2.17 112.035 176.378 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 21.0 t-105 -59.0 -49.82 76.45 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 119.244 -0.407 . . . . 0.84 111.729 178.979 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 16.5 m -55.32 -43.61 75.06 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.75 1.62 . . . . 1.76 111.865 174.611 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 48.9 mt -69.36 -38.37 78.06 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 118.177 -0.915 . . . . 0.75 113.271 179.745 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 30.2 mm -56.79 -41.34 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 120.542 1.519 . . . . 0.63 111.662 178.26 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.74 -18.8 57.43 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-O 119.365 -0.686 . . . . 0.71 114.174 -179.258 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . 0.441 ' HA3' HD11 ' B' ' 165' ' ' LEU . . . -80.8 -11.7 83.6 Favored Glycine 0 CA--C 1.535 1.334 0 CA-C-N 118.866 1.333 . . . . 0.68 114.076 175.133 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.7 mp -108.54 -45.04 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.657 1.183 . . . . 0.87 110.325 171.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 23.6 m -80.57 77.51 7.37 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 125.17 1.388 . . . . 1.34 107.982 176.292 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -158.44 -74.39 0.02 OUTLIER Glycine 0 CA--C 1.53 1.03 0 C-N-CA 125.502 1.525 . . . . 0.82 112.019 -172.084 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -63.11 -34.81 68.03 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.004 2.469 . . . . 1.08 113.418 177.851 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.9 pt -83.67 -6.92 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 N-CA-C 114.035 1.124 . . . . 0.91 114.035 174.722 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -50.07 -55.26 15.58 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.093 1.357 . . . . 1.57 113.919 -172.758 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 11.0 mtpp -66.51 -39.63 88.77 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-O 116.987 -1.483 . . . . 5.37 112.86 174.336 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 8.5 tt -50.29 -41.81 51.39 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 120.783 1.629 . . . . 1.75 111.675 177.896 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 85.1 mt -52.15 -54.99 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.351 1.06 . . . . 1.1 112.432 169.028 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 57.8 t60 -73.33 -20.15 60.86 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.454 0.909 . . . . 2.23 113.454 -178.067 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.07 -44.29 69.41 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.923 0.889 . . . . 3.74 109.487 168.09 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -60.64 -44.07 96.81 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.755 1.222 . . . . 2.33 113.387 -176.277 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -70.69 1.46 5.3 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 122.529 1.157 . . . . 2.56 112.825 -179.235 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -116.21 -53.5 2.54 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 120.725 -1.234 . . . . 2.65 109.755 175.38 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -14.74 54.62 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 114.598 -1.183 . . . . 4.12 114.167 178.604 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 33.6 t -121.7 28.64 7.55 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.383 1.873 . . . . 8.42 112.853 168.759 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 32.8 t -72.67 2.29 6.8 Favored 'General case' 0 CA--C 1.554 1.106 0 N-CA-C 115.817 1.784 . . . . 11.45 115.817 -178.021 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 35.5 m . . . . . 0 C--O 1.253 1.278 0 C-N-CA 128.858 2.863 . . . . 13.77 111.063 179.277 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.7 m . . . . . 0 CA--C 1.506 -0.723 0 CA-C-O 119.6 -0.238 . . . . 11.28 110.515 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -95.86 -106.1 0.15 Allowed 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 106.868 -1.53 . . . . 7.97 106.868 140.443 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 74.2 m -89.65 -36.06 15.47 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.933 1.693 . . . . 3.42 112.081 169.621 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -56.12 133.71 52.29 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.592 0.757 . . . . 2.25 109.605 168.938 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 16.6 p -62.37 151.82 35.79 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.511 1.05 . . . . 0.97 109.521 174.73 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -58.87 -49.61 77.13 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.876 0.735 . . . . 2.49 109.169 177.717 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -43.92 -49.47 8.42 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.381 1.873 . . . . 1.06 111.499 176.331 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.43 -56.53 4.93 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.875 -0.516 . . . . 3.03 111.807 -171.089 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.41 ' HA ' ' HB ' ' A' ' 13' ' ' ILE . 28.8 mmtt -59.15 -22.16 60.49 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 120.856 -1.153 . . . . 6.92 113.455 170.163 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.907 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.06 -46.35 68.06 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 120.566 -1.334 . . . . 0.48 112.181 168.105 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 96.5 t -59.58 -39.85 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 121.081 1.764 . . . . 0.89 110.318 170.596 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.41 ' HB ' ' HA ' ' A' ' 10' ' ' LYS . 1.1 mt -55.47 -47.07 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 118.558 -0.734 . . . . 1.49 111.344 169.358 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.55 -37.64 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.137 1.375 . . . . 0.58 112.753 175.978 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.43 -37.29 86.73 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.8 1.182 . . . . 0.93 111.009 172.67 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 74.2 t -72.04 -40.9 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 123.833 0.853 . . . . 0.68 110.697 174.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 tm-20 -55.51 -60.1 3.89 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.72 1.146 . . . . 3.04 110.709 172.325 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.514 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 0.1 OUTLIER -63.85 -30.6 71.67 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.151 0.797 . . . . 2.91 113.151 -170.101 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -67.98 -60.64 2.35 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.589 0.755 . . . . 2.07 110.951 169.815 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -60.97 -26.12 67.33 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 118.146 -0.93 . . . . 2.1 112.388 -176.158 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.514 ' HE2' ' HA ' ' A' ' 18' ' ' ASN . 10.7 ttmm -43.88 -42.17 5.59 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.805 2.042 . . . . 2.24 112.81 167.596 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -82.69 -19.0 38.92 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.014 1.116 . . . . 2.96 114.014 178.315 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.7 t -85.08 169.43 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 126.57 1.948 . . . . 2.48 110.387 -179.101 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.7 m -85.05 -16.12 41.77 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 116.126 -1.892 . . . . 3.61 116.088 175.375 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.1 tttp 110.51 -37.41 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 130.813 3.645 . . . . 5.35 112.265 -167.705 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -95.68 142.43 28.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.256 1.422 . . . . 7.91 111.507 -178.98 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 72.3 p -81.35 -115.77 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.079 0.952 . . . . 6.98 110.872 175.205 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 40.9 mt 60.36 4.73 0.72 Allowed 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 116.321 1.971 . . . . 7.69 116.321 163.135 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.0 t 68.4 98.12 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 131.144 3.778 . . . . 4.97 111.716 174.212 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.64 2.63 8.25 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.347 1.24 . . . . 8.12 114.347 -177.297 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 28.3 m-20 71.8 -3.24 2.24 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 127.314 2.246 . . . . 8.86 114.485 173.059 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -64.21 -19.72 65.54 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.742 1.617 . . . . 10.21 114.409 -164.214 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.8 tt -128.51 152.71 37.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 126.306 1.842 . . . . 2.4 107.578 156.068 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.8 t -147.84 -175.63 4.95 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 122.036 0.922 . . . . 4.09 110.84 167.897 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.47 -29.36 24.4 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.651 2.38 . . . . 2.0 114.498 -176.188 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.5 p -61.18 -26.27 67.6 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.157 1.383 . . . . 2.25 114.349 172.515 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 16.4 m -91.3 -40.9 11.23 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.316 1.228 . . . . 1.28 114.316 -175.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.418 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 42.5 t80 -54.82 -52.22 63.38 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.217 0.917 . . . . 2.1 113.226 -167.06 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -54.37 -30.74 52.84 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.594 1.558 . . . . 2.97 113.862 173.529 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -87.76 -50.83 6.21 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.574 1.149 . . . . 3.11 109.782 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -47.49 -45.16 26.03 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.627 1.171 . . . . 1.59 111.915 167.437 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 mt -54.85 -31.2 59.23 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 114.497 1.295 . . . . 1.19 114.497 177.383 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.431 ' HB2' ' HE ' ' A' ' 56' ' ' ARG . 0.9 OUTLIER -87.97 -4.11 58.84 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 120.168 1.349 . . . . 2.26 113.651 178.133 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.14 -43.68 7.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.004 1.321 . . . . 1.59 111.373 168.243 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.465 ' OE2' ' HE3' ' A' ' 21' ' ' LYS . 7.4 mm-40 -97.71 -25.79 14.97 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.487 0.921 . . . . 2.94 113.487 -166.231 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.63 34.71 5.08 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.211 1.404 . . . . 1.89 110.621 -176.984 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -83.66 -5.95 59.32 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 117.243 2.312 . . . . 1.42 117.243 -149.052 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -94.16 -50.27 5.36 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 120.223 1.374 . . . . 1.81 109.93 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.9 tpp -46.46 -40.57 12.54 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.58 1.952 . . . . 1.96 112.527 164.751 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.4 mp -84.59 91.29 7.86 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-O 122.834 1.302 . . . . 3.3 110.159 177.297 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.9 t -91.04 -90.69 0.15 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.445 -1.252 . . . . 3.99 109.926 -176.137 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -72.65 156.51 38.9 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.604 1.161 . . . . 3.9 113.682 -178.452 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.7 m -63.87 -30.0 71.13 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.322 1.449 . . . . 2.64 111.667 171.494 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.11 -37.7 92.03 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.296 1.427 . . . . 2.17 112.525 168.066 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.34 -36.19 74.08 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.044 0.922 . . . . 3.57 111.601 171.241 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.431 ' HE ' ' HB2' ' A' ' 43' ' ' GLN . 48.1 mtt85 -65.73 -24.26 66.93 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.509 0.929 . . . . 7.05 113.509 176.169 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt -59.07 -17.21 23.82 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.868 -1.145 . . . . 4.21 113.725 166.121 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -78.47 -19.2 53.61 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.267 1.58 . . . . 1.36 115.267 169.2 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.17 -55.29 4.84 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.739 1.216 . . . . 0.94 110.422 163.565 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -64.08 -28.89 70.09 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 113.996 1.109 . . . . 2.77 113.996 -176.962 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.3 ptmm? -53.02 -33.58 52.39 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 120.074 1.306 . . . . 3.6 112.596 167.688 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.5 mt -77.16 -41.43 41.74 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 122.138 -0.351 . . . . 0.92 111.459 -179.839 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.3 mm -53.3 -56.12 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 C-N-CA 124.102 0.961 . . . . 1.16 110.191 -179.827 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -57.44 -40.43 78.42 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.7 0.8 . . . . 1.88 112.906 -179.018 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -64.34 -38.92 92.75 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 112.935 0.717 . . . . 4.01 112.935 175.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.42 -38.92 16.87 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.412 0.685 . . . . 2.34 111.962 -173.074 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.5 -22.52 66.18 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.829 0.851 . . . . 2.92 112.826 177.137 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.37 -17.31 61.83 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 114.314 1.227 . . . . 2.84 114.314 168.503 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -128.63 -8.93 5.08 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 115.158 1.54 . . . . 3.35 115.158 -166.545 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -137.87 107.68 6.28 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.489 1.495 . . . . 4.25 111.929 -174.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.0 p-10 -78.6 77.23 5.09 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.482 1.513 . . . . 4.09 112.423 -174.714 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.86 10.7 77.52 Favored Glycine 0 N--CA 1.476 1.332 0 C-N-CA 124.117 0.865 . . . . 2.55 114.587 175.197 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -64.87 153.64 39.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.557 1.543 . . . . 5.79 111.921 179.132 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.6 mp -140.65 86.57 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 124.819 1.247 . . . . 4.28 107.883 175.573 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.7 t -89.66 149.63 22.71 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 125.296 1.438 . . . . 1.59 112.085 169.6 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -58.27 -41.51 84.48 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 121.756 -0.59 . . . . 2.78 111.907 169.536 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -79.04 -23.2 44.43 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.084 0.772 . . . . 4.1 113.084 -174.269 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -54.83 -59.04 5.26 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.262 -1.014 . . . . 3.42 108.262 167.08 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -55.45 -43.78 75.75 Favored 'General case' 0 CA--C 1.536 0.442 0 O-C-N 121.234 -0.916 . . . . 3.02 113.006 179.57 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 45.6 t-105 -65.76 -49.26 69.02 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.304 -0.873 . . . . 1.06 112.957 -178.861 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 4.6 t -67.97 -25.65 65.54 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.114 0.87 . . . . 2.03 112.498 178.379 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 89.5 mt -65.51 -49.61 68.32 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.277 -0.868 . . . . 0.67 111.362 171.541 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 34.4 mm -54.85 -40.34 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 CA-C-N 120.561 1.528 . . . . 0.59 113.538 -177.553 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.69 -28.24 71.23 Favored Glycine 0 CA--C 1.529 0.939 0 CA-C-O 119.477 -0.624 . . . . 0.65 112.751 175.048 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -83.05 -14.66 74.36 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-O 117.63 -1.65 . . . . 0.84 116.535 -174.683 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.4 mp -87.33 -31.36 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-N 119.637 1.719 . . . . 1.08 110.795 163.193 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 8.1 m -71.55 168.92 16.56 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.195 1.798 . . . . 3.34 108.712 176.342 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.69 -73.07 0.3 Allowed Glycine 0 CA--C 1.531 1.078 0 CA-C-O 117.821 -1.544 . . . . 1.39 113.03 179.763 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -63.72 -43.64 16.05 Favored 'Trans proline' 0 C--N 1.351 0.666 0 CA-C-N 120.539 2.169 . . . . 1.43 110.138 174.584 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.1 pt -67.43 -22.55 28.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 113.62 0.97 . . . . 1.4 113.62 170.875 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.437 ' HA ' HD12 ' A' ' 94' ' ' ILE . . . -57.73 -55.7 31.53 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.976 1.262 . . . . 1.48 112.7 -171.79 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -29.3 70.23 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.831 -1.168 . . . . 3.9 112.389 176.712 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.44 -41.45 72.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.343 1.457 . . . . 1.36 110.572 -177.195 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.437 HD12 ' HA ' ' A' ' 91' ' ' ALA . 62.9 mt -48.98 -60.17 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 1.19 109.585 165.256 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -55.9 -44.66 78.45 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-O 118.38 -0.819 . . . . 1.98 111.7 -177.978 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -55.36 -43.08 74.74 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.137 1.335 . . . . 4.13 112.805 173.483 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 24.2 mm100 -79.26 -30.54 43.11 Favored 'General case' 0 CA--C 1.527 0.079 0 N-CA-C 113.95 1.092 . . . . 2.7 113.95 -172.553 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -71.89 -32.92 67.91 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.873 1.215 . . . . 2.43 111.15 170.317 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.57 -40.91 96.4 Favored 'General case' 0 N--CA 1.482 1.13 0 O-C-N 121.132 -0.98 . . . . 2.62 110.674 173.778 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -68.88 -16.09 63.67 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 115.43 -0.805 . . . . 5.34 112.279 171.517 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.0 m 47.64 48.95 16.82 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.565 2.346 . . . . 9.02 112.1 -170.388 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.0 t -135.63 69.99 1.43 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.899 1.679 . . . . 12.66 108.293 -164.723 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 54.5 p . . . . . 0 C--O 1.254 1.294 0 C-N-CA 126.267 1.827 . . . . 16.71 112.706 -177.468 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 39.2 m . . . . . 0 CA--C 1.505 -0.754 0 CA-C-O 119.361 -0.352 . . . . 11.53 111.419 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -83.98 -118.67 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.133 0 O-C-N 124.755 1.285 . . . . 7.72 107.54 144.558 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 73.8 m -106.52 -26.2 11.51 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 127.599 2.36 . . . . 3.85 111.354 -176.426 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -56.14 139.11 48.46 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 118.722 -0.656 . . . . 2.36 109.505 156.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 26.9 p -61.8 147.65 45.7 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.234 0.925 . . . . 1.06 109.703 171.641 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.44 -48.09 72.11 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.772 -0.633 . . . . 2.88 110.348 173.612 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -47.92 -49.91 28.58 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.797 1.639 . . . . 0.73 111.976 177.183 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.42 -54.23 8.8 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.422 -0.799 . . . . 2.98 111.091 -171.727 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 28.0 mmtt -56.36 -24.79 46.47 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 120.883 -1.135 . . . . 7.45 113.48 169.064 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.907 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -67.86 -45.27 75.05 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 120.652 -1.28 . . . . 0.53 112.62 168.027 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 93.7 t -57.66 -38.08 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 CA-C-N 120.834 1.652 . . . . 0.77 110.468 169.117 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 2.3 mt -59.71 -49.49 83.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 121.481 -0.762 . . . . 1.41 112.23 170.031 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.9 t -60.81 -38.8 79.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 125.777 1.631 . . . . 0.57 112.256 178.472 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.79 -40.47 97.42 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.401 1.0 . . . . 0.99 111.048 172.438 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 66.8 t -66.67 -41.35 88.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-O 117.467 -1.254 . . . . 0.69 110.957 177.156 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -67.56 -39.41 84.93 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 121.185 1.811 . . . . 4.44 113.982 169.399 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -61.55 -24.39 66.6 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.35 -1.469 . . . . 3.49 113.162 177.216 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -81.01 -66.19 0.92 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.736 1.214 . . . . 1.88 112.559 164.345 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -60.29 -31.39 70.21 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 118.195 -0.907 . . . . 2.11 112.774 -167.862 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 ptmt -52.24 -31.72 33.63 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.278 1.399 . . . . 2.34 113.4 175.034 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -82.66 -16.56 47.8 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.803 -1.185 . . . . 2.23 113.605 177.213 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 25.6 t -99.37 157.2 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 127.105 2.162 . . . . 2.56 108.976 -176.981 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 65.1 m -101.15 56.89 0.85 Allowed 'General case' 0 N--CA 1.483 1.211 0 O-C-N 120.542 -1.349 . . . . 4.04 112.135 166.101 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 34.1 tttp 77.87 -44.24 0.41 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 116.126 1.899 . . . . 5.26 116.126 151.341 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -86.66 148.9 25.26 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.349 1.46 . . . . 7.93 112.389 179.16 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 68.8 p -85.74 -125.86 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.714 1.206 . . . . 7.39 111.408 178.968 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 61.9 mt 64.0 -19.1 0.07 Allowed 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 127.608 2.363 . . . . 8.15 116.284 173.478 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 48.7 t 99.64 125.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.345 1 C-N-CA 132.87 4.468 . . . . 4.72 108.176 -174.972 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 21.3 mmmt -123.78 -16.71 6.58 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 115.561 1.689 . . . . 6.96 115.561 -169.373 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 55.0 m-20 57.61 19.96 5.86 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.5 1.52 . . . . 8.94 112.717 -170.02 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -80.55 -29.27 37.12 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 120.59 -1.319 . . . . 9.93 112.394 -168.364 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 10.2 tt -140.03 157.95 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 C-N-CA 126.75 2.02 . . . . 2.29 107.316 169.168 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 9.1 t -148.43 -175.19 4.82 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 122.759 1.266 . . . . 4.09 111.157 171.229 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.17 -35.69 27.26 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.981 2.912 . . . . 2.01 114.349 -177.824 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 26.8 p -58.83 -26.47 64.19 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.089 1.356 . . . . 2.03 114.409 173.821 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 19.3 m -91.53 -40.33 11.42 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.394 1.078 . . . . 1.34 113.756 -178.848 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 53.4 t80 -55.45 -51.59 66.41 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.789 1.177 . . . . 2.16 113.473 -166.476 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.35 -32.29 48.47 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.202 1.401 . . . . 2.83 114.024 171.28 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -84.06 -52.49 6.26 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.021 1.328 . . . . 3.02 109.459 -173.183 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 13.9 tmm? -44.96 -45.08 10.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.138 1.775 . . . . 1.52 112.395 165.501 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 9.2 mt -58.86 -27.91 65.59 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.614 1.166 . . . . 1.21 114.112 179.622 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -92.53 3.84 54.73 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.894 1.225 . . . . 2.16 113.862 173.191 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -44.44 5.84 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.044 0.938 . . . . 1.49 111.614 165.605 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.01 -18.59 19.32 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 113.735 1.013 . . . . 2.88 113.735 -170.935 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -122.85 26.77 8.03 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.311 1.845 . . . . 1.83 111.574 -179.365 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -71.93 1.93 6.38 Favored 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 117.832 2.531 . . . . 1.44 117.832 -157.94 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -99.64 -57.82 2.06 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.701 1.201 . . . . 1.88 110.007 178.025 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . 0.441 ' SD ' HD12 ' B' ' 193' ' ' ILE . 8.1 ttp -65.36 -27.65 68.73 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.28 1.032 . . . . 2.05 113.058 168.223 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 6.1 mp -98.53 82.04 2.8 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.799 1.182 . . . . 4.14 110.871 157.445 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 6.3 t -104.52 -64.06 1.15 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.892 2.077 . . . . 4.77 110.785 178.345 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -72.57 140.93 48.38 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.15 0.98 . . . . 4.25 112.433 176.58 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 77.0 m -71.91 -26.09 62.17 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.572 1.949 . . . . 3.11 112.72 175.98 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -61.61 -45.69 95.8 Favored Glycine 0 CA--C 1.529 0.956 0 CA-C-N 119.222 0.919 . . . . 2.06 111.064 165.927 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.14 -37.41 82.74 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.796 0.839 . . . . 3.55 111.739 169.598 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 -64.81 -25.56 67.96 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.779 1.172 . . . . 7.36 113.642 177.881 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 21.7 mtmt -58.63 -17.78 25.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 120.141 1.337 . . . . 4.32 113.465 167.739 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -77.6 -19.13 56.07 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 115.315 1.598 . . . . 1.54 115.315 168.511 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.82 -55.71 4.79 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.207 1.003 . . . . 1.08 110.382 163.136 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -64.6 -28.96 69.98 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.734 1.013 . . . . 2.98 113.734 -175.425 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 5.5 ptmm? -52.53 -32.97 43.26 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 119.654 1.115 . . . . 3.87 112.412 168.722 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 48.8 mt -76.96 -42.44 39.08 Favored 'General case' 0 C--O 1.224 -0.265 0 O-C-N 121.704 -0.622 . . . . 0.97 111.675 -179.653 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 35.6 mm -52.01 -53.68 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 125.099 1.36 . . . . 1.34 110.485 -179.179 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -59.53 -42.51 92.48 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.214 0.82 . . . . 1.96 113.214 -179.949 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -64.62 -30.0 71.02 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.293 0.637 . . . . 3.99 112.709 175.682 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -85.8 -47.24 9.91 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.17 0.988 . . . . 2.68 112.026 -176.8 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -63.78 -23.3 67.31 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.197 0.908 . . . . 3.08 112.692 178.358 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -67.71 -15.01 63.43 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.63 1.344 . . . . 2.85 114.63 170.656 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -136.53 -20.43 1.36 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.619 1.711 . . . . 3.45 115.619 -169.009 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -122.46 99.75 6.58 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.716 -1.24 . . . . 4.91 111.666 -167.758 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -77.6 76.95 4.13 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.818 1.247 . . . . 3.92 113.687 -169.996 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 72.2 11.51 75.38 Favored Glycine 0 N--CA 1.477 1.37 0 O-C-N 120.943 -1.098 . . . . 2.63 114.345 176.75 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -65.93 152.16 45.13 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.772 1.629 . . . . 5.62 111.935 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 2.5 mp -140.23 78.64 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 C-N-CA 124.779 1.232 . . . . 4.18 108.353 174.605 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 27.7 t -82.61 151.67 26.24 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.5 1.12 . . . . 1.58 112.171 169.261 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -57.84 -42.11 83.74 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.621 -0.674 . . . . 2.76 111.545 170.04 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -80.95 -22.71 39.38 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.031 0.752 . . . . 3.82 113.031 -173.061 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -56.59 -53.11 61.42 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.714 -0.847 . . . . 3.72 108.714 166.276 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -58.16 -46.87 84.96 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.274 -0.891 . . . . 2.99 112.484 176.505 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 49.7 t-105 -65.4 -47.78 75.11 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 120.924 -1.11 . . . . 0.97 113.369 -176.373 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 5.6 t -63.44 -32.86 74.41 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.481 1.037 . . . . 1.94 111.914 176.321 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.414 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 67.6 mt -61.54 -49.47 76.55 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.263 -0.898 . . . . 0.82 112.249 173.711 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 33.2 mm -57.14 -40.12 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 CA-C-N 120.418 1.463 . . . . 0.78 113.023 -176.712 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.02 -29.74 75.3 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-O 119.206 -0.774 . . . . 0.82 112.735 174.803 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.84 -16.16 75.81 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.404 1.478 . . . . 0.84 116.297 -173.807 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 2.1 mp -86.68 -31.41 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 CA-C-N 119.249 1.524 . . . . 0.99 110.82 164.297 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 7.5 m -74.01 171.13 14.03 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.988 1.715 . . . . 3.05 108.546 178.209 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . 115.43 -73.86 0.25 Allowed Glycine 0 N--CA 1.473 1.153 0 CA-C-O 117.752 -1.582 . . . . 1.2 113.399 179.532 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.27 -41.0 22.98 Favored 'Trans proline' 0 C--N 1.351 0.687 0 CA-C-N 121.276 2.538 . . . . 1.3 110.348 175.616 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . 0.441 HD12 ' SD ' ' B' ' 152' ' ' MET . 12.4 pt -69.26 -21.2 24.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 113.577 0.955 . . . . 1.33 113.577 170.727 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . 0.454 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -60.26 -45.73 92.27 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.185 1.357 . . . . 1.27 112.628 -178.448 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -65.68 -35.52 81.01 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 120.68 -1.262 . . . . 3.51 112.89 170.521 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 1.4 mt -64.35 -41.79 96.57 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.696 -1.145 . . . . 1.86 111.172 179.317 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . 0.454 HD12 ' HA ' ' B' ' 194' ' ' ALA . 75.1 mt -49.57 -58.1 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 119.625 1.102 . . . . 1.28 110.1 164.569 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -58.44 -36.23 73.33 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 118.433 -0.794 . . . . 1.98 112.611 -172.372 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -68.57 -49.78 56.8 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.669 1.988 . . . . 4.01 112.693 171.84 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -70.47 -32.17 69.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.368 1.067 . . . . 2.59 113.466 -172.124 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -66.55 -35.71 80.9 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 119.951 1.251 . . . . 2.5 111.207 170.952 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -65.95 -42.38 90.07 Favored 'General case' 0 N--CA 1.484 1.226 0 O-C-N 120.643 -1.285 . . . . 2.25 110.588 178.146 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -68.72 -11.68 60.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.417 1.887 . . . . 4.36 112.754 177.735 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 10.3 m 52.58 48.2 23.07 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.72 2.408 . . . . 8.71 111.793 -173.991 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 32.4 t -145.34 69.89 1.25 Allowed 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 122.376 1.084 . . . . 12.55 109.648 -159.553 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 81.3 p . . . . . 0 C--O 1.251 1.166 0 CA-C-O 115.647 -2.12 . . . . 16.32 110.807 177.364 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 N--CA 1.476 0.866 0 CA-C-O 121.202 0.525 . . . . 10.23 109.624 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -112.91 61.27 0.64 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 124.758 2.218 . . . . 9.11 111.361 -138.283 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 60.8 m -75.22 36.81 0.12 Allowed 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 110.271 -3.149 . . . . 3.66 115.167 -169.328 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.92 159.93 22.29 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 127.442 2.297 . . . . 2.12 108.376 163.543 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.47 153.25 35.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.458 -1.401 . . . . 1.04 110.425 178.385 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -63.96 -34.13 77.28 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 119.648 1.113 . . . . 2.06 111.437 174.443 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.01 -45.81 87.29 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 120.108 1.322 . . . . 1.1 109.375 177.049 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -66.13 -55.74 14.91 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.94 1.296 . . . . 3.02 112.057 179.836 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -58.64 -29.72 66.76 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 120.868 -1.145 . . . . 5.38 112.099 172.284 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.789 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -69.38 -41.37 76.57 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 119.649 -1.907 . . . . 0.67 112.488 169.078 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.437 ' HA ' ' HG ' ' A' ' 15' ' ' LEU . 85.9 t -56.66 -37.54 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 CA-C-N 119.733 1.151 . . . . 0.72 110.773 167.887 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.1 mt -55.92 -56.75 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 CA-C-N 120.924 1.693 . . . . 1.05 111.852 166.073 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.1 t -52.85 -43.75 46.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 119.382 0.992 . . . . 1.0 112.218 -177.773 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.437 ' HG ' ' HA ' ' A' ' 12' ' ' VAL . 1.8 pp -71.44 -18.94 62.29 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.161 1.171 . . . . 4.27 114.161 177.956 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 56.2 t -81.95 -43.52 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.291 0.95 . . . . 0.94 110.261 179.177 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -56.68 -41.45 77.33 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.227 0.467 . . . . 3.38 110.593 171.988 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -66.75 -23.8 66.13 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 115.397 1.629 . . . . 2.63 115.397 -178.243 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -79.61 -52.91 7.39 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.567 -0.708 . . . . 1.94 111.852 170.97 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.423 ' HA ' HG22 ' A' ' 23' ' ' VAL . 37.4 m-85 -68.22 -30.75 69.9 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 117.995 -1.002 . . . . 1.79 113.668 -172.065 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.39 -26.31 66.56 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.492 1.293 . . . . 3.74 114.492 172.638 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -93.1 -31.14 14.93 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 113.76 1.022 . . . . 2.31 113.76 177.847 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.423 HG22 ' HA ' ' A' ' 20' ' ' TYR . 18.9 m -88.36 -159.69 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 O-C-N 121.605 -0.684 . . . . 2.82 110.736 174.68 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.9 m -73.36 -10.74 60.06 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 118.0 2.593 . . . . 5.34 118.0 -164.212 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 46.8 tptt 112.72 -69.25 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 130.623 3.569 . . . . 5.04 109.63 -157.649 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -130.49 -82.52 0.54 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.555 1.142 . . . . 6.86 111.487 -173.731 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.4 m -155.29 6.17 0.23 Allowed 'General case' 0 N--CA 1.479 1.024 0 O-C-N 120.59 -1.319 . . . . 7.45 114.268 -178.733 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 90.8 mt -76.56 -17.53 59.17 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.47 1.285 . . . . 8.97 114.47 -174.087 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . 0.276 2.7 t 41.45 65.71 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 127.451 2.3 . . . . 4.84 114.357 -177.494 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -84.62 -8.11 59.01 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.364 -1.289 . . . . 9.81 112.058 157.458 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -171.86 162.49 6.1 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 128.151 2.58 . . . . 7.33 110.247 178.148 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 15.4 ptmm? -167.98 158.02 10.21 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.508 2.323 . . . . 6.89 112.438 179.396 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 7.2 pt -74.13 162.16 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-O 122.459 1.123 . . . . 3.0 112.872 165.781 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.3 t -78.93 150.52 32.08 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.169 -0.923 . . . . 3.1 110.576 154.762 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -43.55 -32.3 0.9 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.745 1.618 . . . . 2.24 113.075 171.659 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 82.4 p -67.92 -18.09 64.67 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 115.68 1.733 . . . . 1.76 115.68 -178.952 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.7 m -65.61 -43.49 89.46 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 121.114 1.779 . . . . 1.24 112.128 177.986 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.489 ' CZ ' HD11 ' A' ' 42' ' ' LEU . 10.8 t80 -50.4 -53.02 32.45 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.29 1.036 . . . . 2.02 112.866 -178.327 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -61.52 -17.93 56.91 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.318 0.858 . . . . 2.45 113.318 179.481 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -95.66 -42.3 8.46 Favored 'General case' 0 C--O 1.225 -0.184 0 C-N-CA 124.699 1.2 . . . . 3.44 112.329 178.438 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -44.39 -53.39 6.89 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.26 1.024 . . . . 1.71 109.544 162.363 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.489 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 11.8 mt -52.84 -15.88 0.86 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 127.12 2.168 . . . . 1.31 116.568 174.071 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.21 1.09 10.78 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.667 1.576 . . . . 2.43 114.187 174.746 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.92 -43.99 6.51 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.985 0.914 . . . . 1.88 111.766 164.643 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -88.03 -40.36 13.91 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.977 1.711 . . . . 3.24 112.496 -179.08 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.84 25.19 10.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.592 1.557 . . . . 2.21 112.253 -175.68 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -67.5 -23.84 65.51 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 120.917 -1.114 . . . . 1.74 113.708 -174.23 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -86.13 -20.55 28.49 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 119.245 0.93 . . . . 1.84 112.128 -169.026 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.7 mtm -98.23 -8.24 27.72 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 114.954 1.464 . . . . 2.62 114.954 168.275 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tp -77.72 71.47 4.2 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 120.445 1.475 . . . . 2.44 111.821 -176.43 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.0 m -70.69 3.56 3.08 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 117.416 2.376 . . . . 4.2 117.416 -166.587 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -177.32 158.39 1.44 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 127.333 2.253 . . . . 5.59 110.502 -179.418 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 53.8 m -58.24 -30.47 66.56 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.783 2.033 . . . . 2.94 112.405 171.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -57.8 -33.41 68.0 Favored Glycine 0 N--CA 1.472 1.085 0 CA-C-N 120.48 1.491 . . . . 2.32 113.605 175.938 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -64.63 -45.69 85.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.327 0.651 . . . . 3.37 110.938 171.684 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.1 mmm-85 -61.94 -43.87 97.95 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 120.662 -1.274 . . . . 5.25 113.638 169.082 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -53.35 -34.96 59.61 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 121.554 1.979 . . . . 3.43 111.916 173.879 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.44 -17.55 60.77 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 115.013 1.486 . . . . 1.32 115.013 174.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -80.22 -48.7 12.7 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.374 0.988 . . . . 0.93 110.822 163.794 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -63.06 -39.6 95.2 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.352 1.061 . . . . 2.59 111.943 -174.826 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.4 ptmm? -52.43 -29.12 22.88 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 113.841 1.052 . . . . 3.74 113.841 172.588 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.1 mt -78.85 -36.45 42.32 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 124.045 0.938 . . . . 0.97 111.986 -177.704 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.0 mm -57.69 -51.07 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.608 1.163 . . . . 1.12 109.835 -178.199 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -70.55 -31.62 68.73 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.882 1.273 . . . . 1.9 112.959 -179.708 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -65.47 -35.39 80.76 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.626 0.77 . . . . 3.07 112.158 167.568 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.7 tp -75.11 -20.48 59.42 Favored 'General case' 0 C--O 1.221 -0.421 0 O-C-N 120.9 -1.125 . . . . 2.92 111.562 174.216 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 48.8 m-20 -70.43 -5.14 26.31 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 115.585 1.698 . . . . 2.72 115.585 170.275 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.77 -2.83 31.65 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 113.444 0.905 . . . . 3.26 113.444 157.321 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -143.02 179.61 6.94 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 127.264 2.225 . . . . 3.21 110.815 -169.662 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 26.9 t60 101.03 71.64 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 128.231 2.613 . . . . 5.82 112.31 159.149 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.86 46.7 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 130.325 3.45 . . . . 6.44 114.692 -169.534 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 72.28 -14.75 2.21 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 126.262 1.886 . . . . 3.34 114.275 -176.074 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.2 mmt85 -90.37 -167.53 1.86 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.662 1.985 . . . . 7.0 112.059 -177.538 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.7 mm -139.65 132.06 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 127.637 2.375 . . . . 3.35 106.542 175.434 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 71.0 m -113.26 146.83 38.7 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.833 0.853 . . . . 1.99 110.727 162.584 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -60.65 -38.02 83.48 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.348 0.87 . . . . 2.13 113.348 -174.935 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -71.97 -8.83 56.77 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.317 1.047 . . . . 4.48 112.883 -176.443 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.82 -56.33 18.42 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.119 0.872 . . . . 3.99 111.095 175.526 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -58.58 -33.2 69.69 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.207 -1.558 . . . . 2.31 112.212 176.007 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 23.5 t-105 -67.72 -59.49 3.28 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.951 0.723 . . . . 1.08 112.951 178.108 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.9 t -60.28 -23.9 64.52 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.023 1.329 . . . . 1.72 112.147 178.181 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 65.0 mt -73.97 -46.67 42.46 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 117.807 -1.092 . . . . 0.63 113.44 169.355 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 8.2 mm -55.05 -40.8 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 CA-C-N 121.732 2.06 . . . . 0.89 112.423 -178.298 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -62.74 -21.79 63.46 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-N 118.251 0.478 . . . . 0.6 113.39 177.135 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.8 -19.45 76.79 Favored Glycine 0 CA--C 1.532 1.143 0 O-C-N 121.236 -1.155 . . . . 0.67 114.068 177.963 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -110.2 -34.19 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.904 1.281 . . . . 1.05 111.502 170.495 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 4.5 m -77.4 85.18 3.8 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.285 1.434 . . . . 1.37 108.226 177.667 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -170.33 -68.4 0.04 OUTLIER Glycine 0 CA--C 1.532 1.134 0 C-N-CA 126.077 1.799 . . . . 0.98 111.846 -172.753 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -59.28 -67.83 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.654 2.903 . . . . 1.23 110.877 168.563 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.8 pt -65.84 -20.78 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 117.717 -1.135 . . . . 1.39 113.614 177.677 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.54 71.19 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.632 1.56 . . . . 0.93 112.32 173.677 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -63.67 -41.23 98.21 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.848 -1.157 . . . . 4.09 112.585 173.9 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.81 -35.17 75.81 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.219 1.008 . . . . 1.34 112.722 178.945 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.2 mt -55.45 -52.71 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 120.854 -1.154 . . . . 1.01 110.161 171.173 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -67.27 -35.71 80.08 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.683 0.623 . . . . 1.81 112.683 -176.237 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.263 4.6 pt-20 -75.41 -19.67 59.37 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 119.582 1.083 . . . . 3.05 112.514 174.748 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.49 -43.64 22.79 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 117.56 -1.209 . . . . 2.34 114.212 172.72 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -61.65 -17.85 57.09 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 119.785 1.175 . . . . 2.37 111.762 177.286 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.5 -66.38 0.9 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.325 1.45 . . . . 2.26 110.058 176.175 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 57.31 -11.02 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.151 1 C-N-CA 133.235 4.614 . . . . 4.69 116.075 173.499 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 21.1 t -123.35 3.45 9.13 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.57 0.952 . . . . 6.59 113.57 -159.6 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 84.93 106.0 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.353 2.661 . . . . 8.68 110.851 -172.781 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 5.5 p . . . . . 0 C--O 1.25 1.104 0 C-N-CA 129.775 3.23 . . . . 11.3 109.931 -172.887 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 70.1 m . . . . . 0 N--CA 1.477 0.893 0 N-CA-C 109.945 -0.391 . . . . 9.8 109.945 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -117.3 62.56 0.74 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 125.031 2.348 . . . . 8.81 111.188 -138.654 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 66.7 m -76.43 -5.54 47.81 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 109.755 -3.384 . . . . 3.69 115.512 -168.14 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -75.54 137.74 41.05 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.29 1.036 . . . . 2.38 109.59 167.309 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 22.3 p -70.48 152.55 43.9 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 119.81 1.186 . . . . 1.04 111.339 -172.931 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -59.31 -36.08 74.98 Favored 'General case' 0 C--O 1.221 -0.443 0 O-C-N 121.526 -0.734 . . . . 2.13 111.851 -177.42 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -44.72 89.19 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.497 1.044 . . . . 1.36 111.149 175.261 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -65.68 -56.46 12.0 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.077 0.951 . . . . 2.84 111.004 -179.569 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 9.0 tmtt? -58.33 -27.72 64.41 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 120.941 -1.099 . . . . 4.64 112.611 172.137 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.789 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.98 -42.14 76.96 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 119.344 -2.097 . . . . 0.59 113.08 167.842 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 22.1 t -59.81 -31.08 46.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 CA-C-N 120.299 1.409 . . . . 0.72 111.663 168.746 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 69.9 mt -58.57 -60.68 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 O-C-N 120.354 -1.467 . . . . 1.01 111.217 163.097 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 32.9 t -52.94 -44.28 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 124.41 1.084 . . . . 1.02 112.652 -175.601 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 2.6 pp -70.65 -25.11 62.85 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.32 -0.863 . . . . 4.18 112.777 -179.007 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 42.4 t -78.0 -31.66 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 124.199 1.0 . . . . 0.93 110.57 178.045 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -54.14 -49.86 68.25 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.719 0.808 . . . . 2.84 110.284 164.801 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -63.82 -19.26 64.88 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 115.165 1.543 . . . . 2.28 115.165 -178.804 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -80.97 -62.11 1.76 Allowed 'General case' 0 C--O 1.237 0.434 0 O-C-N 121.308 -0.87 . . . . 2.28 112.266 173.471 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -69.61 -21.22 63.59 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 113.598 0.962 . . . . 1.77 113.598 -171.393 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.42 -20.8 66.53 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 114.429 1.27 . . . . 3.07 114.429 168.497 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 14.3 m-30 -106.3 -36.68 6.78 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.707 1.203 . . . . 2.16 114.055 177.785 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 15.8 m -79.94 -169.23 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 119.168 0.894 . . . . 3.05 111.449 172.309 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 3.4 m -70.71 -7.28 43.55 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 118.972 2.952 . . . . 5.4 118.972 -162.697 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 40.8 tptt 109.39 -73.66 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 130.591 3.556 . . . . 5.16 110.87 -161.797 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -123.65 -87.88 0.62 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.051 0.94 . . . . 6.66 112.111 -173.956 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 14.2 m -155.41 1.43 0.17 Allowed 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 115.312 1.597 . . . . 7.52 115.312 178.989 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.41 -34.33 77.93 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.307 0.958 . . . . 9.07 112.948 176.951 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . 0.263 7.5 t 61.21 71.49 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 127.423 2.289 . . . . 4.77 112.401 -172.552 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -79.62 -17.42 53.86 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.192 0.997 . . . . 9.9 112.864 164.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -173.14 170.77 4.28 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 129.507 3.123 . . . . 7.38 109.337 176.108 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -165.29 161.98 19.49 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.612 1.965 . . . . 6.88 113.079 -175.48 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 7.8 pt -75.6 161.09 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 122.248 1.023 . . . . 3.05 112.041 162.645 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 36.0 t -82.48 154.11 25.28 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.189 -0.914 . . . . 3.02 109.907 157.601 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -49.49 -34.42 16.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.211 1.004 . . . . 2.22 112.027 170.679 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 99.7 p -61.73 -15.75 43.4 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.194 1.183 . . . . 1.62 114.194 177.669 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 69.7 m -65.89 -37.2 85.5 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.931 1.242 . . . . 1.28 112.208 169.442 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.42 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 17.8 t80 -58.42 -49.23 78.03 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.184 1.357 . . . . 2.61 113.295 -173.793 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 16.2 ptt85 -57.54 -12.44 2.73 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.286 1.034 . . . . 3.3 113.215 174.243 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -109.82 -42.79 4.16 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 125.93 1.692 . . . . 3.31 114.303 179.374 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -40.95 -49.88 3.26 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.885 1.674 . . . . 2.03 110.217 163.135 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 14.6 mt -61.63 -24.64 66.85 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 114.633 1.346 . . . . 1.2 114.633 177.849 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -103.83 2.78 33.13 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 120.411 1.46 . . . . 2.54 114.124 175.91 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.09 -44.17 4.44 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.448 1.099 . . . . 1.57 113.22 167.246 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -96.9 -15.58 21.12 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.803 1.241 . . . . 3.64 114.222 -178.777 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.91 26.17 8.28 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.286 1.834 . . . . 1.82 112.271 176.265 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -68.76 -16.12 63.71 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 116.046 1.869 . . . . 1.32 116.046 -167.868 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -93.54 -38.23 11.49 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 119.644 1.111 . . . . 1.74 110.509 -175.141 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 36.5 mtm -77.64 -10.19 59.38 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 113.914 1.079 . . . . 2.63 113.914 167.808 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.49 44.04 0.07 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.692 1.997 . . . . 2.38 111.946 167.413 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.78 29.72 0.26 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.84 1.656 . . . . 4.56 113.598 -167.801 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -174.41 163.89 3.75 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.308 2.643 . . . . 6.62 108.886 -161.991 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 47.2 m -107.43 -17.94 13.99 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 125.384 1.474 . . . . 2.75 112.816 178.054 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -65.77 -41.69 95.57 Favored Glycine 0 CA--C 1.528 0.878 0 CA-C-N 119.234 0.924 . . . . 2.24 112.036 175.44 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -57.53 -43.25 84.18 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 117.816 0.808 . . . . 3.33 112.643 174.066 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.39 -50.27 72.08 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 124.133 0.973 . . . . 4.95 112.957 171.395 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -61.57 -33.01 73.14 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.835 0.743 . . . . 3.12 112.02 177.838 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . 0.508 ' HA ' ' HG2' ' B' ' 164' ' ' LYS . . . -68.07 -15.74 63.72 Favored 'General case' 0 CA--C 1.551 0.984 0 N-CA-C 114.395 1.257 . . . . 1.17 114.395 173.722 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -78.44 -44.97 23.38 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.957 0.799 . . . . 0.92 110.955 164.301 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -61.91 -40.23 94.74 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.978 0.911 . . . . 2.72 112.375 -175.722 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . 0.508 ' HG2' ' HA ' ' B' ' 161' ' ' ALA . 2.9 ptmm? -52.95 -26.31 14.71 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.133 1.16 . . . . 4.0 114.133 170.053 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 44.5 mt -83.08 -29.96 28.37 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 118.08 -0.962 . . . . 1.55 112.797 176.886 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 41.0 mm -58.33 -55.01 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 118.922 0.783 . . . . 1.21 108.933 177.868 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -61.53 -34.14 75.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.777 1.029 . . . . 2.58 113.777 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -70.24 -33.7 71.96 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.598 1.159 . . . . 3.11 111.979 175.147 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 24.3 tp -78.5 -21.96 48.16 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 123.87 0.868 . . . . 2.76 111.205 172.275 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -69.52 -8.85 50.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.939 1.696 . . . . 2.96 115.455 174.48 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -73.31 -3.45 27.11 Favored 'General case' 0 CA--C 1.554 1.11 0 N-CA-C 113.84 1.052 . . . . 3.2 113.84 158.874 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -142.87 179.72 6.85 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 127.187 2.195 . . . . 3.11 111.402 -169.447 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 27.1 t60 100.71 80.42 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 128.461 2.704 . . . . 5.52 112.027 160.364 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -72.57 42.57 0.1 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 129.036 2.935 . . . . 6.5 114.404 -167.773 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 75.93 -17.73 3.58 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 126.127 1.822 . . . . 3.29 114.671 -179.499 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 -87.57 -155.89 0.32 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.8 1.64 . . . . 7.06 111.727 177.91 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 29.4 mm -145.98 136.09 18.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 128.213 2.605 . . . . 3.29 106.134 178.406 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.5 m -113.88 153.14 29.71 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.606 0.762 . . . . 2.04 111.257 159.894 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -65.17 -42.43 93.68 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 112.743 0.646 . . . . 1.87 112.743 -176.268 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -68.97 -14.27 62.94 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.877 1.271 . . . . 4.33 113.087 -173.986 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -56.59 -57.98 10.02 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.8 0.84 . . . . 4.11 109.822 174.157 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -54.12 -39.71 66.67 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.026 -1.047 . . . . 2.51 112.611 178.354 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -70.68 -53.9 13.93 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.749 0.648 . . . . 1.39 112.749 -179.259 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.2 t -62.75 -20.42 64.93 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.701 1.2 . . . . 1.6 113.117 -178.24 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.42 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 95.9 mt -76.38 -41.11 49.08 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.83 -1.169 . . . . 0.61 113.933 168.143 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 13.8 mm -58.39 -46.26 89.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 CA-C-N 120.935 1.698 . . . . 0.75 112.278 -173.976 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.65 -21.72 60.9 Favored Glycine 0 CA--C 1.533 1.2 0 CA-C-N 118.441 0.564 . . . . 0.67 113.4 177.33 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -71.05 -8.78 65.45 Favored Glycine 0 CA--C 1.535 1.287 0 O-C-N 121.078 -1.248 . . . . 0.89 114.183 175.845 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.2 mp -120.39 -37.76 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 126.035 1.734 . . . . 1.32 111.544 166.222 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 8.0 m -78.87 78.76 5.3 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.223 1.809 . . . . 1.4 108.088 177.974 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -169.06 -65.78 0.03 OUTLIER Glycine 0 CA--C 1.524 0.627 0 CA-C-O 118.282 -1.288 . . . . 0.91 111.127 -174.644 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -57.74 -62.89 0.17 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.906 2.404 . . . . 0.94 110.817 166.05 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 2.1 pp -74.96 -14.66 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 CA-C-N 119.903 1.229 . . . . 1.06 113.142 -177.535 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -64.28 -36.41 84.02 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.599 0.592 . . . . 1.0 112.599 176.514 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -62.93 -41.4 99.47 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 120.624 -1.298 . . . . 4.16 111.454 171.417 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.97 -37.09 73.56 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.261 1.424 . . . . 1.59 113.019 174.14 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 84.9 mt -54.35 -54.15 24.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 O-C-N 121.094 -1.004 . . . . 0.92 110.755 169.032 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -67.71 -34.62 77.24 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.478 0.918 . . . . 1.71 113.478 -175.495 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -74.14 -20.24 60.3 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 118.521 -0.752 . . . . 3.66 112.268 173.758 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -78.61 -40.85 33.28 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 114.996 1.48 . . . . 2.21 114.996 172.924 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -62.98 -13.65 37.79 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 120.72 1.6 . . . . 2.36 112.144 174.133 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.08 -71.5 0.71 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.308 1.443 . . . . 2.44 109.616 175.974 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 57.35 -14.73 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.229 1 C-N-CA 134.251 5.02 . . . . 4.47 116.092 172.814 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 21.8 t -119.14 7.24 11.3 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 124.381 1.072 . . . . 6.41 113.037 -159.911 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 4.9 t 85.98 108.12 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 128.667 2.787 . . . . 8.82 110.51 -171.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 4.6 p . . . . . 0 C--O 1.25 1.1 0 C-N-CA 129.619 3.168 . . . . 10.84 110.983 -177.832 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.5 m . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 106.58 -1.637 . . . . 8.1 106.58 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -62.02 -106.42 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 107.999 -1.112 . . . . 6.4 107.999 110.811 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 88.7 m -119.89 -91.68 0.55 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.689 1.996 . . . . 3.96 109.001 157.137 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 137.62 157.54 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.227 1 C-N-CA 133.579 4.751 . . . . 2.32 109.808 -177.511 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -88.16 146.01 25.62 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.893 -0.78 . . . . 1.07 108.893 159.01 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -67.26 -23.9 65.74 Favored 'General case' 0 C--O 1.212 -0.899 0 CA-C-O 117.325 -1.322 . . . . 2.93 112.172 177.978 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -49.82 72.96 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 121.828 2.104 . . . . 1.02 109.5 173.487 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -66.52 -55.13 16.95 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 119.294 -0.384 . . . . 2.86 111.752 -176.45 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.2 tptt -63.33 -25.51 68.34 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.868 -1.145 . . . . 6.56 113.823 175.121 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.754 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -67.7 -43.94 78.9 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 120.082 -1.637 . . . . 0.54 112.571 166.072 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 19.0 t -56.89 -39.93 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.317 1.417 . . . . 0.68 110.262 170.212 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.6 mt -58.61 -52.39 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-O 118.052 -0.975 . . . . 1.11 111.281 169.623 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.3 t -57.39 -36.34 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 125.248 1.419 . . . . 0.57 112.585 178.868 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.25 -41.01 74.07 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 121.268 -0.895 . . . . 0.96 111.877 174.128 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.16 -44.82 95.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 123.077 0.551 . . . . 0.65 111.041 176.076 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -62.72 -41.6 99.23 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 119.074 -0.488 . . . . 3.54 110.719 173.707 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.477 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 10.4 t30 -62.4 -23.91 67.1 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.408 1.262 . . . . 2.15 114.408 -174.585 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -78.02 -59.13 2.91 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.206 1.002 . . . . 1.88 111.063 169.666 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -62.31 -31.88 72.55 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.543 0.942 . . . . 2.12 113.543 -174.967 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.477 ' HD3' ' HA ' ' A' ' 18' ' ' ASN . 9.2 ptmt -56.4 -22.14 29.62 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 120.241 1.382 . . . . 2.67 114.148 176.746 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -88.72 -12.69 41.57 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.137 1.162 . . . . 2.73 114.137 175.98 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 28.8 m -117.43 169.85 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 120.094 1.316 . . . . 2.57 111.78 -179.004 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.2 m -85.75 137.61 32.68 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.214 -0.929 . . . . 3.77 113.203 177.193 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.6 tptm 14.74 62.72 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 128.45 2.7 . . . . 5.98 115.786 157.129 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 63.69 9.63 4.49 Favored 'General case' 0 CA--C 1.557 1.212 0 C-N-CA 127.598 2.359 . . . . 7.09 113.983 171.084 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.2 m -90.94 49.43 1.65 Allowed 'General case' 0 CA--C 1.542 0.668 0 O-C-N 119.957 -1.715 . . . . 4.7 114.389 -156.618 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 mt -60.51 21.48 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 130.785 3.634 . . . . 7.58 117.868 -167.995 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.6 p -157.72 -36.7 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 C-N-CA 130.027 3.331 . . . . 4.48 111.56 -176.463 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.88 -25.65 34.84 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 115.031 1.493 . . . . 8.5 115.031 177.489 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -164.23 151.8 12.16 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.009 1.324 . . . . 6.68 111.62 172.721 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.54 163.32 27.43 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.128 1.158 . . . . 7.09 114.128 -163.553 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 31.6 pt -87.62 151.95 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.646 0.778 . . . . 2.9 110.147 161.023 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 54.5 m -88.07 159.14 18.38 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.055 -1.028 . . . . 2.67 111.347 171.611 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -43.2 -35.07 1.27 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.365 1.866 . . . . 2.4 115.574 -179.451 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.5 m -56.42 -29.98 62.23 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.897 1.443 . . . . 2.04 114.897 174.153 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.1 m -81.33 -18.88 44.16 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.754 1.02 . . . . 1.24 113.754 -173.362 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 82' ' ' LEU . 63.8 t80 -64.85 -51.7 60.62 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.421 1.01 . . . . 2.1 110.932 174.164 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.4 ptt180 -65.23 -31.77 73.09 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.319 0.647 . . . . 2.17 112.458 179.673 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -70.45 -52.28 23.27 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.494 1.118 . . . . 3.9 110.057 174.741 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -50.25 -43.23 52.98 Favored 'General case' 0 N--CA 1.483 1.202 0 O-C-N 121.179 -0.951 . . . . 1.3 111.88 172.072 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.403 HD11 ' CZ ' ' A' ' 38' ' ' PHE . 12.6 mt -62.28 -15.31 46.7 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 115.921 1.823 . . . . 1.04 115.921 174.617 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -106.66 -7.75 17.21 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.314 1.416 . . . . 2.62 114.144 169.705 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -56.26 4.33 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.647 1.112 . . . . 3.12 110.97 160.809 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -85.64 -48.42 8.89 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.26 0.624 . . . . 2.63 111.624 -167.868 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 tt -106.14 50.24 0.78 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.14 1.376 . . . . 2.03 110.841 -168.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -94.5 -20.96 19.2 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 117.267 2.321 . . . . 1.35 117.267 -170.758 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.15 -26.8 39.18 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 121.786 2.085 . . . . 1.66 112.962 -177.071 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.1 tpp -65.94 24.84 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 128.965 2.906 . . . . 1.68 115.66 175.949 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.2 mp -109.62 128.3 55.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 128.108 2.563 . . . . 3.4 110.874 -173.611 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.7 m -106.22 -17.68 14.23 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.741 1.216 . . . . 4.18 112.789 172.765 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -177.15 166.58 2.39 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 129.24 3.016 . . . . 4.3 108.289 -173.389 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -27.59 -50.32 0.06 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 128.787 2.835 . . . . 2.28 112.754 156.415 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.31 -38.48 49.76 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.725 1.631 . . . . 1.56 114.484 -176.943 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -60.78 -33.01 72.32 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.317 1.058 . . . . 3.88 112.003 178.55 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.72 -39.7 18.2 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.754 1.222 . . . . 8.14 112.876 171.016 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.3 mmmt -61.38 -30.41 70.52 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 119.902 1.228 . . . . 3.28 112.814 179.862 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -48.78 -47.49 41.85 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.954 0.902 . . . . 1.21 112.789 165.73 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.41 -41.66 98.72 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.077 1.351 . . . . 0.73 112.241 174.692 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -61.41 -36.68 80.99 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.348 0.659 . . . . 2.27 112.566 178.077 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.9 mtmt -52.3 -37.77 56.65 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.437 1.017 . . . . 3.42 112.499 174.378 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 17.5 mt -72.27 -31.53 65.85 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.551 1.54 . . . . 0.85 112.992 -179.024 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.46 -36.26 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 118.555 0.616 . . . . 0.92 111.125 175.476 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -64.76 -50.25 67.56 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.29 1.436 . . . . 2.57 111.047 173.596 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -56.05 -29.95 61.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.99 0.916 . . . . 3.42 112.301 178.147 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.5 mt -89.25 -18.2 27.51 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 114.763 1.394 . . . . 2.77 114.763 177.189 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.36 -22.18 66.87 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.382 0.992 . . . . 3.85 112.665 169.999 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.9 -18.74 46.17 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.363 1.616 . . . . 2.65 115.363 168.892 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -129.95 -19.1 3.29 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 116.179 1.918 . . . . 2.84 116.179 -166.008 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -144.28 154.44 43.07 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.6 1.091 . . . . 4.88 113.267 -155.037 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.7 t0 99.38 158.38 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 129.848 3.259 . . . . 8.38 108.903 -176.404 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 74.1 -54.68 2.26 Favored Glycine 0 CA--C 1.533 1.186 0 O-C-N 120.561 -1.337 . . . . 3.58 110.999 -160.417 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -105.32 142.82 34.42 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.429 1.492 . . . . 6.09 110.541 158.311 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 40.6 mm -104.67 149.05 8.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 N-CA-C 107.769 -1.197 . . . . 2.46 107.769 163.229 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.4 t -125.41 145.55 50.01 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.28 1.032 . . . . 1.54 108.563 174.064 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -72.63 -51.72 18.4 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 122.418 1.104 . . . . 2.02 111.475 -170.51 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -42.66 -38.01 1.9 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 129.866 3.266 . . . . 3.24 114.416 170.799 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -67.53 -37.82 83.32 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.658 0.984 . . . . 4.93 113.658 -177.288 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -60.83 -47.92 84.15 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 120.54 1.518 . . . . 1.8 111.248 172.437 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -63.44 -39.59 94.89 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 119.102 -0.475 . . . . 0.54 110.817 -179.509 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 95.2 m -57.22 -52.74 64.12 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.425 1.49 . . . . 1.95 110.296 171.15 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 38' ' ' PHE . 27.8 mt -52.5 -44.33 65.61 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 118.247 -0.882 . . . . 0.84 113.293 178.378 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 30.3 mm -55.49 -37.0 43.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 120.072 1.305 . . . . 0.59 111.955 -175.585 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -64.09 -15.68 58.8 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 124.031 0.824 . . . . 0.6 114.447 176.773 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.73 -16.2 77.88 Favored Glycine 0 CA--C 1.534 1.236 0 CA-C-N 118.699 1.25 . . . . 0.86 113.682 172.006 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 mp -103.42 -53.31 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-N 118.638 1.219 . . . . 0.99 109.368 167.669 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.1 m -73.92 61.75 0.81 Allowed 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 128.002 2.521 . . . . 1.38 109.326 171.25 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -139.14 -78.3 0.06 OUTLIER Glycine 0 CA--C 1.527 0.812 0 C-N-CA 125.87 1.7 . . . . 0.89 110.017 174.066 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -58.8 -49.19 12.16 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.122 2.548 . . . . 0.99 111.669 179.034 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -75.95 -10.98 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 N-CA-C 114.105 1.15 . . . . 1.02 114.105 176.32 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.59 -38.12 74.01 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.213 -0.929 . . . . 1.16 112.641 -176.155 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -59.94 -39.73 86.54 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 120.432 1.469 . . . . 2.66 111.165 165.309 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.78 -38.13 74.92 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 124.301 1.041 . . . . 1.28 111.374 -178.667 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.5 mt -50.17 -57.77 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.623 1.101 . . . . 1.02 111.076 169.963 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 79.1 t60 -75.68 -5.15 44.17 Favored 'General case' 0 CA--C 1.552 1.028 0 N-CA-C 114.148 1.166 . . . . 1.76 114.148 -176.852 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.265 1.9 pt-20 -107.52 -11.43 15.49 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 119.841 -1.787 . . . . 3.2 114.014 167.461 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -83.63 -45.45 13.45 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.877 1.671 . . . . 2.58 110.13 171.144 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -73.71 11.49 0.83 Allowed 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 123.879 1.799 . . . . 2.88 111.524 176.185 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -120.35 -70.81 0.77 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.862 2.065 . . . . 2.01 110.411 165.878 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 50.13 7.65 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 130.316 3.446 . . . . 3.87 115.566 -178.184 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 33.4 t -157.84 19.88 0.26 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.836 1.254 . . . . 6.74 111.933 -164.624 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.1 p -83.08 0.9 42.9 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.469 1.907 . . . . 8.78 115.992 -172.39 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 41.0 m . . . . . 0 N--CA 1.481 1.111 0 C-N-CA 122.916 0.486 . . . . 11.22 110.653 -142.783 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 12.2 m . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 106.248 -1.76 . . . . 7.74 106.248 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -65.36 -100.33 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 117.937 -1.505 . . . . 6.3 107.168 110.83 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 67.1 m -122.59 -84.68 0.66 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.513 1.925 . . . . 3.93 109.413 159.84 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 124.08 165.79 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.366 1 C-N-CA 134.321 5.048 . . . . 2.54 108.806 -174.648 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 2.3 p -99.63 150.37 22.33 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.068 0.849 . . . . 1.0 109.477 162.343 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -69.57 -22.6 63.52 Favored 'General case' 0 C--O 1.212 -0.88 0 CA-C-O 117.545 -1.217 . . . . 2.96 112.643 178.232 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -53.79 53.38 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 121.954 2.161 . . . . 1.0 109.084 171.915 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -53.45 52.4 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 122.763 0.425 . . . . 2.56 110.897 -177.367 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -65.35 -27.37 68.53 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 120.969 -1.082 . . . . 7.4 113.858 177.045 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.754 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -66.19 -39.89 90.01 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.042 -1.661 . . . . 0.52 113.156 165.217 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 34.8 t -57.54 -39.79 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 120.718 1.599 . . . . 0.63 110.126 169.354 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 2.9 mt -58.38 -54.05 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-O 118.332 -0.842 . . . . 1.25 112.254 169.041 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 20.4 t -56.47 -44.04 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 125.903 1.681 . . . . 0.68 112.922 179.467 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 6.2 mp -64.46 -44.73 90.16 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.492 1.117 . . . . 1.08 110.967 178.244 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 55.8 t -65.73 -40.97 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 118.692 -0.67 . . . . 0.7 111.157 179.409 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -57.64 -42.76 84.07 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.773 0.715 . . . . 3.38 111.608 168.292 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.35 -23.98 67.09 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.016 1.487 . . . . 2.15 115.016 -175.344 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -79.36 -59.4 2.77 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.4 0.68 . . . . 2.12 111.065 168.71 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -61.98 -31.71 72.1 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.563 0.949 . . . . 2.12 113.563 -173.69 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -55.68 -21.25 17.33 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.318 1.447 . . . . 2.47 114.159 176.708 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -89.06 -15.38 34.16 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 114.096 1.147 . . . . 2.55 114.096 175.796 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 33.0 m -115.59 169.48 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-N 119.723 1.147 . . . . 2.61 111.919 -178.12 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 16.3 m -85.58 131.39 34.37 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 121.353 -0.842 . . . . 3.82 112.755 176.09 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 19.4 tptm 27.71 56.95 0.09 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.731 2.012 . . . . 5.96 115.272 147.579 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 66.51 7.77 5.3 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 127.589 2.356 . . . . 6.98 113.781 171.155 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 58.7 m -89.93 49.26 1.69 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.141 -1.599 . . . . 4.71 114.043 -156.42 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 3.8 mt -61.97 23.38 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 130.525 3.53 . . . . 7.66 117.41 -169.149 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 2.5 p -158.65 -36.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 C-N-CA 129.851 3.26 . . . . 4.41 111.622 -177.568 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.83 -25.29 32.77 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 115.066 1.506 . . . . 8.42 115.066 177.817 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -163.79 152.75 13.96 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.032 1.333 . . . . 6.78 111.865 173.358 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . 0.417 ' HZ3' ' CG ' ' B' ' 174' ' ' ASP . 0.0 OUTLIER -163.87 161.48 23.08 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.551 1.315 . . . . 7.04 114.551 -164.13 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 30.8 pt -85.85 155.32 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.708 0.803 . . . . 2.98 109.468 159.191 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 47.0 m -92.85 163.63 13.64 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.939 -1.101 . . . . 2.68 111.704 172.161 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -39.28 -41.05 0.84 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.691 1.996 . . . . 2.65 115.338 178.393 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 19.1 m -57.92 -29.56 65.21 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.349 1.24 . . . . 1.99 114.349 179.154 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 36.8 m -79.58 -21.13 45.43 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.777 1.029 . . . . 1.33 113.777 -173.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.434 ' CZ ' ' HB3' ' B' ' 185' ' ' LEU . 56.0 t80 -64.7 -52.42 57.26 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.187 0.903 . . . . 1.8 110.829 174.517 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -65.87 -31.72 72.83 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 122.974 0.51 . . . . 2.44 112.296 179.487 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -69.05 -51.22 41.18 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.888 0.875 . . . . 3.97 110.409 174.163 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -51.8 -42.82 62.77 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.552 1.141 . . . . 1.14 112.434 173.107 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 15.2 mt -60.12 -13.59 12.77 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.87 1.668 . . . . 1.06 115.492 173.415 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.26 -2.85 15.56 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.367 1.439 . . . . 2.65 114.061 170.488 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.52 -56.38 3.77 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.381 0.991 . . . . 3.15 110.756 159.653 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -88.38 -43.41 11.52 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 122.011 -0.43 . . . . 2.63 111.358 -166.578 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 1.1 tt -111.33 46.95 1.05 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.067 1.747 . . . . 2.06 110.643 -169.795 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -93.7 -14.21 26.6 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 116.303 1.964 . . . . 1.38 116.303 -170.872 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -88.57 -19.06 26.81 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 121.082 1.765 . . . . 1.46 112.311 -178.67 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 7.7 tpp -72.48 24.38 0.05 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 127.405 2.282 . . . . 1.69 114.158 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 9.6 mp -110.51 128.42 55.62 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 127.681 2.392 . . . . 3.33 110.761 -169.809 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 4.2 m -103.33 -21.58 13.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.665 1.186 . . . . 4.28 112.327 171.737 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -173.66 167.94 4.45 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.126 2.971 . . . . 4.57 107.978 -173.98 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -27.7 -49.64 0.05 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 128.491 2.716 . . . . 2.47 112.546 156.265 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -50.59 -38.83 36.5 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 126.017 1.77 . . . . 1.62 114.825 -177.63 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -62.1 -35.42 78.63 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.517 1.158 . . . . 3.87 111.855 179.567 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . 0.42 ' HA ' HH11 ' B' ' 159' ' ' ARG . 0.0 OUTLIER -84.01 -36.43 23.14 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.623 1.169 . . . . 8.57 112.544 172.37 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -61.06 -30.35 70.28 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.725 1.148 . . . . 3.39 113.171 175.566 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -52.7 -44.07 66.07 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.193 0.997 . . . . 1.1 112.816 167.577 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -65.01 -42.84 94.1 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.161 1.384 . . . . 0.67 111.446 173.323 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -61.29 -35.95 78.73 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.582 0.956 . . . . 2.05 113.582 178.314 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 27.5 mtmt -51.95 -37.98 54.87 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.411 1.005 . . . . 3.33 112.192 172.786 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 17.9 mt -72.03 -39.21 69.29 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 125.28 1.432 . . . . 0.68 113.015 -178.14 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 30.7 mm -52.27 -34.68 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 125.101 1.361 . . . . 0.9 111.98 175.825 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -61.94 -52.24 64.85 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.715 1.206 . . . . 2.71 111.617 173.953 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -63.2 -32.44 73.84 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.608 1.163 . . . . 3.57 112.478 177.649 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.09 -26.0 64.71 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.661 1.984 . . . . 3.19 111.947 172.43 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.06 -25.35 64.41 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.866 1.061 . . . . 3.69 113.866 172.242 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.65 -24.1 39.22 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.076 1.139 . . . . 2.61 114.076 174.23 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -121.92 -19.36 6.72 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 116.248 1.944 . . . . 2.72 116.248 -167.138 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -138.49 158.41 44.31 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.08 1.309 . . . . 4.77 114.147 -157.276 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . 0.417 ' CG ' ' HZ3' ' B' ' 135' ' ' LYS . 5.5 t0 98.35 157.9 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 129.698 3.199 . . . . 8.27 108.633 -179.231 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . 73.65 -58.23 2.1 Favored Glycine 0 CA--C 1.532 1.113 0 O-C-N 120.635 -1.291 . . . . 3.61 110.716 -159.493 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 -101.06 139.14 37.16 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.639 1.176 . . . . 6.1 110.662 157.886 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 42.0 mm -102.17 144.74 12.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 107.623 -1.251 . . . . 2.7 107.623 164.599 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 1.1 t -117.53 144.07 45.46 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.321 -0.992 . . . . 1.57 108.321 172.192 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -74.31 -52.84 11.05 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 122.891 1.329 . . . . 2.11 111.163 -171.867 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -42.89 -35.34 1.17 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 129.979 3.312 . . . . 3.19 114.927 168.056 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -67.31 -38.5 85.05 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.904 0.705 . . . . 4.66 112.904 -178.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -58.81 -48.34 81.63 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.122 -1.612 . . . . 1.91 111.168 172.202 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 27.7 t-105 -63.38 -41.29 98.78 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.85 0.46 . . . . 0.57 110.898 -178.706 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 90.1 m -56.06 -52.44 64.27 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.391 1.477 . . . . 1.97 110.354 172.102 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.434 ' HB3' ' CZ ' ' B' ' 141' ' ' PHE . 25.8 mt -56.6 -43.37 80.07 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 113.684 0.994 . . . . 0.71 113.684 179.635 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 28.5 mm -53.33 -38.85 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-N 120.22 1.373 . . . . 0.58 111.685 -178.254 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -63.61 -16.89 59.43 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.17 0.891 . . . . 0.56 114.295 177.89 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -80.72 -13.88 80.71 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 118.682 1.241 . . . . 0.89 113.713 172.685 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 3.3 mp -102.57 -54.85 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-N 118.758 1.279 . . . . 0.99 109.007 165.16 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 24.7 m -73.71 64.52 0.93 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 127.316 2.246 . . . . 1.54 108.935 171.582 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -143.64 -79.78 0.05 OUTLIER Glycine 0 CA--C 1.524 0.6 0 C-N-CA 125.601 1.572 . . . . 0.95 109.892 177.396 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -60.33 -46.72 16.9 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.027 2.485 . . . . 1.14 111.894 178.57 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 3.9 pt -77.42 -10.29 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 N-CA-C 114.023 1.12 . . . . 1.0 114.023 176.764 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . 0.405 ' HA ' HD12 ' B' ' 197' ' ' ILE . . . -68.45 -39.21 81.54 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 120.791 -1.193 . . . . 1.07 113.022 -176.804 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -59.4 -46.15 89.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.911 -1.118 . . . . 2.79 111.289 167.291 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 9.3 tt -53.07 -41.81 65.24 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 124.013 0.925 . . . . 1.8 111.487 179.199 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . 0.405 HD12 ' HA ' ' B' ' 194' ' ' ALA . 88.9 mt -49.76 -59.39 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 CA-C-N 119.521 1.055 . . . . 1.07 111.544 171.2 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -70.94 -15.92 62.62 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 120.809 -1.182 . . . . 1.71 113.429 -178.361 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -78.97 -12.67 60.04 Favored 'General case' 0 CA--C 1.551 0.984 0 O-C-N 120.468 -1.395 . . . . 3.69 112.187 167.534 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -111.72 -31.75 6.87 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.954 1.702 . . . . 3.6 114.439 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -63.77 -6.65 6.02 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 121.241 1.837 . . . . 2.62 111.922 164.37 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -108.12 -80.16 0.57 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 125.356 1.462 . . . . 2.03 111.272 168.206 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 57.91 -10.53 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 130.783 3.633 . . . . 3.84 115.433 -178.028 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 28.6 t -130.37 8.69 5.08 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.06 1.744 . . . . 6.51 112.154 -173.238 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 32.7 p -76.25 -7.12 54.18 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.811 1.244 . . . . 8.59 114.036 175.642 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 24.1 m . . . . . 0 N--CA 1.477 0.911 0 C-N-CA 123.364 0.666 . . . . 10.65 110.136 -146.5 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.572 0.225 . . . . 11.72 110.59 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -129.12 -9.6 4.79 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 122.125 0.965 . . . . 9.23 113.587 -161.134 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.4 m 139.6 -47.01 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.61 1 C-N-CA 135.204 5.401 . . . . 3.65 106.28 -162.721 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.83 12.48 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 127.848 2.459 . . . . 3.03 117.13 -175.426 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.3 p 53.19 -172.4 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.33 2.652 . . . . 2.06 111.21 -162.465 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -94.04 -40.63 9.98 Favored 'General case' 0 C--O 1.222 -0.388 0 O-C-N 120.902 -1.124 . . . . 2.77 110.865 158.044 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.12 -38.83 74.02 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.763 0.825 . . . . 0.93 111.02 -171.087 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -69.53 -62.92 1.19 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 118.631 -0.7 . . . . 2.53 111.105 -178.66 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -54.43 -29.76 50.38 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 120.429 1.468 . . . . 6.14 113.743 172.495 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.83 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -70.36 -43.78 69.45 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 120.186 1.357 . . . . 0.52 111.254 173.341 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 39.0 t -57.24 -42.61 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 121.008 1.731 . . . . 0.81 110.429 168.089 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.7 mt -55.32 -46.87 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-N 119.712 1.142 . . . . 1.09 111.55 171.344 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.0 t -64.41 -41.34 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 CA-C-N 120.234 1.379 . . . . 0.63 112.57 178.541 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.7 mp -64.21 -35.84 82.13 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 123.384 0.673 . . . . 0.97 111.308 175.01 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.1 t -73.66 -35.72 44.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.707 1.603 . . . . 0.9 112.176 175.018 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -61.04 -58.02 10.17 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.309 1.044 . . . . 3.73 109.987 176.435 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.448 HD21 ' CE ' ' A' ' 41' ' ' MET . 24.3 t30 -55.77 -14.96 2.62 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.17 1.544 . . . . 2.29 115.17 179.764 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -80.03 -66.07 0.92 Allowed 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.367 -1.458 . . . . 2.09 111.613 162.592 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -62.41 -26.95 68.76 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.174 1.176 . . . . 2.54 114.174 -172.724 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.567 ' HE3' ' CE1' ' A' ' 22' ' ' TYR . 5.7 ttpp -50.47 -19.94 1.0 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 126.802 2.041 . . . . 5.15 115.108 174.793 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.567 ' CE1' ' HE3' ' A' ' 21' ' ' LYS . 91.5 m-85 -103.7 -11.73 17.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.103 1.361 . . . . 2.77 114.103 177.15 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.4 m -91.54 -174.83 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 118.927 0.785 . . . . 3.07 110.877 176.036 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.4 m -141.2 124.64 16.67 Favored 'General case' 0 C--O 1.238 0.476 0 O-C-N 120.501 -1.374 . . . . 4.87 109.665 152.543 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.8 tptt 51.25 28.16 4.01 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.059 1.344 . . . . 7.4 113.166 174.317 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 81.19 2.74 1.59 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 127.765 2.426 . . . . 8.44 115.058 168.449 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.8 t -144.41 -41.05 0.26 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.436 1.273 . . . . 5.88 114.436 -175.739 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -17.88 63.6 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.896 1.073 . . . . 10.86 113.896 -172.622 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.1 t 21.4 70.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 129.575 3.15 . . . . 8.26 114.256 -173.232 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.1 mmmm -61.7 -37.87 85.75 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.311 -0.868 . . . . 11.14 113.333 -170.213 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -78.76 -32.83 46.79 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 118.74 -0.648 . . . . 10.74 111.403 -178.972 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 34.0 mttp 73.73 72.87 0.12 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.493 1.917 . . . . 9.2 109.416 179.436 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 6.8 tt -75.93 66.92 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 123.207 1.48 . . . . 2.71 108.961 174.2 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.3 m -64.44 165.64 9.52 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 114.803 -1.089 . . . . 2.73 109.06 169.42 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.488 ' HB3' HG23 ' A' ' 63' ' ' ILE . 3.6 mppt? -45.37 -33.75 2.68 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.941 1.089 . . . . 2.51 113.941 173.486 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 6.9 m -58.44 -33.76 70.07 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.893 1.442 . . . . 2.03 114.893 174.707 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.0 m -85.62 -37.64 19.29 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.087 0.858 . . . . 1.31 111.72 -177.859 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.487 ' CE2' HD11 ' A' ' 42' ' ' LEU . 79.7 t80 -58.57 -49.52 77.12 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.295 -0.878 . . . . 2.44 111.818 179.177 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -59.78 -29.65 68.35 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.107 1.151 . . . . 3.15 114.107 177.771 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -86.29 -51.1 6.46 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.746 1.618 . . . . 3.39 110.312 -176.242 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . 0.448 ' CE ' HD21 ' A' ' 18' ' ' ASN . 15.4 tmm? -51.25 -37.27 46.16 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.751 1.22 . . . . 1.5 112.439 170.411 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.487 HD11 ' CE2' ' A' ' 38' ' ' PHE . 16.8 mt -70.29 -4.44 22.0 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 116.282 1.956 . . . . 1.55 116.282 174.618 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -103.7 -4.29 23.92 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.489 1.495 . . . . 2.23 114.009 163.11 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.31 -54.11 3.53 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.19 0.996 . . . . 1.88 113.027 168.776 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -84.91 -22.45 29.28 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.199 1.555 . . . . 3.14 115.199 -166.205 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.403 HD23 ' HG3' ' B' ' 112' ' ' GLU . 1.9 mt -126.73 50.55 1.93 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.889 2.076 . . . . 1.89 108.504 -177.488 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -91.13 -23.14 20.37 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.519 1.303 . . . . 1.59 114.519 -166.323 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.423 ' NE2' ' HA ' ' B' ' 108' ' ' TYR . 22.7 m-70 -90.91 -33.93 15.41 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.285 1.034 . . . . 1.45 112.464 -170.785 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.7 ptp -66.91 -4.51 9.61 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.343 1.457 . . . . 3.21 114.275 173.756 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.3 tp -76.11 117.57 17.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 125.961 1.704 . . . . 3.01 111.837 -161.163 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.1 m -75.61 56.62 0.91 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.89 -1.131 . . . . 5.14 111.348 161.19 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.565 ' CG ' ' H ' ' A' ' 53' ' ' THR . 33.4 t70 52.32 -150.52 0.32 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 127.806 2.443 . . . . 4.66 113.913 175.467 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.565 ' H ' ' CG ' ' A' ' 52' ' ' ASP . 52.7 p -54.82 -32.46 60.47 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 127.953 2.501 . . . . 2.53 112.092 170.192 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.91 -50.89 52.9 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 124.431 1.015 . . . . 1.67 111.583 174.949 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.23 -36.95 82.75 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 117.492 0.646 . . . . 3.53 112.603 173.481 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.475 HH22 ' HB3' ' A' ' 42' ' ' LEU . 2.0 mmp_? -56.01 -34.15 65.54 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.417 -1.427 . . . . 5.5 113.089 -178.369 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -64.37 -22.25 66.89 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.858 1.429 . . . . 4.03 114.858 173.165 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.83 -17.93 59.65 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.589 1.156 . . . . 1.11 114.081 169.143 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -79.41 -51.04 9.91 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.257 0.935 . . . . 0.75 110.804 163.971 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -70.49 -23.31 62.65 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.757 1.021 . . . . 2.32 113.757 -174.918 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -56.43 -30.06 62.37 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.524 1.511 . . . . 3.18 112.464 167.091 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.475 ' HB3' HD22 ' A' ' 82' ' ' LEU . 15.7 mt -81.01 -32.65 34.12 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.663 0.785 . . . . 1.13 112.109 -179.039 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.488 HG23 ' HB3' ' A' ' 35' ' ' LYS . 27.0 mm -60.36 -49.68 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.115 1.366 . . . . 1.02 111.489 174.858 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -64.05 -38.01 89.5 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.347 0.659 . . . . 2.22 112.074 175.794 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -61.97 -30.95 71.27 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.95 0.9 . . . . 3.33 112.876 175.221 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.7 mt -88.51 -19.4 26.47 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 114.847 1.425 . . . . 2.49 114.847 169.992 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -20.26 64.13 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.884 1.674 . . . . 3.64 112.122 170.481 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.37 -17.68 51.23 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.556 1.687 . . . . 2.18 115.556 166.61 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -118.22 -21.83 7.99 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.673 1.578 . . . . 2.88 114.476 -174.272 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.05 160.61 42.98 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.503 1.047 . . . . 4.35 112.115 -162.674 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -98.27 -116.05 0.14 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.432 1.893 . . . . 6.12 111.829 -175.108 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -90.24 -3.33 72.73 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 125.425 1.488 . . . . 4.63 113.471 159.07 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.4 mmt-85 -84.48 165.44 18.1 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.314 1.557 . . . . 8.36 112.304 164.538 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 1.3 pp -149.56 156.06 7.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 130.264 3.426 . . . . 3.46 107.787 174.109 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.4 t -97.77 175.32 6.21 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.588 1.155 . . . . 1.71 112.27 167.047 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -66.51 -54.61 21.97 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.366 1.066 . . . . 2.52 112.643 178.295 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.52 -30.42 70.62 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 126.232 1.813 . . . . 2.98 111.655 -175.936 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -64.3 -54.38 34.09 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 117.79 -1.1 . . . . 3.94 111.014 175.415 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -50.9 -48.14 60.53 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 120.642 1.564 . . . . 2.44 111.955 177.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 37.8 t-105 -60.94 -43.13 99.08 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 119.292 -0.385 . . . . 0.69 111.54 179.659 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 87.2 m -60.87 -39.5 89.4 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.398 1.479 . . . . 1.82 111.966 173.17 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.475 HD22 ' HB3' ' A' ' 62' ' ' LEU . 94.1 mt -60.68 -55.39 33.81 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-O 118.121 -0.942 . . . . 0.83 110.35 177.013 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.4 mm -47.52 -42.36 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 CA-C-N 119.583 1.083 . . . . 0.83 112.919 -176.82 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.15 -30.06 69.77 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-O 118.943 -0.92 . . . . 0.72 113.292 177.479 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -80.14 -21.64 64.81 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 118.259 -1.301 . . . . 0.58 115.423 -177.366 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 2.0 mp -86.14 -39.67 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 CA-C-N 119.231 1.515 . . . . 1.32 110.587 168.537 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 33.8 m -69.73 -39.91 76.53 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.979 1.711 . . . . 3.26 111.549 -174.671 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -27.49 -67.02 0.07 OUTLIER Glycine 0 CA--C 1.535 1.332 0 C-N-CA 128.241 2.829 . . . . 1.09 116.391 -175.396 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.8 -33.56 2.18 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.147 2.565 . . . . 0.97 113.41 -173.626 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.4 pt -82.72 -20.97 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 118.981 0.81 . . . . 1.4 113.177 -175.987 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -52.68 -50.29 63.58 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.072 2.149 . . . . 0.94 113.107 -178.175 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.407 ' HE3' ' CD2' ' B' ' 129' ' ' TYR . 49.9 mtpt -48.11 -53.7 15.73 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.744 0.783 . . . . 3.6 110.981 172.888 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.95 -38.35 76.1 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 118.211 -0.9 . . . . 2.1 111.549 -172.925 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 25.7 mt -47.6 -62.87 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.458 1.103 . . . . 1.91 111.4 165.996 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -59.8 -42.37 93.28 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.959 0.8 . . . . 1.86 111.245 -177.164 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . 0.394 3.3 pt-20 -77.32 -9.01 58.57 Favored 'General case' 0 CA--C 1.55 0.972 0 O-C-N 121.226 -0.921 . . . . 2.87 112.534 -178.505 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -88.17 -26.59 22.34 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 116.589 2.07 . . . . 2.34 116.589 165.096 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -68.74 0.25 4.51 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 120.62 1.554 . . . . 2.94 111.576 169.866 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -129.01 -64.11 0.93 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.682 2.393 . . . . 3.26 110.84 -176.213 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . 0.263 7.7 pt20 55.32 21.42 4.14 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 128.5 2.72 . . . . 4.47 115.529 173.037 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.1 m -152.54 37.32 0.52 Allowed 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.361 -1.462 . . . . 6.62 111.496 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.5 t -112.95 15.62 19.64 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.481 1.112 . . . . 8.82 112.872 176.771 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 75.0 m . . . . . 0 C--O 1.246 0.878 0 C-N-CA 129.815 3.246 . . . . 10.26 109.151 -177.3 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 9.2 m . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 110.158 -0.312 . . . . 11.99 110.158 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -129.01 -11.0 4.79 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 113.971 1.1 . . . . 8.98 113.971 -157.958 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 63.5 m 116.94 -27.92 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.903 1 C-N-CA 133.339 4.655 . . . . 3.67 108.126 -156.777 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.423 ' HA ' ' NE2' ' A' ' 48' ' ' HIS . 0.3 OUTLIER -70.82 19.91 0.05 OUTLIER 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 128.085 2.554 . . . . 3.04 115.446 179.538 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 14.2 p 47.41 -161.0 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 127.974 2.509 . . . . 2.39 111.081 -153.93 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -102.28 -33.99 9.39 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 120.082 1.31 . . . . 2.62 111.487 149.071 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.11 -42.17 72.61 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.337 0.655 . . . . 0.87 109.763 -169.727 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . 0.403 ' HG3' HD23 ' A' ' 46' ' ' LEU . 17.1 tt0 -64.43 -64.11 0.96 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.499 -1.238 . . . . 2.55 111.485 176.464 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -51.84 -31.79 29.18 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 121.762 2.074 . . . . 6.75 114.095 177.155 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.83 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -74.55 -41.34 60.75 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.789 1.177 . . . . 0.72 112.501 174.983 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 39.5 t -60.0 -42.91 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-N 120.55 1.523 . . . . 1.07 110.107 166.71 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . . . . . . . . . 6.3 mt -54.36 -48.79 67.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-O 117.812 -1.089 . . . . 1.28 109.919 171.061 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 2.6 t -60.59 -43.06 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 120.643 1.565 . . . . 0.81 112.859 177.677 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 3.6 mp -60.44 -41.99 95.19 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.958 0.799 . . . . 1.16 111.997 173.939 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 40.2 t -69.39 -41.23 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 125.477 1.511 . . . . 1.11 111.985 177.659 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.91 -57.07 14.18 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 124.401 1.081 . . . . 4.11 108.326 179.235 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -52.43 -24.75 8.41 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.461 1.282 . . . . 2.29 114.461 -178.775 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -74.08 -62.96 1.33 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.453 1.024 . . . . 2.25 112.079 168.672 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -62.49 -25.77 68.18 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.298 0.851 . . . . 2.62 113.298 -176.294 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -43.56 -30.27 0.57 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.345 2.658 . . . . 3.01 115.338 172.062 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -96.21 -13.3 23.58 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.999 1.111 . . . . 2.67 113.999 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' B' ' 132' ' ' VAL 0.256 4.4 m -87.38 -161.74 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 121.893 0.854 . . . . 3.03 111.898 -174.179 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 3.3 m -156.4 124.42 5.63 Favored 'General case' 0 C--O 1.238 0.489 0 O-C-N 120.341 -1.474 . . . . 4.95 108.963 154.105 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 36.2 tptt 44.39 31.59 0.61 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.341 1.856 . . . . 7.62 113.566 -179.483 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . 0.407 ' CD2' ' HE3' ' A' ' 92' ' ' LYS . 16.0 m-85 75.87 6.66 3.8 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 127.101 2.16 . . . . 8.46 114.453 171.085 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 11.6 t -143.7 -41.95 0.28 Allowed 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 115.007 1.484 . . . . 5.94 115.007 -177.246 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.09 -30.01 67.12 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.246 -0.909 . . . . 11.02 112.456 -173.738 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' B' ' 126' ' ' VAL . 9.0 t 42.22 69.77 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 127.377 2.271 . . . . 8.37 112.788 -179.412 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 6.8 mmmm -61.18 -36.98 81.3 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.584 0.957 . . . . 11.17 113.584 -169.597 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -26.01 40.55 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.805 0.73 . . . . 10.94 111.688 179.539 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 32.6 mttp 70.58 63.95 0.19 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.202 1.801 . . . . 9.28 109.655 176.373 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 4.4 tt -72.99 66.49 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.173 1.389 . . . . 2.53 110.12 179.52 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 10.5 m -61.79 160.63 11.55 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.188 -0.914 . . . . 2.81 109.406 165.192 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . 0.548 ' HB3' HG23 ' B' ' 166' ' ' ILE . 2.4 mppt? -43.71 -31.83 0.88 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 115.461 1.652 . . . . 2.48 115.461 177.103 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 15.7 m -55.07 -34.88 63.97 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.628 1.571 . . . . 1.94 115.067 173.836 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 49.5 m -78.55 -41.54 31.8 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.726 1.148 . . . . 1.31 111.947 -179.936 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.489 ' CE2' HD11 ' B' ' 145' ' ' LEU . 79.9 t80 -57.74 -45.84 85.28 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 120.997 -1.064 . . . . 2.21 112.401 -177.191 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -63.24 -27.84 69.63 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.929 1.085 . . . . 3.37 113.929 177.675 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -87.19 -49.67 7.13 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 124.445 1.098 . . . . 3.38 109.629 -177.681 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 14.4 tmm? -50.21 -37.65 36.38 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.741 2.017 . . . . 1.38 113.127 171.63 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . 0.489 HD11 ' CE2' ' B' ' 141' ' ' PHE . 17.5 mt -68.7 -0.6 5.48 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 116.799 2.148 . . . . 1.72 116.799 174.037 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -114.94 11.2 16.5 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.087 1.143 . . . . 2.05 114.087 161.221 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.44 -56.8 2.21 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.816 1.246 . . . . 1.84 112.993 166.806 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -75.97 -27.21 57.42 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 121.009 -1.057 . . . . 2.63 113.704 -173.014 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 2.2 mt -128.3 56.1 1.64 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 127.023 2.129 . . . . 1.85 107.929 -172.307 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -102.58 -15.76 16.29 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.481 1.512 . . . . 1.33 115.022 -166.398 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -94.96 -34.9 12.2 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 120.96 -1.087 . . . . 1.4 110.957 179.394 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 9.6 ptp -68.0 -3.06 8.85 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.533 0.938 . . . . 3.13 113.533 166.129 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 28.5 tp -71.72 105.5 3.75 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.124 -0.985 . . . . 2.85 111.049 -170.116 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 5.4 m -79.78 54.25 1.8 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.157 0.98 . . . . 4.75 111.323 169.556 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . 0.583 ' CG ' ' H ' ' B' ' 156' ' ' THR . 27.4 t70 53.23 -153.75 0.25 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 128.551 2.74 . . . . 4.78 115.018 171.786 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . 0.583 ' H ' ' CG ' ' B' ' 155' ' ' ASP . 41.4 p -54.9 -36.36 65.09 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 128.671 2.789 . . . . 2.83 112.176 175.61 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.8 -46.73 89.65 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 123.811 0.719 . . . . 1.85 111.604 175.75 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -72.26 -34.36 68.18 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.042 0.937 . . . . 3.44 113.188 174.059 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . 0.458 HH22 ' HB3' ' B' ' 145' ' ' LEU . 2.1 mmp_? -58.49 -35.02 71.57 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.252 -1.53 . . . . 5.54 112.596 177.182 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -63.34 -25.65 68.4 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 115.23 1.567 . . . . 4.27 115.23 171.5 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -76.37 -18.38 58.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.134 1.161 . . . . 1.05 114.134 170.787 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -79.33 -52.75 7.7 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.179 0.9 . . . . 0.84 110.708 163.043 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -68.39 -25.05 64.86 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 113.335 0.865 . . . . 2.09 113.335 -174.091 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -57.87 -30.39 65.78 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.327 -1.483 . . . . 2.93 112.615 168.747 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . 0.453 ' HB3' HD22 ' B' ' 185' ' ' LEU . 15.9 mt -80.79 -29.87 36.03 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.314 0.646 . . . . 1.1 112.104 -177.879 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . 0.548 HG23 ' HB3' ' B' ' 138' ' ' LYS . 36.2 mm -61.13 -51.06 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.172 1.389 . . . . 1.0 111.049 174.77 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -66.01 -35.81 81.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.76 0.824 . . . . 2.16 112.604 176.348 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -62.4 -35.91 80.67 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.81 0.844 . . . . 3.24 112.03 173.763 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . . . . . . . . . 3.6 tp -86.71 -21.39 26.65 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.593 0.96 . . . . 3.17 113.593 178.211 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -63.05 -23.65 67.55 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.894 0.877 . . . . 3.67 112.376 173.458 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -70.13 -11.24 60.75 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.761 1.393 . . . . 2.33 114.761 169.623 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -125.46 -23.39 4.11 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.274 1.213 . . . . 2.86 114.274 -172.417 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.26 158.16 43.5 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.433 -0.792 . . . . 4.2 112.743 -160.229 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -103.19 -118.13 0.2 Allowed 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 127.392 2.277 . . . . 6.02 111.737 -172.392 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -87.41 -4.88 80.03 Favored Glycine 0 CA--C 1.534 1.279 0 CA-C-O 118.265 -1.297 . . . . 4.56 113.703 159.869 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 8.6 mmt-85 -83.17 164.82 19.95 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 119.783 1.791 . . . . 8.47 112.282 162.62 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . . . . . . . . . 1.6 pp -146.67 153.89 12.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 129.628 3.171 . . . . 3.72 107.099 173.02 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 8.4 t -97.98 176.51 5.75 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.974 0.909 . . . . 1.62 111.43 166.246 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -74.35 -52.29 12.63 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.428 0.899 . . . . 2.41 113.428 -176.39 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -58.6 -29.28 66.33 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.453 1.901 . . . . 3.17 111.548 -179.485 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -64.5 -55.93 17.42 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-O 118.027 -0.987 . . . . 4.0 110.811 175.345 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -50.24 -49.01 54.29 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.422 1.464 . . . . 2.41 112.497 178.949 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -62.52 -40.66 97.47 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.926 0.49 . . . . 0.69 111.708 179.958 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 97.9 m -64.09 -37.6 88.03 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.434 1.494 . . . . 1.9 111.706 173.298 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . 0.453 HD22 ' HB3' ' B' ' 165' ' ' LEU . 87.5 mt -60.13 -51.22 70.52 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.21 0.914 . . . . 0.77 110.523 175.624 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 47.4 mm -46.3 -42.26 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-N 119.631 1.105 . . . . 0.69 113.078 -177.589 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -62.14 -31.65 79.65 Favored Glycine 0 CA--C 1.533 1.212 0 CA-C-O 119.193 -0.781 . . . . 0.82 113.467 178.732 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -75.38 -24.75 69.93 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-N 118.826 1.313 . . . . 0.69 114.528 -177.011 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -87.8 -37.51 10.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 CA-C-N 118.682 1.241 . . . . 1.48 111.471 169.03 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 22.8 m -80.81 -40.0 25.7 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.482 1.113 . . . . 3.31 112.612 -169.325 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -45.08 -48.18 9.92 Favored Glycine 0 CA--C 1.538 1.526 0 CA-C-O 117.416 -1.769 . . . . 0.94 116.249 -172.926 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.52 -32.88 7.4 Favored 'Trans proline' 0 C--N 1.353 0.809 0 CA-C-N 121.05 2.425 . . . . 1.09 113.05 -179.738 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 41.2 pt -85.14 -20.44 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 113.218 0.822 . . . . 1.25 113.218 179.979 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -51.89 -45.78 64.29 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 127.399 2.28 . . . . 0.87 111.967 -178.033 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -55.27 -49.18 72.73 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.11 0.564 . . . . 3.76 111.222 175.399 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.09 -35.49 61.78 Favored 'General case' 0 C--O 1.222 -0.373 0 O-C-N 121.228 -0.92 . . . . 2.1 111.675 -175.469 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 27.2 mt -48.75 -62.43 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.82 1.248 . . . . 1.75 110.421 166.457 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -60.25 -45.04 94.63 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.931 -0.481 . . . . 1.9 111.041 -176.242 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . 0.383 3.1 pt-20 -78.39 -8.06 58.04 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.406 0.521 . . . . 2.78 112.406 -174.401 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.88 -27.8 44.04 Favored 'General case' 0 C--N 1.346 0.452 0 C-N-CA 126.551 1.941 . . . . 2.33 115.324 162.905 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -74.19 5.52 4.36 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 121.055 1.752 . . . . 2.43 111.159 172.57 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -127.94 -67.85 0.8 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 127.435 2.294 . . . . 2.44 110.144 -176.991 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 56.2 12.01 0.89 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 129.806 3.242 . . . . 4.42 115.803 167.441 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 72.1 m -155.95 33.12 0.35 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.566 1.146 . . . . 6.48 111.838 -176.377 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 33.3 t -104.89 8.15 34.58 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 120.926 -1.109 . . . . 8.79 112.96 169.108 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 34.8 m . . . . . 0 C--O 1.248 0.976 0 C-N-CA 127.685 2.394 . . . . 9.9 108.963 -179.843 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.1 m . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 112.246 0.462 . . . . 10.12 112.246 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -88.09 -120.69 0.05 OUTLIER 'General case' 0 CA--C 1.559 1.327 0 O-C-N 124.896 1.373 . . . . 7.2 109.137 140.968 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 94.5 m -95.75 33.19 1.7 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.481 2.313 . . . . 3.98 114.23 -167.233 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -57.74 130.36 46.09 Favored 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 126.163 1.785 . . . . 2.43 113.45 -161.86 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.4 p -70.81 159.37 34.7 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 125.275 1.43 . . . . 1.2 111.928 -174.692 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -61.76 -39.5 91.82 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 120.469 1.486 . . . . 2.37 112.904 -178.425 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.19 -47.25 81.73 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.671 0.748 . . . . 0.77 110.469 175.082 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.66 -52.4 31.6 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.835 0.854 . . . . 2.9 111.726 -177.044 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -56.73 -32.09 65.19 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 119.842 -1.786 . . . . 5.03 113.765 169.731 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.868 ' HB1' ' HB1' ' B' ' 114' ' ' ALA . . . -65.63 -39.88 91.96 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 120.745 -1.222 . . . . 0.5 111.634 172.693 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 95.4 t -59.0 -33.67 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-N 119.401 1.001 . . . . 0.64 111.074 166.063 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.7 mt -58.54 -59.08 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 CA-C-N 120.469 1.486 . . . . 0.94 111.558 164.139 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 23.1 t -55.02 -38.6 46.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.149 1.38 . . . . 0.64 112.926 -176.945 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 mp -65.7 -27.61 68.46 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.465 -1.397 . . . . 0.92 112.563 174.36 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.0 t -94.87 -19.72 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.137 1.375 . . . . 1.03 111.343 -179.552 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -59.8 -54.24 48.52 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 120.342 1.428 . . . . 4.01 110.083 153.573 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.434 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 25.8 t30 -54.18 -34.29 60.15 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 118.921 0.782 . . . . 2.24 112.948 -178.344 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -80.32 -48.51 12.88 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.243 0.831 . . . . 2.19 113.243 174.144 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -73.5 -22.29 60.18 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 114.23 1.196 . . . . 2.62 114.23 -173.039 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.434 ' HD2' ' HA ' ' A' ' 18' ' ' ASN . 9.3 ptmt -48.86 -34.98 13.64 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 120.872 1.669 . . . . 2.77 113.064 176.134 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -74.4 -40.27 62.14 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 114.03 1.122 . . . . 2.52 114.03 178.529 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.454 ' HB ' ' H ' ' A' ' 28' ' ' LEU . 16.6 m -79.98 -16.4 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 CA-C-N 118.921 0.782 . . . . 3.03 112.244 177.025 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.3 m 68.69 -59.61 0.46 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 128.973 2.909 . . . . 5.6 111.995 -173.211 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 tmtm? -178.73 -38.78 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 127.486 2.314 . . . . 6.0 112.149 -169.136 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -118.01 -23.95 7.24 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.911 1.819 . . . . 7.46 115.911 -171.516 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.8 m -67.0 -37.73 84.73 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.109 1.322 . . . . 6.69 113.438 -170.435 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.454 ' H ' ' HB ' ' A' ' 23' ' ' VAL . 90.2 mt 48.45 -79.97 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 129.216 3.006 . . . . 6.99 113.778 172.608 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -140.5 -19.6 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 126.775 2.03 . . . . 3.69 113.359 175.706 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.417 ' O ' ' HE2' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -57.05 -33.82 67.63 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.9 -1.125 . . . . 8.68 112.896 166.456 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -132.26 68.7 1.49 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 122.605 1.193 . . . . 7.02 111.594 166.739 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.16 159.94 32.03 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 126.516 1.926 . . . . 6.52 113.849 176.067 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.7 pt -71.71 -173.21 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 127.16 2.184 . . . . 2.13 115.123 -174.722 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 97.6 p -101.02 140.75 34.89 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 120.692 -1.255 . . . . 3.53 108.375 152.879 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.413 ' HE2' HD12 ' A' ' 66' ' ' LEU . 14.8 mttt -71.44 -18.95 62.29 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.19 -0.944 . . . . 2.75 112.582 -171.846 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.9 m -48.43 -30.34 4.97 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.264 1.026 . . . . 2.29 113.621 159.323 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 t -65.28 -35.16 80.17 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 117.477 -1.249 . . . . 2.6 111.761 176.443 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -59.3 -48.89 79.94 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 120.929 1.695 . . . . 1.8 111.844 174.881 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.0 ptt85 -62.97 -29.74 71.04 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.346 0.976 . . . . 4.39 111.463 176.606 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -83.96 -39.84 19.25 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 114.008 1.114 . . . . 3.11 114.008 -175.874 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' MET . . . . . . . . . . . . . 2.7 tmm? -51.67 -47.8 63.68 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 126.331 1.853 . . . . 1.7 110.67 162.379 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -55.47 -50.82 68.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.487 0.585 . . . . 1.05 112.393 169.227 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -79.14 -9.17 59.48 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 115.758 1.762 . . . . 3.03 115.758 -175.786 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -98.16 -51.68 3.93 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.256 1.423 . . . . 1.44 114.078 167.724 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -89.67 -43.21 10.89 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.093 0.957 . . . . 2.9 111.966 -168.9 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.58 38.55 2.13 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.049 1.34 . . . . 1.9 110.742 -168.526 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -96.55 -17.78 20.24 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 116.085 1.883 . . . . 2.36 116.085 -149.257 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 -92.17 -38.9 11.87 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.446 1.498 . . . . 1.94 113.142 -162.939 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 68.4 mtm -77.0 -18.9 57.89 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.021 -1.049 . . . . 2.75 113.367 170.479 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.1 tt -56.52 -31.24 63.93 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.128 0.971 . . . . 5.8 112.68 -155.401 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.1 m 83.5 109.66 0.06 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.349 2.26 . . . . 5.15 111.494 169.477 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 t70 66.42 -163.14 0.24 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.904 1.682 . . . . 4.44 113.669 168.169 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.4 m -87.14 -31.56 20.34 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.274 1.429 . . . . 2.24 109.913 157.03 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -54.2 -42.21 72.22 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 124.793 1.187 . . . . 1.98 114.154 -174.773 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -76.38 -20.62 56.98 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.902 1.351 . . . . 4.73 112.955 177.983 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.6 mtt85 -69.72 -37.92 76.72 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.0 -1.688 . . . . 7.06 112.43 164.279 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 mmmt -59.07 -40.35 84.94 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.417 1.008 . . . . 4.27 111.373 170.411 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.48 ' HA ' ' HE3' ' A' ' 61' ' ' LYS . . . -59.14 -40.44 85.48 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 117.833 -1.08 . . . . 1.67 113.739 173.143 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.412 ' HB2' HG12 ' A' ' 86' ' ' ILE . . . -58.04 -46.88 84.64 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.663 1.185 . . . . 1.01 112.368 167.32 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -62.79 -34.06 76.49 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.036 0.934 . . . . 2.43 112.891 -175.681 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.48 ' HE3' ' HA ' ' A' ' 58' ' ' ALA . 8.0 mtmp? -47.69 -44.0 27.1 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 122.979 1.371 . . . . 2.99 113.102 169.488 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.1 mt -69.36 -43.05 74.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 113.615 -1.629 . . . . 1.01 110.491 -174.708 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.1 mm -53.8 -54.57 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.669 1.588 . . . . 1.27 110.56 178.806 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -64.13 -37.75 88.58 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 123.699 0.799 . . . . 2.83 112.377 -178.001 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -44.34 82.46 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 121.512 0.672 . . . . 3.77 112.232 168.355 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.413 HD12 ' HE2' ' A' ' 35' ' ' LYS . 0.2 OUTLIER -72.21 -34.06 68.08 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.012 0.925 . . . . 2.39 110.922 -174.429 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -77.78 -30.92 51.64 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.829 1.048 . . . . 3.57 113.829 171.26 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.27 -31.63 58.38 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.852 1.056 . . . . 2.85 113.852 176.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.51 57.94 1.19 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.484 1.113 . . . . 4.31 113.084 -173.49 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.77 5.05 0.06 Allowed 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 116.594 2.072 . . . . 4.41 116.594 167.301 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.0 t70 59.65 -150.36 0.43 Allowed 'General case' 0 CA--C 1.557 1.216 0 CA-C-N 120.004 1.274 . . . . 4.0 110.102 -175.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -93.91 11.63 70.6 Favored Glycine 0 CA--C 1.533 1.183 0 O-C-N 119.962 -1.711 . . . . 2.48 112.603 158.231 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.2 mmt-85 -80.28 70.71 6.98 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.524 1.662 . . . . 4.62 111.452 -176.931 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.8 mt -63.33 139.47 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 124.766 1.226 . . . . 2.17 109.814 174.614 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.5 m -117.23 158.74 23.79 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.321 1.048 . . . . 1.64 109.817 168.351 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -46.23 -47.73 17.91 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 123.151 1.453 . . . . 1.84 112.247 172.689 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.21 -16.99 63.1 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 129.4 3.08 . . . . 3.15 112.74 -175.303 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -58.47 -59.27 5.63 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.466 1.106 . . . . 4.28 110.812 175.335 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -55.33 -47.67 75.32 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.567 -0.708 . . . . 1.92 111.152 -178.473 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -62.56 -47.01 85.72 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.485 0.55 . . . . 0.55 112.485 -178.365 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 1.3 t -69.78 -39.61 76.55 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.503 0.721 . . . . 1.56 111.758 -179.538 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 44.2 mt -58.1 -46.13 86.05 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 118.001 -0.999 . . . . 0.83 111.85 175.442 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 20.9 mm -50.56 -37.26 15.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 CA-C-N 119.549 1.068 . . . . 0.95 112.775 -178.007 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.01 -20.07 47.74 Favored Glycine 0 CA--C 1.537 1.406 0 CA-C-N 119.686 1.13 . . . . 0.94 114.189 176.258 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.99 0.78 82.12 Favored Glycine 0 CA--C 1.532 1.124 0 O-C-N 120.743 -1.445 . . . . 0.97 114.48 175.32 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.412 HG12 ' HB2' ' A' ' 59' ' ' ALA . 0.7 OUTLIER -134.72 -45.44 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 126.193 1.797 . . . . 1.0 110.668 174.752 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 95.5 m -76.18 71.3 2.9 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.677 1.991 . . . . 1.45 107.131 163.024 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -149.77 -77.98 0.02 OUTLIER Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.212 1.387 . . . . 0.96 111.077 -179.711 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -62.23 -34.14 79.21 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 123.227 2.618 . . . . 1.46 113.617 -176.634 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -82.95 0.06 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 N-CA-C 114.549 1.314 . . . . 1.37 114.549 179.839 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -35.88 -61.06 0.5 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.329 2.651 . . . . 2.34 115.756 -176.158 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.51 -40.33 65.33 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.024 -1.047 . . . . 4.43 111.719 176.296 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 5.3 tt -66.73 -42.29 86.52 Favored 'General case' 0 C--O 1.223 -0.309 0 C-N-CA 123.432 0.693 . . . . 2.14 109.898 -176.704 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.7 mt -51.29 -54.5 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.0 0.92 . . . . 2.82 110.2 169.788 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -41.08 96.21 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 121.614 -0.679 . . . . 2.99 112.733 -179.606 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -93.63 0.66 56.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.951 0.901 . . . . 3.2 112.666 -169.051 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -29.82 70.3 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 125.821 1.649 . . . . 5.72 112.501 163.856 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.475 ' CD ' HG21 ' B' ' 116' ' ' ILE . 3.2 mm-40 -74.09 8.09 2.3 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.415 1.086 . . . . 3.84 111.957 171.529 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.58 -61.16 1.55 Allowed 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.947 1.299 . . . . 4.21 109.644 174.754 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.57 11.36 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 131.417 3.887 . . . . 8.16 116.873 170.886 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.9 t -163.76 25.61 0.08 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.417 1.487 . . . . 6.02 110.687 -167.948 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.6 t -113.97 18.14 17.44 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.469 1.108 . . . . 7.5 113.673 -177.271 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.253 1.258 1 C-N-CA 132.316 4.246 . . . . 9.77 108.426 -177.494 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 105' ' ' SER . . . . . . . . . . . . . 45.3 m . . . . . 0 N--CA 1.471 0.575 0 N-CA-C 108.759 -0.83 . . . . 7.79 108.759 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -64.26 -119.91 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 108.226 -1.027 . . . . 6.88 108.226 133.105 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 107' ' ' CYS . . . . . . . . . . . . . 34.7 t -94.64 -99.37 0.15 Allowed 'General case' 0 CA--C 1.543 0.697 0 O-C-N 120.794 -1.191 . . . . 4.6 111.241 165.831 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 63.47 97.97 0.04 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 127.604 2.362 . . . . 2.42 110.28 -155.524 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 20.8 p -71.11 163.38 27.72 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.468 1.507 . . . . 1.24 111.458 -173.892 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.51 -34.73 78.95 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 117.875 -1.059 . . . . 2.98 112.621 178.857 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.09 -50.2 64.89 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.971 1.26 . . . . 0.9 109.119 172.621 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -67.51 -54.02 23.63 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.158 0.799 . . . . 2.54 113.158 -176.194 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -57.42 -30.55 65.07 Favored 'General case' 0 C--O 1.225 -0.187 0 O-C-N 120.759 -1.213 . . . . 4.44 113.215 172.313 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.868 ' HB1' ' HB1' ' A' ' 11' ' ' ALA . . . -68.36 -43.09 78.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 118.211 -0.899 . . . . 0.57 112.326 169.134 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 77.2 t -54.95 -36.12 36.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-N 120.353 1.433 . . . . 0.69 110.452 167.267 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 116' ' ' ILE . . . . . 0.475 HG21 ' CD ' ' A' ' 98' ' ' GLU 0.265 34.7 mt -60.9 -60.27 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 117.085 -1.436 . . . . 0.99 112.129 166.972 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 21.9 t -51.74 -38.56 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 121.124 1.784 . . . . 0.58 112.576 -179.685 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 9.8 mp -63.62 -36.74 84.8 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.096 -1.002 . . . . 0.94 111.895 173.424 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 119' ' ' VAL . . . . . . . . . . . . . 72.3 t -90.22 -29.55 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 117.4 -1.286 . . . . 1.0 112.456 -177.708 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 120' ' ' GLU . . . . . 0.418 ' CD ' ' HZ2' ' B' ' 124' ' ' LYS . 9.3 tm-20 -53.01 -50.44 64.21 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 121.359 1.89 . . . . 3.29 108.724 157.684 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 121' ' ' ASN . . . . . 0.511 ' HA ' ' HD2' ' B' ' 124' ' ' LYS . 26.9 t30 -65.22 -25.16 67.57 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.837 1.051 . . . . 2.16 113.837 -173.447 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -77.48 -50.13 13.29 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 120.963 -1.086 . . . . 2.45 112.242 165.369 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 123' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -64.87 -27.13 68.66 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 117.134 -1.413 . . . . 2.62 113.788 -170.148 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 124' ' ' LYS . . . . . 0.511 ' HD2' ' HA ' ' B' ' 121' ' ' ASN . 2.6 ptmt -52.63 -32.83 43.8 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 121.841 2.11 . . . . 2.01 112.911 174.792 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 125' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -73.32 -23.87 60.31 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.43 1.27 . . . . 2.42 114.43 179.252 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 126' ' ' VAL . . . . . 0.454 ' HB ' ' H ' ' B' ' 131' ' ' LEU . 31.3 m -100.7 -14.94 7.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 CA-C-N 119.067 0.849 . . . . 2.74 112.99 170.46 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 6.6 m 68.84 -53.36 0.57 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 129.759 3.224 . . . . 4.79 112.846 -172.883 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 1.7 mmtm 163.39 -33.1 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 129.056 2.943 . . . . 6.13 111.959 -160.526 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 129' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -130.78 -21.0 2.79 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.719 1.748 . . . . 7.56 115.719 -167.914 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 130' ' ' SER . . . . . . . . . . . . . 15.6 m -70.39 -44.17 68.55 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 120.882 -1.136 . . . . 6.73 111.672 -176.78 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 131' ' ' LEU . . . . . 0.454 ' H ' ' HB ' ' B' ' 126' ' ' VAL . 92.8 mt 57.9 -68.86 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 129.698 3.199 . . . . 6.88 114.378 167.301 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -160.9 -23.82 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 128.43 2.692 . . . . 3.69 111.231 179.142 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 133' ' ' LYS . . . . . 0.414 ' HE2' ' O ' ' B' ' 133' ' ' LYS . 0.0 OUTLIER -54.44 -26.57 31.66 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.23 -0.919 . . . . 8.77 113.016 161.974 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 134' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -138.66 80.82 1.81 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.753 1.263 . . . . 6.8 111.687 156.059 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.65 152.23 44.68 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 127.25 2.22 . . . . 6.66 113.085 169.081 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . 34.8 pt -76.19 -155.42 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 125.878 1.671 . . . . 2.65 113.731 179.791 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 90.3 p -108.4 142.57 38.57 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 119.446 -2.034 . . . . 3.11 107.74 153.212 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . 0.469 ' CD ' ' HB3' ' B' ' 169' ' ' LEU . 20.8 mttp -67.53 -21.96 65.45 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.054 -1.029 . . . . 2.79 110.99 179.895 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 2.9 m -50.2 -23.07 1.99 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 115.324 1.602 . . . . 2.18 115.324 162.1 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 21.7 t -70.35 -34.58 72.81 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 120.309 -1.495 . . . . 2.28 112.761 169.92 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -64.52 -44.52 90.62 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 118.299 -0.858 . . . . 2.17 112.334 178.805 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 142' ' ' ARG . . . . . . . . . . . . . 16.4 ptt85 -57.88 -34.04 69.35 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.681 1.128 . . . . 4.03 110.821 172.014 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . 0.472 ' HA ' ' HG2' ' B' ' 146' ' ' GLN . 6.2 tt0 -86.75 -38.55 16.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 113.977 1.103 . . . . 2.99 113.977 -169.144 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 144' ' ' MET . . . . . . . . . . . . . 1.6 tmm? -62.31 -37.58 86.1 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.856 -0.528 . . . . 1.19 110.941 165.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 12.6 mt -64.81 -41.67 95.6 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 120.658 -1.276 . . . . 1.08 113.844 169.778 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 146' ' ' GLN . . . . . 0.5 ' HB2' ' HE ' ' B' ' 159' ' ' ARG . 14.3 pt20 -73.71 -19.91 60.68 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 114.05 1.13 . . . . 3.18 114.05 -175.665 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 1.2 mppt? -91.29 -68.54 0.79 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.826 2.05 . . . . 2.37 113.005 168.954 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -65.96 -27.22 68.0 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.655 1.57 . . . . 3.64 113.792 -167.233 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.25 6.1 42.79 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.245 1.018 . . . . 2.34 112.87 -179.817 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -52.09 -36.68 51.57 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 115.773 1.768 . . . . 2.47 115.773 -160.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 151' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -67.25 -53.02 33.83 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.11 0.868 . . . . 1.89 112.699 -168.318 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 152' ' ' MET . . . . . . . . . . . . . 38.0 mtm -73.2 -23.81 60.45 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 114.414 1.264 . . . . 2.95 114.414 173.565 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 8.8 tt -50.76 -38.09 45.92 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-O 118.141 -0.933 . . . . 5.65 112.823 -160.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 50.2 m 81.58 102.81 0.06 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.235 1.814 . . . . 5.15 112.28 172.237 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 14.1 t70 69.8 -173.43 0.18 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.541 1.536 . . . . 4.62 114.5 165.32 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 156' ' ' THR . . . . . . . . . . . . . 62.2 m -73.23 -38.61 65.97 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.939 1.696 . . . . 2.61 110.0 162.579 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 157' ' ' GLY . . . . . . . . . . . . . . . -56.49 -45.71 89.12 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.407 1.003 . . . . 1.97 113.742 -172.692 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -72.66 -20.01 61.33 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 118.813 1.306 . . . . 4.64 112.71 178.909 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 159' ' ' ARG . . . . . 0.5 ' HE ' ' HB2' ' B' ' 146' ' ' GLN . 38.7 mtt85 -70.4 -38.06 74.58 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 120.057 -1.652 . . . . 7.37 112.83 167.652 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -61.97 -37.64 85.56 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 121.174 -0.954 . . . . 4.43 111.26 169.596 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 161' ' ' ALA . . . . . 0.47 ' HA ' ' HE3' ' B' ' 164' ' ' LYS . . . -60.5 -38.49 84.48 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 117.668 -1.158 . . . . 1.31 113.602 170.428 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 162' ' ' ALA . . . . . . . . . . . . . . . -58.12 -48.05 81.41 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.454 1.025 . . . . 0.82 111.84 168.6 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 163' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -61.67 -32.87 73.07 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 114.062 1.134 . . . . 2.3 114.062 -177.681 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 164' ' ' LYS . . . . . 0.47 ' HE3' ' HA ' ' B' ' 161' ' ' ALA . 8.2 mtmp? -46.64 -44.63 18.57 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-O 123.131 1.443 . . . . 3.18 113.206 171.777 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 5.6 mt -72.8 -39.7 66.47 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.199 -1.819 . . . . 1.15 111.274 -170.386 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 26.1 mm -53.66 -55.16 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 126.096 1.758 . . . . 1.42 109.651 178.437 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -66.48 -38.4 87.22 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.254 1.022 . . . . 2.76 112.832 -179.262 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 168' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -57.57 -15.05 6.23 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.625 1.17 . . . . 3.54 113.939 169.19 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 169' ' ' LEU . . . . . 0.469 ' HB3' ' CD ' ' B' ' 138' ' ' LYS . 3.4 mm? -108.63 -38.93 5.53 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.686 1.194 . . . . 2.08 113.346 170.046 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -77.82 -25.57 48.92 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 119.443 -2.036 . . . . 3.93 113.787 -177.674 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.32 -20.13 44.99 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.723 1.147 . . . . 3.75 113.782 176.09 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 172' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -159.82 20.79 0.17 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.083 1.512 . . . . 4.94 115.083 -161.407 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 173' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.44 15.35 4.51 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 120.597 -1.314 . . . . 5.2 113.915 171.922 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 174' ' ' ASP . . . . . . . . . . . . . 14.3 t70 60.56 -155.05 0.36 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.701 1.6 . . . . 3.9 110.649 177.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 175' ' ' GLY . . . . . . . . . . . . . . . -94.09 15.95 62.03 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 120.278 -1.513 . . . . 2.39 112.857 165.609 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 176' ' ' ARG . . . . . . . . . . . . . 53.6 mmt-85 -78.02 51.41 0.97 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.099 1.45 . . . . 4.8 112.39 -177.696 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 177' ' ' ILE . . . . . 0.402 HG12 ' HE3' ' B' ' 138' ' ' LYS . 39.7 mt -58.04 127.71 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.212 1.005 . . . . 2.82 110.316 -175.394 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 178' ' ' SER . . . . . . . . . . . . . 75.3 m -113.23 168.57 9.61 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 114.141 1.163 . . . . 2.11 114.141 -173.21 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 179' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -63.38 -58.49 6.93 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.01 1.324 . . . . 1.87 111.13 170.695 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -67.92 -22.45 65.06 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 127.246 2.219 . . . . 3.53 111.482 -172.134 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 181' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -57.6 -58.72 7.09 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 125.56 1.544 . . . . 3.27 110.882 169.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 182' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -50.46 -50.44 52.35 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.971 -0.456 . . . . 2.24 110.824 179.418 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . 33.3 t-105 -62.82 -46.39 88.15 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.396 0.679 . . . . 0.56 112.762 -179.672 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 184' ' ' THR . . . . . . . . . . . . . 1.1 t -68.77 -33.89 74.64 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 118.638 0.654 . . . . 1.44 111.387 -178.68 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 75.9 mt -61.69 -43.07 99.57 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 117.449 -1.262 . . . . 0.69 112.143 172.065 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . 46.8 mm -48.39 -43.19 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 CA-C-N 121.077 1.762 . . . . 0.71 112.122 -179.253 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . -61.89 -19.06 58.3 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.179 0.895 . . . . 0.66 114.311 -179.981 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . -76.78 -4.85 82.9 Favored Glycine 0 CA--C 1.534 1.241 0 O-C-N 120.776 -1.426 . . . . 0.94 114.274 174.775 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -123.17 -45.28 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 125.851 1.66 . . . . 0.86 110.188 170.686 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 190' ' ' THR . . . . . . . . . . . . . 92.6 m -74.64 71.91 1.93 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.983 1.713 . . . . 1.52 107.739 165.574 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 191' ' ' GLY . . . . . . . . . . . . . . . -144.43 -78.35 0.04 OUTLIER Glycine 0 CA--C 1.529 0.926 0 C-N-CA 125.535 1.54 . . . . 0.87 111.14 178.668 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -63.77 -32.29 67.71 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.344 2.696 . . . . 1.02 113.684 -176.894 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 193' ' ' ILE . . . . . . . . . . . . . 6.4 pt -78.38 -3.13 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 114.306 1.224 . . . . 1.11 114.306 178.846 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -35.61 -64.83 0.27 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 127.704 2.402 . . . . 2.22 115.516 -176.889 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -57.64 -33.41 68.25 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.616 -1.303 . . . . 4.87 113.202 177.101 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 196' ' ' LEU . . . . . . . . . . . . . 10.4 tt -70.15 -41.36 73.94 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 117.991 -1.004 . . . . 2.83 110.468 177.487 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 197' ' ' ILE . . . . . . . . . . . . . 83.9 mt -52.58 -50.27 41.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 119.15 0.887 . . . . 2.79 110.71 172.181 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 198' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -61.28 -47.1 87.55 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.964 0.906 . . . . 2.96 113.301 175.019 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 199' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -92.44 2.44 56.66 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 120.713 -1.242 . . . . 3.36 113.257 -169.074 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 200' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -22.37 61.06 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.636 1.574 . . . . 5.12 113.301 161.571 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -87.88 15.31 7.29 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 123.784 1.754 . . . . 3.28 111.152 172.891 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 202' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -121.75 -67.99 0.93 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.04 1.336 . . . . 4.05 109.062 168.118 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.52 13.34 0.2 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 129.243 3.017 . . . . 8.03 116.873 165.012 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 204' ' ' SER . . . . . . . . . . . . . 45.9 t -170.92 24.01 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.088 1.755 . . . . 6.25 110.574 -166.336 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 205' ' ' SER . . . . . . . . . . . . . 31.1 t -108.19 7.94 27.71 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.882 1.273 . . . . 7.87 112.857 -178.647 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 42.7 t . . . . . 0 C--O 1.256 1.41 1 C-N-CA 131.892 4.077 . . . . 9.74 108.624 -165.604 . . . . . . . . 1 1 . 1 stop_ save_